# Electronic Supplementary Material (ESI) for Chemical Science.
# This journal is © The Royal Society of Chemistry 2019

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_I
_database_code_depnum_ccdc_archive 'CCDC 1868211'
loop_
_audit_author_name
_audit_author_address
'Oliver Janka'
;WWU Muenster
Germany
;
_audit_update_record             
;
2019-04-17 deposited with the CCDC.	2019-10-14 downloaded from the CCDC.
;
#=======================================================================

# 5. CHEMICAL DATA

_chemical_name_systematic        
; ?
;
_chemical_name_common            ?
_chemical_formula_moiety         ?
_chemical_formula_structural     ?
_chemical_formula_analytical     ?
_chemical_formula_iupac          ?
_chemical_formula_sum            'Al3 Ca1 Pd2'
_chemical_formula_weight         333.8
_chemical_melting_point          ?
_chemical_compound_source        ?
_chemical_absolute_configuration .

#=======================================================================

# 6. CRYSTAL DATA

_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_H-M   'P 6/m m m'
_symmetry_space_group_name_Hall  '-P 6;-2'
_symmetry_Int_Tables_number      191

loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -y,x-y,z
3 -x+y,-x,z
4 -x,-y,z
5 y,-x+y,z
6 x-y,x,z
7 y,x,-z
8 x-y,-y,-z
9 -x,-x+y,-z
10 -y,-x,-z
11 -x+y,y,-z
12 x,x-y,-z
13 -x,-y,-z
14 y,-x+y,-z
15 x-y,x,-z
16 x,y,-z
17 -y,x-y,-z
18 -x+y,-x,-z
19 -y,-x,z
20 -x+y,y,z
21 x,x-y,z
22 y,x,z
23 x-y,-y,z
24 -x,-x+y,z

_cell_length_a                   9.3628(6)
_cell_length_b                   9.3628(3)
_cell_length_c                   4.2396
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_volume                     321.86(2)

loop_
_twin_individual_id
_twin_individual_mass_fraction_refined
_twin_individual_twin_matrix_11
_twin_individual_twin_matrix_12
_twin_individual_twin_matrix_13
_twin_individual_twin_matrix_21
_twin_individual_twin_matrix_22
_twin_individual_twin_matrix_23
_twin_individual_twin_matrix_31
_twin_individual_twin_matrix_32
_twin_individual_twin_matrix_33
? ? ? ? ? ? ? ? ? ? ?

_cell_formula_units_Z            3

_cell_measurement_reflns_used    7006
_cell_measurement_theta_min      2.51
_cell_measurement_theta_max      33.52
_cell_measurement_temperature    293
_cell_special_details            
; ?
;

_exptl_crystal_density_diffrn    5.17
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_F_000             453

_exptl_absorpt_coefficient_mu    10.0
_exptl_crystal_description       block
_exptl_crystal_size_max          0.040
_exptl_crystal_size_mid          0.035
_exptl_crystal_size_min          0.030
_exptl_crystal_size_rad          ?
_exptl_crystal_colour            silver
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   ?
_exptl_absorpt_correction_T_min  0.6748
_exptl_absorpt_correction_T_max  0.8119
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
? ? ? ?

#=======================================================================

# 7. EXPERIMENTAL DATA

_exptl_special_details           ?

_diffrn_ambient_temperature      293
_diffrn_source                   ?
_diffrn_source_power             ?
_diffrn_source_voltage           ?
_diffrn_source_current           ?
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_source         'X-ray tube'
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'IPDS Stoe'
_diffrn_detector                 ?
_diffrn_detector_area_resol_mean ?
_diffrn_measurement_method       '??integration method??'
_diffrn_measurement_specimen_support ?

_diffrn_reflns_number            5818
_diffrn_reflns_theta_min         2.51
_diffrn_reflns_theta_max         33.31
_diffrn_reflns_theta_full        33.31
_diffrn_measured_fraction_theta_max 0.99
_diffrn_measured_fraction_theta_full 0.99
_diffrn_reflns_av_R_equivalents  0.022
_diffrn_reflns_av_unetI/netI     0.0038
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_l_min       -6
_diffrn_reflns_limit_l_max       5
_diffrn_reflns_reduction_process ?

_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
loop_
_diffrn_standard_refln_index_h
_diffrn_standard_refln_index_k
_diffrn_standard_refln_index_l
? ? ?

_diffrn_radiation_probe          X-ray

#=======================================================================

# 8. REFINEMENT DATA

_refine_special_details          
; ?
;

_reflns_number_total             288
_reflns_number_gt                258
_reflns_threshold_expression     I>3σ(I)

_refine_ls_structure_factor_coef Fsqd
_refine_ls_R_factor_gt           0.0069
_refine_ls_wR_factor_gt          0.0186
_refine_ls_R_factor_all          0.0098
_refine_ls_wR_factor_ref         0.0200
_refine_ls_goodness_of_fit_ref   0.84
_refine_ls_goodness_of_fit_gt    0.83
_refine_ls_restrained_S_gt       ?
_refine_ls_restrained_S_all      ?
_refine_ls_number_reflns         288
_refine_ls_number_parameters     17
_refine_ls_number_restraints     0
_refine_ls_number_constraints    0
_refine_ls_weighting_scheme      sigma
_refine_ls_weighting_details     w=1/(σ²(I)+0.0004I²)
_refine_ls_hydrogen_treatment    ?
_refine_ls_shift/su_max          0.0007
_refine_ls_shift/su_mean         0.0001
_refine_diff_density_max         0.45
_refine_diff_density_min         -0.41
_refine_ls_extinction_method     
'B-C type 1 Lorentzian isotropic (Becker & Coppens, 1974)'
_refine_ls_extinction_coef       750(30)
_refine_ls_abs_structure_details ?
_refine_ls_abs_structure_Flack   ?
_refine_ls_abs_structure_Rogers  ?

loop_
_atom_type_symbol
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Al 0.0645 0.0514 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Ca 0.2262 0.3064 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Pd -0.9988 1.0072 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    ?
_computing_structure_refinement  ?
_computing_molecular_graphics    ?
_computing_publication_material  ?

loop_
_restr_distance_atom_site_label_1
_restr_distance_site_symmetry_1
_restr_distance_atom_site_label_2
_restr_distance_site_symmetry_2
_restr_distance_target
_restr_distance_target_weight_param
? ? ? ? ? ?

loop_
_restr_angle_atom_site_label_1
_restr_angle_site_symmetry_1
_restr_angle_atom_site_label_2
_restr_angle_site_symmetry_2
_restr_angle_atom_site_label_3
_restr_angle_site_symmetry_3
_restr_angle_target
_restr_angle_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_torsion_atom_site_label_1
_restr_torsion_site_symmetry_1
_restr_torsion_atom_site_label_2
_restr_torsion_site_symmetry_2
_restr_torsion_atom_site_label_3
_restr_torsion_site_symmetry_3
_restr_torsion_atom_site_label_4
_restr_torsion_site_symmetry_4
_restr_torsion_angle_target
_restr_torsion_weight_param
? ? ? ? ? ? ? ? ? ?

loop_
_restr_equal_distance_atom_site_label_1
_restr_equal_distance_site_symmetry_1
_restr_equal_distance_atom_site_label_2
_restr_equal_distance_site_symmetry_2
_restr_equal_distance_class_class_id
_restr_equal_distance_class_target_weight_param
? ? ? ? ? ?

loop_
_restr_equal_angle_atom_site_label_1
_restr_equal_angle_site_symmetry_1
_restr_equal_angle_atom_site_label_2
_restr_equal_angle_site_symmetry_2
_restr_equal_angle_atom_site_label_3
_restr_equal_angle_site_symmetry_3
_restr_equal_angle_class_class_id
_restr_equal_angle_class_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_equal_torsion_atom_site_label_1
_restr_equal_torsion_site_symmetry_1
_restr_equal_torsion_atom_site_label_2
_restr_equal_torsion_site_symmetry_2
_restr_equal_torsion_atom_site_label_3
_restr_equal_torsion_site_symmetry_3
_restr_equal_torsion_atom_site_label_4
_restr_equal_torsion_site_symmetry_4
_restr_equal_torsion_class_class_id
_restr_equal_torsion_class_target_weight_param
? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 9. ATOMIC COORDINATES AND DISPLACEMENT PARAMETERS

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_adp_type
_atom_site_U_iso_or_equiv
_atom_site_site_symmetry_multiplicity
_atom_site_occupancy
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ca1 Ca 0.333333 0.666667 0.5 Uani 0.00838(12) 2 1 d . . .
Ca2 Ca 0 0 0 Uani 0.01039(18) 1 1 d . . .
Pd Pd 0.183557(7) 0.367115(15) 0 Uani 0.00675(5) 6 1 d . . .
Al1 Al 0.30197(6) 0 0.5 Uani 0.00811(14) 6 1 d . . .
Al2 Al 0.5 0 0 Uani 0.00779(19) 3 1 d . . .


loop_
_jana_atom_site_ADP_C_label
_jana_atom_site_ADP_C_type_symbol
_jana_atom_site_ADP_C_111
_jana_atom_site_ADP_C_112
_jana_atom_site_ADP_C_113
_jana_atom_site_ADP_C_122
_jana_atom_site_ADP_C_123
_jana_atom_site_ADP_C_133
_jana_atom_site_ADP_C_222
_jana_atom_site_ADP_C_223
_jana_atom_site_ADP_C_233
_jana_atom_site_ADP_C_333
? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_D_label
_jana_atom_site_ADP_D_type_symbol
_jana_atom_site_ADP_D_1111
_jana_atom_site_ADP_D_1112
_jana_atom_site_ADP_D_1113
_jana_atom_site_ADP_D_1122
_jana_atom_site_ADP_D_1123
_jana_atom_site_ADP_D_1133
_jana_atom_site_ADP_D_1222
_jana_atom_site_ADP_D_1223
_jana_atom_site_ADP_D_1233
_jana_atom_site_ADP_D_1333
_jana_atom_site_ADP_D_2222
_jana_atom_site_ADP_D_2223
_jana_atom_site_ADP_D_2233
_jana_atom_site_ADP_D_2333
_jana_atom_site_ADP_D_3333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_E_label
_jana_atom_site_ADP_E_type_symbol
_jana_atom_site_ADP_E_11111
_jana_atom_site_ADP_E_11112
_jana_atom_site_ADP_E_11113
_jana_atom_site_ADP_E_11122
_jana_atom_site_ADP_E_11123
_jana_atom_site_ADP_E_11133
_jana_atom_site_ADP_E_11222
_jana_atom_site_ADP_E_11223
_jana_atom_site_ADP_E_11233
_jana_atom_site_ADP_E_11333
_jana_atom_site_ADP_E_12222
_jana_atom_site_ADP_E_12223
_jana_atom_site_ADP_E_12233
_jana_atom_site_ADP_E_12333
_jana_atom_site_ADP_E_13333
_jana_atom_site_ADP_E_22222
_jana_atom_site_ADP_E_22223
_jana_atom_site_ADP_E_22233
_jana_atom_site_ADP_E_22333
_jana_atom_site_ADP_E_23333
_jana_atom_site_ADP_E_33333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_F_label
_jana_atom_site_ADP_F_type_symbol
_jana_atom_site_ADP_F_111111
_jana_atom_site_ADP_F_111112
_jana_atom_site_ADP_F_111113
_jana_atom_site_ADP_F_111122
_jana_atom_site_ADP_F_111123
_jana_atom_site_ADP_F_111133
_jana_atom_site_ADP_F_111222
_jana_atom_site_ADP_F_111223
_jana_atom_site_ADP_F_111233
_jana_atom_site_ADP_F_111333
_jana_atom_site_ADP_F_112222
_jana_atom_site_ADP_F_112223
_jana_atom_site_ADP_F_112233
_jana_atom_site_ADP_F_112333
_jana_atom_site_ADP_F_113333
_jana_atom_site_ADP_F_122222
_jana_atom_site_ADP_F_122223
_jana_atom_site_ADP_F_122233
_jana_atom_site_ADP_F_122333
_jana_atom_site_ADP_F_123333
_jana_atom_site_ADP_F_133333
_jana_atom_site_ADP_F_222222
_jana_atom_site_ADP_F_222223
_jana_atom_site_ADP_F_222233
_jana_atom_site_ADP_F_222333
_jana_atom_site_ADP_F_223333
_jana_atom_site_ADP_F_233333
_jana_atom_site_ADP_F_333333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 10. MOLECULAR GEOMETRY


loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Ca1 Pd . . 3.2238(2) ?
Ca1 Pd . 1_556 3.2238(2) ?
Ca1 Pd . 2_665 3.2238(3) ?
Ca1 Pd . 2_666 3.2238(3) ?
Ca1 Pd . 3_565 3.22382(14) ?
Ca1 Pd . 3_566 3.22382(14) ?
Ca1 Al1 . 1_565 3.2776(4) ?
Ca1 Al1 . 2_555 3.2776(6) ?
Ca1 Al1 . 3_665 3.2776(8) ?
Ca1 Al1 . 4_665 3.2776(6) ?
Ca1 Al1 . 5_565 3.2776(5) ?
Ca1 Al1 . 6_555 3.2776(7) ?
Ca1 Al2 . 1_565 3.4349(2) ?
Ca1 Al2 . 1_566 3.4349(2) ?
Ca1 Al2 . 2_555 3.4349(4) ?
Ca1 Al2 . 2_556 3.4349(4) ?
Ca1 Al2 . 3_665 3.43493(11) ?
Ca1 Al2 . 3_666 3.43493(11) ?
Ca2 Pd . . 2.9767(3) ?
Ca2 Pd . 2_555 2.9767(5) ?
Ca2 Pd . 3_555 2.9767(2) ?
Ca2 Pd . 4_555 2.9767(3) ?
Ca2 Pd . 5_555 2.9767(5) ?
Ca2 Pd . 6_555 2.9767(2) ?
Ca2 Al1 . 1_554 3.5337(5) ?
Ca2 Al1 . . 3.5337(5) ?
Ca2 Al1 . 2_554 3.5337(5) ?
Ca2 Al1 . 2_555 3.5337(5) ?
Ca2 Al1 . 3_554 3.5337(5) ?
Ca2 Al1 . 3_555 3.5337(5) ?
Ca2 Al1 . 4_554 3.5337(5) ?
Ca2 Al1 . 4_555 3.5337(5) ?
Ca2 Al1 . 5_554 3.5337(5) ?
Ca2 Al1 . 5_555 3.5337(5) ?
Ca2 Al1 . 6_554 3.5337(5) ?
Ca2 Al1 . 6_555 3.5337(5) ?
Pd Pd . 5_555 2.9767(3) ?
Pd Pd . 6_555 2.9767(5) ?
Pd Al1 . 2_554 2.60211(16) ?
Pd Al1 . 2_555 2.60211(16) ?
Pd Al1 . 6_554 2.6021(4) ?
Pd Al1 . 6_555 2.6021(4) ?
Pd Al2 . 2_555 2.5768(2) ?
Pd Al2 . 3_665 2.5768(4) ?
Al1 Al1 . 4_655 3.7082(9) ?
Al1 Al1 . 5_555 2.8273(6) ?
Al1 Al1 . 6_555 2.8273(7) ?
Al1 Al2 . . 2.8163(4) ?
Al1 Al2 . 1_556 2.8163(4) ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
Pd Ca1 Pd . . 1_556 82.225(4) ?
Pd Ca1 Pd . . 2_665 81.458(5) ?
Pd Ca1 Pd . . 2_666 135.740(4) ?
Pd Ca1 Pd . . 3_565 81.458(3) ?
Pd Ca1 Pd . . 3_566 135.740(4) ?
Pd Ca1 Al1 . . 1_565 128.410(5) ?
Pd Ca1 Al1 . . 2_555 47.177(4) ?
Pd Ca1 Al1 . . 3_665 93.351(8) ?
Pd Ca1 Al1 . . 4_665 128.410(5) ?
Pd Ca1 Al1 . . 5_565 93.351(7) ?
Pd Ca1 Al1 . . 6_555 47.177(5) ?
Pd Ca1 Al2 . . 1_565 100.780(3) ?
Pd Ca1 Al2 . . 1_566 176.9943(14) ?
Pd Ca1 Al2 . . 2_555 45.396(3) ?
Pd Ca1 Al2 . . 2_556 96.279(4) ?
Pd Ca1 Al2 . . 3_665 45.396(4) ?
Pd Ca1 Al2 . . 3_666 96.279(3) ?
Pd Ca1 Pd 1_556 . 2_665 135.740(4) ?
Pd Ca1 Pd 1_556 . 2_666 81.458(5) ?
Pd Ca1 Pd 1_556 . 3_565 135.740(4) ?
Pd Ca1 Pd 1_556 . 3_566 81.458(3) ?
Pd Ca1 Al1 1_556 . 1_565 128.410(5) ?
Pd Ca1 Al1 1_556 . 2_555 47.177(4) ?
Pd Ca1 Al1 1_556 . 3_665 93.351(8) ?
Pd Ca1 Al1 1_556 . 4_665 128.410(5) ?
Pd Ca1 Al1 1_556 . 5_565 93.351(7) ?
Pd Ca1 Al1 1_556 . 6_555 47.177(5) ?
Pd Ca1 Al2 1_556 . 1_565 176.9943(14) ?
Pd Ca1 Al2 1_556 . 1_566 100.780(3) ?
Pd Ca1 Al2 1_556 . 2_555 96.279(4) ?
Pd Ca1 Al2 1_556 . 2_556 45.396(3) ?
Pd Ca1 Al2 1_556 . 3_665 96.279(3) ?
Pd Ca1 Al2 1_556 . 3_666 45.396(4) ?
Pd Ca1 Pd 2_665 . 2_666 82.225(5) ?
Pd Ca1 Pd 2_665 . 3_565 81.458(5) ?
Pd Ca1 Pd 2_665 . 3_566 135.740(4) ?
Pd Ca1 Al1 2_665 . 1_565 93.351(7) ?
Pd Ca1 Al1 2_665 . 2_555 128.410(6) ?
Pd Ca1 Al1 2_665 . 3_665 47.177(6) ?
Pd Ca1 Al1 2_665 . 4_665 47.177(5) ?
Pd Ca1 Al1 2_665 . 5_565 128.410(6) ?
Pd Ca1 Al1 2_665 . 6_555 93.351(8) ?
Pd Ca1 Al2 2_665 . 1_565 45.396(3) ?
Pd Ca1 Al2 2_665 . 1_566 96.279(5) ?
Pd Ca1 Al2 2_665 . 2_555 100.780(5) ?
Pd Ca1 Al2 2_665 . 2_556 176.9944(14) ?
Pd Ca1 Al2 2_665 . 3_665 45.396(4) ?
Pd Ca1 Al2 2_665 . 3_666 96.279(4) ?
Pd Ca1 Pd 2_666 . 3_565 135.740(4) ?
Pd Ca1 Pd 2_666 . 3_566 81.458(5) ?
Pd Ca1 Al1 2_666 . 1_565 93.351(7) ?
Pd Ca1 Al1 2_666 . 2_555 128.410(6) ?
Pd Ca1 Al1 2_666 . 3_665 47.177(6) ?
Pd Ca1 Al1 2_666 . 4_665 47.177(5) ?
Pd Ca1 Al1 2_666 . 5_565 128.410(6) ?
Pd Ca1 Al1 2_666 . 6_555 93.351(8) ?
Pd Ca1 Al2 2_666 . 1_565 96.279(5) ?
Pd Ca1 Al2 2_666 . 1_566 45.396(3) ?
Pd Ca1 Al2 2_666 . 2_555 176.9944(14) ?
Pd Ca1 Al2 2_666 . 2_556 100.780(5) ?
Pd Ca1 Al2 2_666 . 3_665 96.279(4) ?
Pd Ca1 Al2 2_666 . 3_666 45.396(4) ?
Pd Ca1 Pd 3_565 . 3_566 82.225(3) ?
Pd Ca1 Al1 3_565 . 1_565 47.177(4) ?
Pd Ca1 Al1 3_565 . 2_555 93.351(7) ?
Pd Ca1 Al1 3_565 . 3_665 128.410(5) ?
Pd Ca1 Al1 3_565 . 4_665 93.351(7) ?
Pd Ca1 Al1 3_565 . 5_565 47.177(4) ?
Pd Ca1 Al1 3_565 . 6_555 128.410(5) ?
Pd Ca1 Al2 3_565 . 1_565 45.396(4) ?
Pd Ca1 Al2 3_565 . 1_566 96.279(2) ?
Pd Ca1 Al2 3_565 . 2_555 45.396(3) ?
Pd Ca1 Al2 3_565 . 2_556 96.279(4) ?
Pd Ca1 Al2 3_565 . 3_665 100.780(2) ?
Pd Ca1 Al2 3_565 . 3_666 176.9942(17) ?
Pd Ca1 Al1 3_566 . 1_565 47.177(4) ?
Pd Ca1 Al1 3_566 . 2_555 93.351(7) ?
Pd Ca1 Al1 3_566 . 3_665 128.410(5) ?
Pd Ca1 Al1 3_566 . 4_665 93.351(7) ?
Pd Ca1 Al1 3_566 . 5_565 47.177(4) ?
Pd Ca1 Al1 3_566 . 6_555 128.410(5) ?
Pd Ca1 Al2 3_566 . 1_565 96.279(2) ?
Pd Ca1 Al2 3_566 . 1_566 45.396(4) ?
Pd Ca1 Al2 3_566 . 2_555 96.279(4) ?
Pd Ca1 Al2 3_566 . 2_556 45.396(3) ?
Pd Ca1 Al2 3_566 . 3_665 176.9942(17) ?
Pd Ca1 Al2 3_566 . 3_666 100.780(2) ?
Al1 Ca1 Al1 1_565 . 2_555 120.000(12) ?
Al1 Ca1 Al1 1_565 . 3_665 120.000(12) ?
Al1 Ca1 Al1 1_565 . 4_665 68.900(12) ?
Al1 Ca1 Al1 1_565 . 5_565 51.100(12) ?
Al1 Ca1 Al1 1_565 . 6_555 171.100(12) ?
Al1 Ca1 Al2 1_565 . 1_565 49.544(5) ?
Al1 Ca1 Al2 1_565 . 1_566 49.544(5) ?
Al1 Ca1 Al2 1_565 . 2_555 86.500(7) ?
Al1 Ca1 Al2 1_565 . 2_556 86.500(7) ?
Al1 Ca1 Al2 1_565 . 3_665 135.228(4) ?
Al1 Ca1 Al2 1_565 . 3_666 135.228(4) ?
Al1 Ca1 Al1 2_555 . 3_665 120.000(13) ?
Al1 Ca1 Al1 2_555 . 4_665 171.100(12) ?
Al1 Ca1 Al1 2_555 . 5_565 68.900(13) ?
Al1 Ca1 Al1 2_555 . 6_555 51.100(12) ?
Al1 Ca1 Al2 2_555 . 1_565 135.228(4) ?
Al1 Ca1 Al2 2_555 . 1_566 135.228(4) ?
Al1 Ca1 Al2 2_555 . 2_555 49.544(6) ?
Al1 Ca1 Al2 2_555 . 2_556 49.544(6) ?
Al1 Ca1 Al2 2_555 . 3_665 86.500(8) ?
Al1 Ca1 Al2 2_555 . 3_666 86.500(8) ?
Al1 Ca1 Al1 3_665 . 4_665 51.100(13) ?
Al1 Ca1 Al1 3_665 . 5_565 171.100(12) ?
Al1 Ca1 Al1 3_665 . 6_555 68.900(13) ?
Al1 Ca1 Al2 3_665 . 1_565 86.500(8) ?
Al1 Ca1 Al2 3_665 . 1_566 86.500(8) ?
Al1 Ca1 Al2 3_665 . 2_555 135.228(5) ?
Al1 Ca1 Al2 3_665 . 2_556 135.228(5) ?
Al1 Ca1 Al2 3_665 . 3_665 49.544(5) ?
Al1 Ca1 Al2 3_665 . 3_666 49.544(5) ?
Al1 Ca1 Al1 4_665 . 5_565 120.000(12) ?
Al1 Ca1 Al1 4_665 . 6_555 120.000(12) ?
Al1 Ca1 Al2 4_665 . 1_565 49.544(5) ?
Al1 Ca1 Al2 4_665 . 1_566 49.544(5) ?
Al1 Ca1 Al2 4_665 . 2_555 135.228(5) ?
Al1 Ca1 Al2 4_665 . 2_556 135.228(5) ?
Al1 Ca1 Al2 4_665 . 3_665 86.500(7) ?
Al1 Ca1 Al2 4_665 . 3_666 86.500(7) ?
Al1 Ca1 Al1 5_565 . 6_555 120.000(13) ?
Al1 Ca1 Al2 5_565 . 1_565 86.500(7) ?
Al1 Ca1 Al2 5_565 . 1_566 86.500(7) ?
Al1 Ca1 Al2 5_565 . 2_555 49.544(6) ?
Al1 Ca1 Al2 5_565 . 2_556 49.544(6) ?
Al1 Ca1 Al2 5_565 . 3_665 135.228(4) ?
Al1 Ca1 Al2 5_565 . 3_666 135.228(4) ?
Al1 Ca1 Al2 6_555 . 1_565 135.228(5) ?
Al1 Ca1 Al2 6_555 . 1_566 135.228(5) ?
Al1 Ca1 Al2 6_555 . 2_555 86.500(7) ?
Al1 Ca1 Al2 6_555 . 2_556 86.500(7) ?
Al1 Ca1 Al2 6_555 . 3_665 49.544(5) ?
Al1 Ca1 Al2 6_555 . 3_666 49.544(5) ?
Al2 Ca1 Al2 1_565 . 1_566 76.214(3) ?
Al2 Ca1 Al2 1_565 . 2_555 85.913(4) ?
Al2 Ca1 Al2 1_565 . 2_556 133.6640(17) ?
Al2 Ca1 Al2 1_565 . 3_665 85.913(2) ?
Al2 Ca1 Al2 1_565 . 3_666 133.664(4) ?
Al2 Ca1 Al2 1_566 . 2_555 133.6640(17) ?
Al2 Ca1 Al2 1_566 . 2_556 85.913(4) ?
Al2 Ca1 Al2 1_566 . 3_665 133.664(4) ?
Al2 Ca1 Al2 1_566 . 3_666 85.913(2) ?
Al2 Ca1 Al2 2_555 . 2_556 76.214(5) ?
Al2 Ca1 Al2 2_555 . 3_665 85.913(4) ?
Al2 Ca1 Al2 2_555 . 3_666 133.664(2) ?
Al2 Ca1 Al2 2_556 . 3_665 133.664(2) ?
Al2 Ca1 Al2 2_556 . 3_666 85.913(4) ?
Al2 Ca1 Al2 3_665 . 3_666 76.2138(14) ?
Pd Ca2 Pd . . 2_555 120.000(5) ?
Pd Ca2 Pd . . 3_555 120.000(5) ?
Pd Ca2 Pd . . 4_555 180.0(5) ?
Pd Ca2 Pd . . 5_555 60.000(5) ?
Pd Ca2 Pd . . 6_555 60.000(5) ?
Pd Ca2 Al1 . . 1_554 90.000(4) ?
Pd Ca2 Al1 . . . 90.000(4) ?
Pd Ca2 Al1 . . 2_554 46.140(5) ?
Pd Ca2 Al1 . . 2_555 46.140(5) ?
Pd Ca2 Al1 . . 3_554 133.860(9) ?
Pd Ca2 Al1 . . 3_555 133.860(9) ?
Pd Ca2 Al1 . . 4_554 90.000(4) ?
Pd Ca2 Al1 . . 4_555 90.000(4) ?
Pd Ca2 Al1 . . 5_554 133.860(5) ?
Pd Ca2 Al1 . . 5_555 133.860(5) ?
Pd Ca2 Al1 . . 6_554 46.140(9) ?
Pd Ca2 Al1 . . 6_555 46.140(9) ?
Pd Ca2 Pd 2_555 . 3_555 120.000(5) ?
Pd Ca2 Pd 2_555 . 4_555 60.000(5) ?
Pd Ca2 Pd 2_555 . 5_555 180.0(5) ?
Pd Ca2 Pd 2_555 . 6_555 60.000(5) ?
Pd Ca2 Al1 2_555 . 1_554 133.860(5) ?
Pd Ca2 Al1 2_555 . . 133.860(5) ?
Pd Ca2 Al1 2_555 . 2_554 90.000(4) ?
Pd Ca2 Al1 2_555 . 2_555 90.000(4) ?
Pd Ca2 Al1 2_555 . 3_554 46.140(9) ?
Pd Ca2 Al1 2_555 . 3_555 46.140(9) ?
Pd Ca2 Al1 2_555 . 4_554 46.140(5) ?
Pd Ca2 Al1 2_555 . 4_555 46.140(5) ?
Pd Ca2 Al1 2_555 . 5_554 90.000(4) ?
Pd Ca2 Al1 2_555 . 5_555 90.000(4) ?
Pd Ca2 Al1 2_555 . 6_554 133.860(9) ?
Pd Ca2 Al1 2_555 . 6_555 133.860(9) ?
Pd Ca2 Pd 3_555 . 4_555 60.000(5) ?
Pd Ca2 Pd 3_555 . 5_555 60.000(5) ?
Pd Ca2 Pd 3_555 . 6_555 180.0(5) ?
Pd Ca2 Al1 3_555 . 1_554 46.140(4) ?
Pd Ca2 Al1 3_555 . . 46.140(4) ?
Pd Ca2 Al1 3_555 . 2_554 133.860(4) ?
Pd Ca2 Al1 3_555 . 2_555 133.860(4) ?
Pd Ca2 Al1 3_555 . 3_554 90.000(12) ?
Pd Ca2 Al1 3_555 . 3_555 90.000(12) ?
Pd Ca2 Al1 3_555 . 4_554 133.860(4) ?
Pd Ca2 Al1 3_555 . 4_555 133.860(4) ?
Pd Ca2 Al1 3_555 . 5_554 46.140(4) ?
Pd Ca2 Al1 3_555 . 5_555 46.140(4) ?
Pd Ca2 Al1 3_555 . 6_554 90.000(12) ?
Pd Ca2 Al1 3_555 . 6_555 90.000(12) ?
Pd Ca2 Pd 4_555 . 5_555 120.000(5) ?
Pd Ca2 Pd 4_555 . 6_555 120.000(5) ?
Pd Ca2 Al1 4_555 . 1_554 90.000(4) ?
Pd Ca2 Al1 4_555 . . 90.000(4) ?
Pd Ca2 Al1 4_555 . 2_554 133.860(5) ?
Pd Ca2 Al1 4_555 . 2_555 133.860(5) ?
Pd Ca2 Al1 4_555 . 3_554 46.140(9) ?
Pd Ca2 Al1 4_555 . 3_555 46.140(9) ?
Pd Ca2 Al1 4_555 . 4_554 90.000(4) ?
Pd Ca2 Al1 4_555 . 4_555 90.000(4) ?
Pd Ca2 Al1 4_555 . 5_554 46.140(5) ?
Pd Ca2 Al1 4_555 . 5_555 46.140(5) ?
Pd Ca2 Al1 4_555 . 6_554 133.860(9) ?
Pd Ca2 Al1 4_555 . 6_555 133.860(9) ?
Pd Ca2 Pd 5_555 . 6_555 120.000(5) ?
Pd Ca2 Al1 5_555 . 1_554 46.140(5) ?
Pd Ca2 Al1 5_555 . . 46.140(5) ?
Pd Ca2 Al1 5_555 . 2_554 90.000(4) ?
Pd Ca2 Al1 5_555 . 2_555 90.000(4) ?
Pd Ca2 Al1 5_555 . 3_554 133.860(9) ?
Pd Ca2 Al1 5_555 . 3_555 133.860(9) ?
Pd Ca2 Al1 5_555 . 4_554 133.860(5) ?
Pd Ca2 Al1 5_555 . 4_555 133.860(5) ?
Pd Ca2 Al1 5_555 . 5_554 90.000(4) ?
Pd Ca2 Al1 5_555 . 5_555 90.000(4) ?
Pd Ca2 Al1 5_555 . 6_554 46.140(9) ?
Pd Ca2 Al1 5_555 . 6_555 46.140(9) ?
Pd Ca2 Al1 6_555 . 1_554 133.860(4) ?
Pd Ca2 Al1 6_555 . . 133.860(4) ?
Pd Ca2 Al1 6_555 . 2_554 46.140(4) ?
Pd Ca2 Al1 6_555 . 2_555 46.140(4) ?
Pd Ca2 Al1 6_555 . 3_554 90.000(12) ?
Pd Ca2 Al1 6_555 . 3_555 90.000(12) ?
Pd Ca2 Al1 6_555 . 4_554 46.140(4) ?
Pd Ca2 Al1 6_555 . 4_555 46.140(4) ?
Pd Ca2 Al1 6_555 . 5_554 133.860(4) ?
Pd Ca2 Al1 6_555 . 5_555 133.860(4) ?
Pd Ca2 Al1 6_555 . 6_554 90.000(12) ?
Pd Ca2 Al1 6_555 . 6_555 90.000(12) ?
Al1 Ca2 Al1 1_554 . . 73.723(8) ?
Al1 Ca2 Al1 1_554 . 2_554 87.720(6) ?
Al1 Ca2 Al1 1_554 . 2_555 132.838(4) ?
Al1 Ca2 Al1 1_554 . 3_554 87.720(10) ?
Al1 Ca2 Al1 1_554 . 3_555 132.838(11) ?
Al1 Ca2 Al1 1_554 . 4_554 106.277(8) ?
Al1 Ca2 Al1 1_554 . 4_555 180.0(5) ?
Al1 Ca2 Al1 1_554 . 5_554 47.162(4) ?
Al1 Ca2 Al1 1_554 . 5_555 92.280(6) ?
Al1 Ca2 Al1 1_554 . 6_554 47.162(11) ?
Al1 Ca2 Al1 1_554 . 6_555 92.280(10) ?
Al1 Ca2 Al1 . . 2_554 132.838(4) ?
Al1 Ca2 Al1 . . 2_555 87.720(6) ?
Al1 Ca2 Al1 . . 3_554 132.838(11) ?
Al1 Ca2 Al1 . . 3_555 87.720(10) ?
Al1 Ca2 Al1 . . 4_554 180.0(5) ?
Al1 Ca2 Al1 . . 4_555 106.277(8) ?
Al1 Ca2 Al1 . . 5_554 92.280(6) ?
Al1 Ca2 Al1 . . 5_555 47.162(4) ?
Al1 Ca2 Al1 . . 6_554 92.280(10) ?
Al1 Ca2 Al1 . . 6_555 47.162(11) ?
Al1 Ca2 Al1 2_554 . 2_555 73.723(8) ?
Al1 Ca2 Al1 2_554 . 3_554 87.720(10) ?
Al1 Ca2 Al1 2_554 . 3_555 132.838(11) ?
Al1 Ca2 Al1 2_554 . 4_554 47.162(4) ?
Al1 Ca2 Al1 2_554 . 4_555 92.280(6) ?
Al1 Ca2 Al1 2_554 . 5_554 106.277(8) ?
Al1 Ca2 Al1 2_554 . 5_555 180.0(5) ?
Al1 Ca2 Al1 2_554 . 6_554 47.162(11) ?
Al1 Ca2 Al1 2_554 . 6_555 92.280(10) ?
Al1 Ca2 Al1 2_555 . 3_554 132.838(11) ?
Al1 Ca2 Al1 2_555 . 3_555 87.720(10) ?
Al1 Ca2 Al1 2_555 . 4_554 92.280(6) ?
Al1 Ca2 Al1 2_555 . 4_555 47.162(4) ?
Al1 Ca2 Al1 2_555 . 5_554 180.0(5) ?
Al1 Ca2 Al1 2_555 . 5_555 106.277(8) ?
Al1 Ca2 Al1 2_555 . 6_554 92.280(10) ?
Al1 Ca2 Al1 2_555 . 6_555 47.162(11) ?
Al1 Ca2 Al1 3_554 . 3_555 73.723(7) ?
Al1 Ca2 Al1 3_554 . 4_554 47.162(11) ?
Al1 Ca2 Al1 3_554 . 4_555 92.280(10) ?
Al1 Ca2 Al1 3_554 . 5_554 47.162(11) ?
Al1 Ca2 Al1 3_554 . 5_555 92.280(10) ?
Al1 Ca2 Al1 3_554 . 6_554 106.277(7) ?
Al1 Ca2 Al1 3_554 . 6_555 180.0(5) ?
Al1 Ca2 Al1 3_555 . 4_554 92.280(10) ?
Al1 Ca2 Al1 3_555 . 4_555 47.162(11) ?
Al1 Ca2 Al1 3_555 . 5_554 92.280(10) ?
Al1 Ca2 Al1 3_555 . 5_555 47.162(11) ?
Al1 Ca2 Al1 3_555 . 6_554 180.0(5) ?
Al1 Ca2 Al1 3_555 . 6_555 106.277(7) ?
Al1 Ca2 Al1 4_554 . 4_555 73.723(8) ?
Al1 Ca2 Al1 4_554 . 5_554 87.720(6) ?
Al1 Ca2 Al1 4_554 . 5_555 132.838(4) ?
Al1 Ca2 Al1 4_554 . 6_554 87.720(10) ?
Al1 Ca2 Al1 4_554 . 6_555 132.838(11) ?
Al1 Ca2 Al1 4_555 . 5_554 132.838(4) ?
Al1 Ca2 Al1 4_555 . 5_555 87.720(6) ?
Al1 Ca2 Al1 4_555 . 6_554 132.838(11) ?
Al1 Ca2 Al1 4_555 . 6_555 87.720(10) ?
Al1 Ca2 Al1 5_554 . 5_555 73.723(8) ?
Al1 Ca2 Al1 5_554 . 6_554 87.720(10) ?
Al1 Ca2 Al1 5_554 . 6_555 132.838(11) ?
Al1 Ca2 Al1 5_555 . 6_554 132.838(11) ?
Al1 Ca2 Al1 5_555 . 6_555 87.720(10) ?
Al1 Ca2 Al1 6_554 . 6_555 73.723(7) ?
Ca1 Pd Ca1 1_554 . . 82.225(4) ?
Ca1 Pd Ca2 1_554 . . 138.887(2) ?
Ca1 Pd Pd 1_554 . 5_555 112.130(4) ?
Ca1 Pd Pd 1_554 . 6_555 112.130(4) ?
Ca1 Pd Al1 1_554 . 2_554 67.498(9) ?
Ca1 Pd Al1 1_554 . 2_555 133.520(13) ?
Ca1 Pd Al1 1_554 . 6_554 67.498(12) ?
Ca1 Pd Al1 1_554 . 6_555 133.520(10) ?
Ca1 Pd Al2 1_554 . 2_555 71.636(5) ?
Ca1 Pd Al2 1_554 . 3_665 71.637(3) ?
Ca1 Pd Ca2 . . . 138.887(2) ?
Ca1 Pd Pd . . 5_555 112.130(4) ?
Ca1 Pd Pd . . 6_555 112.130(4) ?
Ca1 Pd Al1 . . 2_554 133.520(13) ?
Ca1 Pd Al1 . . 2_555 67.498(9) ?
Ca1 Pd Al1 . . 6_554 133.520(10) ?
Ca1 Pd Al1 . . 6_555 67.498(12) ?
Ca1 Pd Al2 . . 2_555 71.636(5) ?
Ca1 Pd Al2 . . 3_665 71.637(3) ?
Ca2 Pd Pd . . 5_555 60.000(6) ?
Ca2 Pd Pd . . 6_555 60.000(4) ?
Ca2 Pd Al1 . . 2_554 78.288(12) ?
Ca2 Pd Al1 . . 2_555 78.288(12) ?
Ca2 Pd Al1 . . 6_554 78.288(11) ?
Ca2 Pd Al1 . . 6_555 78.288(11) ?
Ca2 Pd Al2 . . 2_555 114.718(5) ?
Ca2 Pd Al2 . . 3_665 114.718(6) ?
Pd Pd Pd 5_555 . 6_555 120.000(6) ?
Pd Pd Al1 5_555 . 2_554 111.653(12) ?
Pd Pd Al1 5_555 . 2_555 111.653(12) ?
Pd Pd Al1 5_555 . 6_554 55.111(13) ?
Pd Pd Al1 5_555 . 6_555 55.111(13) ?
Pd Pd Al2 5_555 . 2_555 174.718(4) ?
Pd Pd Al2 5_555 . 3_665 54.718(4) ?
Pd Pd Al1 6_555 . 2_554 55.111(3) ?
Pd Pd Al1 6_555 . 2_555 55.111(3) ?
Pd Pd Al1 6_555 . 6_554 111.653(10) ?
Pd Pd Al1 6_555 . 6_555 111.653(10) ?
Pd Pd Al2 6_555 . 2_555 54.718(4) ?
Pd Pd Al2 6_555 . 3_665 174.718(6) ?
Al1 Pd Al1 2_554 . 2_555 109.105(6) ?
Al1 Pd Al1 2_554 . 6_554 65.813(13) ?
Al1 Pd Al1 2_554 . 6_555 156.575(16) ?
Al1 Pd Al2 2_554 . 2_555 65.882(11) ?
Al1 Pd Al2 2_554 . 3_665 125.337(3) ?
Al1 Pd Al1 2_555 . 6_554 156.575(16) ?
Al1 Pd Al1 2_555 . 6_555 65.813(13) ?
Al1 Pd Al2 2_555 . 2_555 65.882(11) ?
Al1 Pd Al2 2_555 . 3_665 125.337(3) ?
Al1 Pd Al1 6_554 . 6_555 109.105(18) ?
Al1 Pd Al2 6_554 . 2_555 125.336(13) ?
Al1 Pd Al2 6_554 . 3_665 65.883(10) ?
Al1 Pd Al2 6_555 . 2_555 125.336(13) ?
Al1 Pd Al2 6_555 . 3_665 65.883(10) ?
Al2 Pd Al2 2_555 . 3_665 130.564(6) ?
Ca1 Al1 Ca1 1_545 . 4_665 111.100(17) ?
Ca1 Al1 Ca2 1_545 . . 116.911(4) ?
Ca1 Al1 Ca2 1_545 . 1_556 116.911(4) ?
Ca1 Al1 Pd 1_545 . 3_555 65.326(6) ?
Ca1 Al1 Pd 1_545 . 3_556 65.326(6) ?
Ca1 Al1 Pd 1_545 . 5_555 121.727(10) ?
Ca1 Al1 Pd 1_545 . 5_556 121.727(10) ?
Ca1 Al1 Al1 1_545 . 4_655 55.550(9) ?
Ca1 Al1 Al1 1_545 . 5_555 64.450(11) ?
Ca1 Al1 Al1 1_545 . 6_555 175.55(2) ?
Ca1 Al1 Al2 1_545 . . 68.135(9) ?
Ca1 Al1 Al2 1_545 . 1_556 68.135(9) ?
Ca1 Al1 Ca2 4_665 . . 116.911(6) ?
Ca1 Al1 Ca2 4_665 . 1_556 116.911(6) ?
Ca1 Al1 Pd 4_665 . 3_555 121.728(10) ?
Ca1 Al1 Pd 4_665 . 3_556 121.728(10) ?
Ca1 Al1 Pd 4_665 . 5_555 65.326(5) ?
Ca1 Al1 Pd 4_665 . 5_556 65.326(5) ?
Ca1 Al1 Al1 4_665 . 4_655 55.550(9) ?
Ca1 Al1 Al1 4_665 . 5_555 175.55(2) ?
Ca1 Al1 Al1 4_665 . 6_555 64.450(11) ?
Ca1 Al1 Al2 4_665 . . 68.135(9) ?
Ca1 Al1 Al2 4_665 . 1_556 68.135(9) ?
Ca2 Al1 Ca2 . . 1_556 73.723(11) ?
Ca2 Al1 Pd . . 3_555 55.572(8) ?
Ca2 Al1 Pd . . 3_556 114.331(17) ?
Ca2 Al1 Pd . . 5_555 55.572(9) ?
Ca2 Al1 Pd . . 5_556 114.332(16) ?
Ca2 Al1 Al1 . . 4_655 143.139(6) ?
Ca2 Al1 Al1 . . 5_555 66.419(13) ?
Ca2 Al1 Al1 . . 6_555 66.419(12) ?
Ca2 Al1 Al2 . . . 94.314(5) ?
Ca2 Al1 Al2 . . 1_556 168.036(14) ?
Ca2 Al1 Pd 1_556 . 3_555 114.331(17) ?
Ca2 Al1 Pd 1_556 . 3_556 55.572(8) ?
Ca2 Al1 Pd 1_556 . 5_555 114.332(16) ?
Ca2 Al1 Pd 1_556 . 5_556 55.572(9) ?
Ca2 Al1 Al1 1_556 . 4_655 143.139(6) ?
Ca2 Al1 Al1 1_556 . 5_555 66.419(13) ?
Ca2 Al1 Al1 1_556 . 6_555 66.419(12) ?
Ca2 Al1 Al2 1_556 . . 168.036(14) ?
Ca2 Al1 Al2 1_556 . 1_556 94.314(5) ?
Pd Al1 Pd 3_555 . 3_556 109.105(5) ?
Pd Al1 Pd 3_555 . 5_555 69.777(4) ?
Pd Al1 Pd 3_555 . 5_556 169.00(3) ?
Pd Al1 Al1 3_555 . 4_655 95.499(13) ?
Pd Al1 Al1 3_555 . 5_555 57.093(5) ?
Pd Al1 Al1 3_555 . 6_555 116.579(13) ?
Pd Al1 Al2 3_555 . . 56.627(7) ?
Pd Al1 Al2 3_555 . 1_556 132.554(16) ?
Pd Al1 Pd 3_556 . 5_555 169.00(3) ?
Pd Al1 Pd 3_556 . 5_556 69.777(4) ?
Pd Al1 Al1 3_556 . 4_655 95.499(13) ?
Pd Al1 Al1 3_556 . 5_555 57.093(5) ?
Pd Al1 Al1 3_556 . 6_555 116.579(13) ?
Pd Al1 Al2 3_556 . . 132.554(16) ?
Pd Al1 Al2 3_556 . 1_556 56.627(7) ?
Pd Al1 Pd 5_555 . 5_556 109.105(6) ?
Pd Al1 Al1 5_555 . 4_655 95.499(13) ?
Pd Al1 Al1 5_555 . 5_555 116.579(13) ?
Pd Al1 Al1 5_555 . 6_555 57.094(6) ?
Pd Al1 Al2 5_555 . . 56.626(6) ?
Pd Al1 Al2 5_555 . 1_556 132.554(16) ?
Pd Al1 Al1 5_556 . 4_655 95.499(13) ?
Pd Al1 Al1 5_556 . 5_555 116.579(13) ?
Pd Al1 Al1 5_556 . 6_555 57.094(6) ?
Pd Al1 Al2 5_556 . . 132.554(16) ?
Pd Al1 Al2 5_556 . 1_556 56.626(6) ?
Al1 Al1 Al1 4_655 . 5_555 120.000(15) ?
Al1 Al1 Al1 4_655 . 6_555 120.000(14) ?
Al1 Al1 Al2 4_655 . . 48.825(9) ?
Al1 Al1 Al2 4_655 . 1_556 48.825(9) ?
Al1 Al1 Al1 5_555 . 6_555 120.00(2) ?
Al1 Al1 Al2 5_555 . . 109.219(7) ?
Al1 Al1 Al2 5_555 . 1_556 109.219(7) ?
Al1 Al1 Al2 6_555 . . 109.219(7) ?
Al1 Al1 Al2 6_555 . 1_556 109.219(7) ?
Al2 Al1 Al2 . . 1_556 97.650(18) ?
Ca1 Al2 Ca1 1_544 . 1_545 76.214(3) ?
Ca1 Al2 Ca1 1_544 . 4_664 103.786(3) ?
Ca1 Al2 Ca1 1_544 . 4_665 180.0(5) ?
Ca1 Al2 Pd 1_544 . 2_655 62.968(4) ?
Ca1 Al2 Pd 1_544 . 3_555 62.968(3) ?
Ca1 Al2 Pd 1_544 . 5_555 117.032(4) ?
Ca1 Al2 Pd 1_544 . 6_655 117.032(3) ?
Ca1 Al2 Al1 1_544 . 1_554 62.321(4) ?
Ca1 Al2 Al1 1_544 . . 117.679(6) ?
Ca1 Al2 Al1 1_544 . 4_654 62.321(6) ?
Ca1 Al2 Al1 1_544 . 4_655 117.679(4) ?
Ca1 Al2 Ca1 1_545 . 4_664 180.0(5) ?
Ca1 Al2 Ca1 1_545 . 4_665 103.786(3) ?
Ca1 Al2 Pd 1_545 . 2_655 62.968(4) ?
Ca1 Al2 Pd 1_545 . 3_555 62.968(3) ?
Ca1 Al2 Pd 1_545 . 5_555 117.032(4) ?
Ca1 Al2 Pd 1_545 . 6_655 117.032(3) ?
Ca1 Al2 Al1 1_545 . 1_554 117.679(6) ?
Ca1 Al2 Al1 1_545 . . 62.321(4) ?
Ca1 Al2 Al1 1_545 . 4_654 117.679(4) ?
Ca1 Al2 Al1 1_545 . 4_655 62.321(6) ?
Ca1 Al2 Ca1 4_664 . 4_665 76.214(3) ?
Ca1 Al2 Pd 4_664 . 2_655 117.032(4) ?
Ca1 Al2 Pd 4_664 . 3_555 117.032(3) ?
Ca1 Al2 Pd 4_664 . 5_555 62.968(4) ?
Ca1 Al2 Pd 4_664 . 6_655 62.968(3) ?
Ca1 Al2 Al1 4_664 . 1_554 62.321(6) ?
Ca1 Al2 Al1 4_664 . . 117.679(4) ?
Ca1 Al2 Al1 4_664 . 4_654 62.321(4) ?
Ca1 Al2 Al1 4_664 . 4_655 117.679(6) ?
Ca1 Al2 Pd 4_665 . 2_655 117.032(4) ?
Ca1 Al2 Pd 4_665 . 3_555 117.032(3) ?
Ca1 Al2 Pd 4_665 . 5_555 62.968(4) ?
Ca1 Al2 Pd 4_665 . 6_655 62.968(3) ?
Ca1 Al2 Al1 4_665 . 1_554 117.679(4) ?
Ca1 Al2 Al1 4_665 . . 62.321(6) ?
Ca1 Al2 Al1 4_665 . 4_654 117.679(6) ?
Ca1 Al2 Al1 4_665 . 4_655 62.321(4) ?
Pd Al2 Pd 2_655 . 3_555 109.436(5) ?
Pd Al2 Pd 2_655 . 5_555 180.0(5) ?
Pd Al2 Pd 2_655 . 6_655 70.564(5) ?
Pd Al2 Al1 2_655 . 1_554 122.509(7) ?
Pd Al2 Al1 2_655 . . 122.509(7) ?
Pd Al2 Al1 2_655 . 4_654 57.491(7) ?
Pd Al2 Al1 2_655 . 4_655 57.491(7) ?
Pd Al2 Pd 3_555 . 5_555 70.564(5) ?
Pd Al2 Pd 3_555 . 6_655 180.0(5) ?
Pd Al2 Al1 3_555 . 1_554 57.491(7) ?
Pd Al2 Al1 3_555 . . 57.491(7) ?
Pd Al2 Al1 3_555 . 4_654 122.509(7) ?
Pd Al2 Al1 3_555 . 4_655 122.509(7) ?
Pd Al2 Pd 5_555 . 6_655 109.436(5) ?
Pd Al2 Al1 5_555 . 1_554 57.491(7) ?
Pd Al2 Al1 5_555 . . 57.491(7) ?
Pd Al2 Al1 5_555 . 4_654 122.509(7) ?
Pd Al2 Al1 5_555 . 4_655 122.509(7) ?
Pd Al2 Al1 6_655 . 1_554 122.509(7) ?
Pd Al2 Al1 6_655 . . 122.509(7) ?
Pd Al2 Al1 6_655 . 4_654 57.491(7) ?
Pd Al2 Al1 6_655 . 4_655 57.491(7) ?
Al1 Al2 Al1 1_554 . . 97.650(13) ?
Al1 Al2 Al1 1_554 . 4_654 82.350(13) ?
Al1 Al2 Al1 1_554 . 4_655 180.0(5) ?
Al1 Al2 Al1 . . 4_654 180.0(5) ?
Al1 Al2 Al1 . . 4_655 82.350(13) ?
Al1 Al2 Al1 4_654 . 4_655 97.650(13) ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion
_geom_torsion_publ_flag
? ? ? ? ? ? ? ? ? ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_D
_geom_hbond_site_symmetry_H
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_publ_flag
? ? ? ? ? ? ? ? ? ? ?


####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_I_CCDC1
_database_code_depnum_ccdc_archive 'CCDC 1868849'
loop_
_audit_author_name
_audit_author_address
'Oliver Janka'
;WWU Muenster
Germany
;
_audit_update_record             
;
2019-04-17 deposited with the CCDC.	2019-10-14 downloaded from the CCDC.
;
#=======================================================================

# 5. CHEMICAL DATA

_chemical_name_systematic        
; ?
;
_chemical_name_common            ?
_chemical_formula_moiety         ?
_chemical_formula_structural     ?
_chemical_formula_analytical     ?
_chemical_formula_iupac          ?
_chemical_formula_sum            'Al3 Ca0.66 Pd2 Yb0.34'
_chemical_formula_weight         379
_chemical_melting_point          ?
_chemical_compound_source        ?
_chemical_absolute_configuration .

#=======================================================================

# 6. CRYSTAL DATA

_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_H-M   'P 6/m m m'
_symmetry_space_group_name_Hall  '-P 6;-2'
_symmetry_Int_Tables_number      191

loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -y,x-y,z
3 -x+y,-x,z
4 -x,-y,z
5 y,-x+y,z
6 x-y,x,z
7 y,x,-z
8 x-y,-y,-z
9 -x,-x+y,-z
10 -y,-x,-z
11 -x+y,y,-z
12 x,x-y,-z
13 -x,-y,-z
14 y,-x+y,-z
15 x-y,x,-z
16 x,y,-z
17 -y,x-y,-z
18 -x+y,-x,-z
19 -y,-x,z
20 -x+y,y,z
21 x,x-y,z
22 y,x,z
23 x-y,-y,z
24 -x,-x+y,z

_cell_length_a                   9.3353(7)
_cell_length_b                   9.3353(7)
_cell_length_c                   4.2266(3)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_volume                     318.99(4)

loop_
_twin_individual_id
_twin_individual_mass_fraction_refined
_twin_individual_twin_matrix_11
_twin_individual_twin_matrix_12
_twin_individual_twin_matrix_13
_twin_individual_twin_matrix_21
_twin_individual_twin_matrix_22
_twin_individual_twin_matrix_23
_twin_individual_twin_matrix_31
_twin_individual_twin_matrix_32
_twin_individual_twin_matrix_33
? ? ? ? ? ? ? ? ? ? ?

_cell_formula_units_Z            3

_cell_measurement_reflns_used    4301
_cell_measurement_theta_min      4.47
_cell_measurement_theta_max      33.59
_cell_measurement_temperature    293
_cell_special_details            
; ?
;

_exptl_crystal_density_diffrn    5.92
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_F_000             504

_exptl_absorpt_coefficient_mu    17.0
_exptl_crystal_description       plate
_exptl_crystal_size_max          0.100
_exptl_crystal_size_mid          0.080
_exptl_crystal_size_min          0.020
_exptl_crystal_size_rad          ?
_exptl_crystal_colour            silver
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   ?
_exptl_absorpt_correction_T_min  0.2624
_exptl_absorpt_correction_T_max  0.7031
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
? ? ? ?

#=======================================================================

# 7. EXPERIMENTAL DATA

_exptl_special_details           ?

_diffrn_ambient_temperature      293
_diffrn_source                   ?
_diffrn_source_power             ?
_diffrn_source_voltage           ?
_diffrn_source_current           ?
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_source         'X-ray tube'
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'IPDS Stoe'
_diffrn_detector                 ?
_diffrn_detector_area_resol_mean ?
_diffrn_measurement_method       '??integration method??'
_diffrn_measurement_specimen_support ?

_diffrn_reflns_number            3732
_diffrn_reflns_theta_min         2.52
_diffrn_reflns_theta_max         33.24
_diffrn_reflns_theta_full        33.24
_diffrn_measured_fraction_theta_max 1
_diffrn_measured_fraction_theta_full 1
_diffrn_reflns_av_R_equivalents  0.0489
_diffrn_reflns_av_unetI/netI     0.0074
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_l_min       -6
_diffrn_reflns_limit_l_max       6
_diffrn_reflns_reduction_process ?

_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
loop_
_diffrn_standard_refln_index_h
_diffrn_standard_refln_index_k
_diffrn_standard_refln_index_l
? ? ?

_diffrn_radiation_probe          X-ray

#=======================================================================

# 8. REFINEMENT DATA

_refine_special_details          
; ?
;

_reflns_number_total             287
_reflns_number_gt                241
_reflns_threshold_expression     I>3σ(I)

_refine_ls_structure_factor_coef Fsqd
_refine_ls_R_factor_gt           0.0165
_refine_ls_wR_factor_gt          0.0367
_refine_ls_R_factor_all          0.0208
_refine_ls_wR_factor_ref         0.0376
_refine_ls_goodness_of_fit_ref   1.35
_refine_ls_goodness_of_fit_gt    1.44
_refine_ls_restrained_S_gt       ?
_refine_ls_restrained_S_all      ?
_refine_ls_number_reflns         287
_refine_ls_number_parameters     19
_refine_ls_number_restraints     0
_refine_ls_number_constraints    5
_refine_ls_weighting_scheme      sigma
_refine_ls_weighting_details     w=1/(σ²(I)+0.0004I²)
_refine_ls_hydrogen_treatment    ?
_refine_ls_shift/su_max          0.0005
_refine_ls_shift/su_mean         0.0001
_refine_diff_density_max         1.05
_refine_diff_density_min         -0.86
_refine_ls_extinction_method     
'B-C type 1 Lorentzian isotropic (Becker & Coppens, 1974)'
_refine_ls_extinction_coef       390(30)
_refine_ls_abs_structure_details ?
_refine_ls_abs_structure_Flack   ?
_refine_ls_abs_structure_Rogers  ?

loop_
_atom_type_symbol
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Al 0.0645 0.0514 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Ca 0.2262 0.3064 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Pd -0.9988 1.0072 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Yb -0.3850 5.5486 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    ?
_computing_structure_refinement  ?
_computing_molecular_graphics    ?
_computing_publication_material  ?

loop_
_restr_distance_atom_site_label_1
_restr_distance_site_symmetry_1
_restr_distance_atom_site_label_2
_restr_distance_site_symmetry_2
_restr_distance_target
_restr_distance_target_weight_param
? ? ? ? ? ?

loop_
_restr_angle_atom_site_label_1
_restr_angle_site_symmetry_1
_restr_angle_atom_site_label_2
_restr_angle_site_symmetry_2
_restr_angle_atom_site_label_3
_restr_angle_site_symmetry_3
_restr_angle_target
_restr_angle_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_torsion_atom_site_label_1
_restr_torsion_site_symmetry_1
_restr_torsion_atom_site_label_2
_restr_torsion_site_symmetry_2
_restr_torsion_atom_site_label_3
_restr_torsion_site_symmetry_3
_restr_torsion_atom_site_label_4
_restr_torsion_site_symmetry_4
_restr_torsion_angle_target
_restr_torsion_weight_param
? ? ? ? ? ? ? ? ? ?

loop_
_restr_equal_distance_atom_site_label_1
_restr_equal_distance_site_symmetry_1
_restr_equal_distance_atom_site_label_2
_restr_equal_distance_site_symmetry_2
_restr_equal_distance_class_class_id
_restr_equal_distance_class_target_weight_param
? ? ? ? ? ?

loop_
_restr_equal_angle_atom_site_label_1
_restr_equal_angle_site_symmetry_1
_restr_equal_angle_atom_site_label_2
_restr_equal_angle_site_symmetry_2
_restr_equal_angle_atom_site_label_3
_restr_equal_angle_site_symmetry_3
_restr_equal_angle_class_class_id
_restr_equal_angle_class_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_equal_torsion_atom_site_label_1
_restr_equal_torsion_site_symmetry_1
_restr_equal_torsion_atom_site_label_2
_restr_equal_torsion_site_symmetry_2
_restr_equal_torsion_atom_site_label_3
_restr_equal_torsion_site_symmetry_3
_restr_equal_torsion_atom_site_label_4
_restr_equal_torsion_site_symmetry_4
_restr_equal_torsion_class_class_id
_restr_equal_torsion_class_target_weight_param
? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 9. ATOMIC COORDINATES AND DISPLACEMENT PARAMETERS

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_adp_type
_atom_site_U_iso_or_equiv
_atom_site_site_symmetry_multiplicity
_atom_site_occupancy
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ca1 Ca 0.333333 0.666667 0.5 Uani 0.00918(18) 2 0.564(4) d . . .
Yb1 Yb 0.333333 0.666667 0.5 Uani 0.00918(18) 2 0.436(4) d . . .
Ca2 Ca 0 0 0 Uani 0.0112(4) 1 0.852(5) d . . .
Yb2 Yb 0 0 0 Uani 0.0112(4) 1 0.148(5) d . . .
Pd Pd 0.18431(2) 0.36861(4) 0 Uani 0.00794(12) 6 1 d . . .
Al1 Al 0.30310(16) 0 0.5 Uani 0.0094(4) 6 1 d . . .
Al2 Al 0.5 0 0 Uani 0.0093(6) 3 1 d . . .


loop_
_jana_atom_site_ADP_C_label
_jana_atom_site_ADP_C_type_symbol
_jana_atom_site_ADP_C_111
_jana_atom_site_ADP_C_112
_jana_atom_site_ADP_C_113
_jana_atom_site_ADP_C_122
_jana_atom_site_ADP_C_123
_jana_atom_site_ADP_C_133
_jana_atom_site_ADP_C_222
_jana_atom_site_ADP_C_223
_jana_atom_site_ADP_C_233
_jana_atom_site_ADP_C_333
? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_D_label
_jana_atom_site_ADP_D_type_symbol
_jana_atom_site_ADP_D_1111
_jana_atom_site_ADP_D_1112
_jana_atom_site_ADP_D_1113
_jana_atom_site_ADP_D_1122
_jana_atom_site_ADP_D_1123
_jana_atom_site_ADP_D_1133
_jana_atom_site_ADP_D_1222
_jana_atom_site_ADP_D_1223
_jana_atom_site_ADP_D_1233
_jana_atom_site_ADP_D_1333
_jana_atom_site_ADP_D_2222
_jana_atom_site_ADP_D_2223
_jana_atom_site_ADP_D_2233
_jana_atom_site_ADP_D_2333
_jana_atom_site_ADP_D_3333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_E_label
_jana_atom_site_ADP_E_type_symbol
_jana_atom_site_ADP_E_11111
_jana_atom_site_ADP_E_11112
_jana_atom_site_ADP_E_11113
_jana_atom_site_ADP_E_11122
_jana_atom_site_ADP_E_11123
_jana_atom_site_ADP_E_11133
_jana_atom_site_ADP_E_11222
_jana_atom_site_ADP_E_11223
_jana_atom_site_ADP_E_11233
_jana_atom_site_ADP_E_11333
_jana_atom_site_ADP_E_12222
_jana_atom_site_ADP_E_12223
_jana_atom_site_ADP_E_12233
_jana_atom_site_ADP_E_12333
_jana_atom_site_ADP_E_13333
_jana_atom_site_ADP_E_22222
_jana_atom_site_ADP_E_22223
_jana_atom_site_ADP_E_22233
_jana_atom_site_ADP_E_22333
_jana_atom_site_ADP_E_23333
_jana_atom_site_ADP_E_33333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_F_label
_jana_atom_site_ADP_F_type_symbol
_jana_atom_site_ADP_F_111111
_jana_atom_site_ADP_F_111112
_jana_atom_site_ADP_F_111113
_jana_atom_site_ADP_F_111122
_jana_atom_site_ADP_F_111123
_jana_atom_site_ADP_F_111133
_jana_atom_site_ADP_F_111222
_jana_atom_site_ADP_F_111223
_jana_atom_site_ADP_F_111233
_jana_atom_site_ADP_F_111333
_jana_atom_site_ADP_F_112222
_jana_atom_site_ADP_F_112223
_jana_atom_site_ADP_F_112233
_jana_atom_site_ADP_F_112333
_jana_atom_site_ADP_F_113333
_jana_atom_site_ADP_F_122222
_jana_atom_site_ADP_F_122223
_jana_atom_site_ADP_F_122233
_jana_atom_site_ADP_F_122333
_jana_atom_site_ADP_F_123333
_jana_atom_site_ADP_F_133333
_jana_atom_site_ADP_F_222222
_jana_atom_site_ADP_F_222223
_jana_atom_site_ADP_F_222233
_jana_atom_site_ADP_F_222333
_jana_atom_site_ADP_F_223333
_jana_atom_site_ADP_F_233333
_jana_atom_site_ADP_F_333333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?


# 10. MOLECULAR GEOMETRY


loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Yb1 Pd . . 3.2051(5) ?
Yb1 Pd . 1_556 3.2051(5) ?
Yb1 Pd . 2_665 3.2051(5) ?
Yb1 Pd . 2_666 3.2051(5) ?
Yb1 Pd . 3_565 3.2051(4) ?
Yb1 Pd . 3_566 3.2051(4) ?
Yb1 Al1 . 1_565 3.2620(9) ?
Yb1 Al1 . 2_555 3.2621(11) ?
Yb1 Al1 . 3_665 3.2621(17) ?
Yb1 Al1 . 4_665 3.2621(11) ?
Yb1 Al1 . 5_565 3.2620(9) ?
Yb1 Al1 . 6_555 3.2621(17) ?
Yb1 Al2 . 1_565 3.4247(5) ?
Yb1 Al2 . 1_566 3.4247(5) ?
Yb1 Al2 . 2_555 3.4247(5) ?
Yb1 Al2 . 2_556 3.4247(5) ?
Yb1 Al2 . 3_665 3.4247(2) ?
Yb1 Al2 . 3_666 3.4247(2) ?
Ca1 Pd . . 3.2051(5) ?
Ca1 Pd . 1_556 3.2051(5) ?
Ca1 Pd . 2_665 3.2051(5) ?
Ca1 Pd . 2_666 3.2051(5) ?
Ca1 Pd . 3_565 3.2051(4) ?
Ca1 Pd . 3_566 3.2051(4) ?
Ca1 Al1 . 1_565 3.2620(9) ?
Ca1 Al1 . 2_555 3.2621(11) ?
Ca1 Al1 . 3_665 3.2621(17) ?
Ca1 Al1 . 4_665 3.2621(11) ?
Ca1 Al1 . 5_565 3.2620(9) ?
Ca1 Al1 . 6_555 3.2621(17) ?
Ca1 Al2 . 1_565 3.4247(5) ?
Ca1 Al2 . 1_566 3.4247(5) ?
Ca1 Al2 . 2_555 3.4247(5) ?
Ca1 Al2 . 2_556 3.4247(5) ?
Ca1 Al2 . 3_665 3.4247(2) ?
Ca1 Al2 . 3_666 3.4247(2) ?
Yb2 Pd . . 2.9801(7) ?
Yb2 Pd . 2_555 2.9801(7) ?
Yb2 Pd . 3_555 2.9801(4) ?
Yb2 Pd . 4_555 2.9801(7) ?
Yb2 Pd . 5_555 2.9801(7) ?
Yb2 Pd . 6_555 2.9801(4) ?
Yb2 Al1 . 1_554 3.5316(12) ?
Yb2 Al1 . . 3.5316(12) ?
Yb2 Al1 . 2_554 3.5316(12) ?
Yb2 Al1 . 2_555 3.5316(12) ?
Yb2 Al1 . 3_554 3.5316(10) ?
Yb2 Al1 . 3_555 3.5316(10) ?
Yb2 Al1 . 4_554 3.5316(12) ?
Yb2 Al1 . 4_555 3.5316(12) ?
Yb2 Al1 . 5_554 3.5316(12) ?
Yb2 Al1 . 5_555 3.5316(12) ?
Yb2 Al1 . 6_554 3.5316(10) ?
Yb2 Al1 . 6_555 3.5316(10) ?
Ca2 Pd . . 2.9801(7) ?
Ca2 Pd . 2_555 2.9801(7) ?
Ca2 Pd . 3_555 2.9801(4) ?
Ca2 Pd . 4_555 2.9801(7) ?
Ca2 Pd . 5_555 2.9801(7) ?
Ca2 Pd . 6_555 2.9801(4) ?
Ca2 Al1 . 1_554 3.5316(12) ?
Ca2 Al1 . . 3.5316(12) ?
Ca2 Al1 . 2_554 3.5316(12) ?
Ca2 Al1 . 2_555 3.5316(12) ?
Ca2 Al1 . 3_554 3.5316(10) ?
Ca2 Al1 . 3_555 3.5316(10) ?
Ca2 Al1 . 4_554 3.5316(12) ?
Ca2 Al1 . 4_555 3.5316(12) ?
Ca2 Al1 . 5_554 3.5316(12) ?
Ca2 Al1 . 5_555 3.5316(12) ?
Ca2 Al1 . 6_554 3.5316(10) ?
Ca2 Al1 . 6_555 3.5316(10) ?
Pd Pd . 5_555 2.9801(6) ?
Pd Pd . 6_555 2.9801(7) ?
Pd Al1 . 2_554 2.5977(3) ?
Pd Al1 . 2_555 2.5977(3) ?
Pd Al1 . 6_554 2.5977(11) ?
Pd Al1 . 6_555 2.5977(11) ?
Pd Al2 . 2_555 2.5642(4) ?
Pd Al2 . 3_665 2.5642(6) ?
Al1 Al1 . 4_655 3.676(2) ?
Al1 Al1 . 5_555 2.8295(12) ?
Al1 Al1 . 6_555 2.8295(19) ?
Al1 Al2 . . 2.8008(10) ?
Al1 Al2 . 1_556 2.8008(10) ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
Pd Yb1 Pd . . 1_556 82.502(9) ?
Pd Yb1 Pd . . 2_665 81.249(9) ?
Pd Yb1 Pd . . 2_666 135.838(10) ?
Pd Yb1 Pd . . 3_565 81.249(8) ?
Pd Yb1 Pd . . 3_566 135.839(8) ?
Pd Yb1 Al1 . . 1_565 128.397(13) ?
Pd Yb1 Al1 . . 2_555 47.356(11) ?
Pd Yb1 Al1 . . 3_665 93.229(19) ?
Pd Yb1 Al1 . . 4_665 128.397(13) ?
Pd Yb1 Al1 . . 5_565 93.229(17) ?
Pd Yb1 Al1 . . 6_555 47.356(12) ?
Pd Yb1 Al2 . . 1_565 100.645(8) ?
Pd Yb1 Al2 . . 1_566 176.852(4) ?
Pd Yb1 Al2 . . 2_555 45.357(6) ?
Pd Yb1 Al2 . . 2_556 96.377(7) ?
Pd Yb1 Al2 . . 3_665 45.357(6) ?
Pd Yb1 Al2 . . 3_666 96.377(8) ?
Pd Yb1 Pd 1_556 . 2_665 135.838(10) ?
Pd Yb1 Pd 1_556 . 2_666 81.249(9) ?
Pd Yb1 Pd 1_556 . 3_565 135.839(8) ?
Pd Yb1 Pd 1_556 . 3_566 81.249(8) ?
Pd Yb1 Al1 1_556 . 1_565 128.397(13) ?
Pd Yb1 Al1 1_556 . 2_555 47.356(11) ?
Pd Yb1 Al1 1_556 . 3_665 93.229(19) ?
Pd Yb1 Al1 1_556 . 4_665 128.397(13) ?
Pd Yb1 Al1 1_556 . 5_565 93.229(17) ?
Pd Yb1 Al1 1_556 . 6_555 47.356(12) ?
Pd Yb1 Al2 1_556 . 1_565 176.852(4) ?
Pd Yb1 Al2 1_556 . 1_566 100.645(8) ?
Pd Yb1 Al2 1_556 . 2_555 96.377(7) ?
Pd Yb1 Al2 1_556 . 2_556 45.357(6) ?
Pd Yb1 Al2 1_556 . 3_665 96.377(8) ?
Pd Yb1 Al2 1_556 . 3_666 45.357(6) ?
Pd Yb1 Pd 2_665 . 2_666 82.502(9) ?
Pd Yb1 Pd 2_665 . 3_565 81.249(10) ?
Pd Yb1 Pd 2_665 . 3_566 135.839(9) ?
Pd Yb1 Al1 2_665 . 1_565 93.229(19) ?
Pd Yb1 Al1 2_665 . 2_555 128.397(13) ?
Pd Yb1 Al1 2_665 . 3_665 47.356(13) ?
Pd Yb1 Al1 2_665 . 4_665 47.356(11) ?
Pd Yb1 Al1 2_665 . 5_565 128.397(14) ?
Pd Yb1 Al1 2_665 . 6_555 93.23(2) ?
Pd Yb1 Al2 2_665 . 1_565 45.357(9) ?
Pd Yb1 Al2 2_665 . 1_566 96.377(8) ?
Pd Yb1 Al2 2_665 . 2_555 100.645(8) ?
Pd Yb1 Al2 2_665 . 2_556 176.852(4) ?
Pd Yb1 Al2 2_665 . 3_665 45.357(9) ?
Pd Yb1 Al2 2_665 . 3_666 96.377(9) ?
Pd Yb1 Pd 2_666 . 3_565 135.839(9) ?
Pd Yb1 Pd 2_666 . 3_566 81.249(10) ?
Pd Yb1 Al1 2_666 . 1_565 93.229(19) ?
Pd Yb1 Al1 2_666 . 2_555 128.397(13) ?
Pd Yb1 Al1 2_666 . 3_665 47.356(13) ?
Pd Yb1 Al1 2_666 . 4_665 47.356(11) ?
Pd Yb1 Al1 2_666 . 5_565 128.397(14) ?
Pd Yb1 Al1 2_666 . 6_555 93.23(2) ?
Pd Yb1 Al2 2_666 . 1_565 96.377(8) ?
Pd Yb1 Al2 2_666 . 1_566 45.357(9) ?
Pd Yb1 Al2 2_666 . 2_555 176.852(4) ?
Pd Yb1 Al2 2_666 . 2_556 100.645(8) ?
Pd Yb1 Al2 2_666 . 3_665 96.377(9) ?
Pd Yb1 Al2 2_666 . 3_666 45.357(9) ?
Pd Yb1 Pd 3_565 . 3_566 82.503(8) ?
Pd Yb1 Al1 3_565 . 1_565 47.356(10) ?
Pd Yb1 Al1 3_565 . 2_555 93.229(17) ?
Pd Yb1 Al1 3_565 . 3_665 128.397(14) ?
Pd Yb1 Al1 3_565 . 4_665 93.229(18) ?
Pd Yb1 Al1 3_565 . 5_565 47.356(11) ?
Pd Yb1 Al1 3_565 . 6_555 128.397(13) ?
Pd Yb1 Al2 3_565 . 1_565 45.357(7) ?
Pd Yb1 Al2 3_565 . 1_566 96.377(6) ?
Pd Yb1 Al2 3_565 . 2_555 45.357(6) ?
Pd Yb1 Al2 3_565 . 2_556 96.377(8) ?
Pd Yb1 Al2 3_565 . 3_665 100.645(6) ?
Pd Yb1 Al2 3_565 . 3_666 176.852(5) ?
Pd Yb1 Al1 3_566 . 1_565 47.356(10) ?
Pd Yb1 Al1 3_566 . 2_555 93.229(17) ?
Pd Yb1 Al1 3_566 . 3_665 128.397(14) ?
Pd Yb1 Al1 3_566 . 4_665 93.229(18) ?
Pd Yb1 Al1 3_566 . 5_565 47.356(11) ?
Pd Yb1 Al1 3_566 . 6_555 128.397(13) ?
Pd Yb1 Al2 3_566 . 1_565 96.377(6) ?
Pd Yb1 Al2 3_566 . 1_566 45.357(7) ?
Pd Yb1 Al2 3_566 . 2_555 96.377(8) ?
Pd Yb1 Al2 3_566 . 2_556 45.357(6) ?
Pd Yb1 Al2 3_566 . 3_665 176.852(5) ?
Pd Yb1 Al2 3_566 . 3_666 100.645(6) ?
Al1 Yb1 Al1 1_565 . 2_555 120.00(3) ?
Al1 Yb1 Al1 1_565 . 3_665 120.00(3) ?
Al1 Yb1 Al1 1_565 . 4_665 68.59(3) ?
Al1 Yb1 Al1 1_565 . 5_565 51.41(3) ?
Al1 Yb1 Al1 1_565 . 6_555 171.41(3) ?
Al1 Yb1 Al2 1_565 . 1_565 49.452(13) ?
Al1 Yb1 Al2 1_565 . 1_566 49.452(13) ?
Al1 Yb1 Al2 1_565 . 2_555 86.620(18) ?
Al1 Yb1 Al2 1_565 . 2_556 86.620(18) ?
Al1 Yb1 Al2 1_565 . 3_665 135.157(11) ?
Al1 Yb1 Al2 1_565 . 3_666 135.157(11) ?
Al1 Yb1 Al1 2_555 . 3_665 120.00(3) ?
Al1 Yb1 Al1 2_555 . 4_665 171.41(3) ?
Al1 Yb1 Al1 2_555 . 5_565 68.59(3) ?
Al1 Yb1 Al1 2_555 . 6_555 51.41(3) ?
Al1 Yb1 Al2 2_555 . 1_565 135.157(11) ?
Al1 Yb1 Al2 2_555 . 1_566 135.157(11) ?
Al1 Yb1 Al2 2_555 . 2_555 49.452(13) ?
Al1 Yb1 Al2 2_555 . 2_556 49.452(13) ?
Al1 Yb1 Al2 2_555 . 3_665 86.620(18) ?
Al1 Yb1 Al2 2_555 . 3_666 86.620(18) ?
Al1 Yb1 Al1 3_665 . 4_665 51.41(3) ?
Al1 Yb1 Al1 3_665 . 5_565 171.41(3) ?
Al1 Yb1 Al1 3_665 . 6_555 68.59(3) ?
Al1 Yb1 Al2 3_665 . 1_565 86.620(19) ?
Al1 Yb1 Al2 3_665 . 1_566 86.620(19) ?
Al1 Yb1 Al2 3_665 . 2_555 135.157(12) ?
Al1 Yb1 Al2 3_665 . 2_556 135.157(12) ?
Al1 Yb1 Al2 3_665 . 3_665 49.452(14) ?
Al1 Yb1 Al2 3_665 . 3_666 49.452(14) ?
Al1 Yb1 Al1 4_665 . 5_565 120.00(3) ?
Al1 Yb1 Al1 4_665 . 6_555 120.00(3) ?
Al1 Yb1 Al2 4_665 . 1_565 49.452(13) ?
Al1 Yb1 Al2 4_665 . 1_566 49.452(13) ?
Al1 Yb1 Al2 4_665 . 2_555 135.157(11) ?
Al1 Yb1 Al2 4_665 . 2_556 135.157(11) ?
Al1 Yb1 Al2 4_665 . 3_665 86.620(18) ?
Al1 Yb1 Al2 4_665 . 3_666 86.620(18) ?
Al1 Yb1 Al1 5_565 . 6_555 120.00(3) ?
Al1 Yb1 Al2 5_565 . 1_565 86.620(18) ?
Al1 Yb1 Al2 5_565 . 1_566 86.620(18) ?
Al1 Yb1 Al2 5_565 . 2_555 49.452(13) ?
Al1 Yb1 Al2 5_565 . 2_556 49.452(13) ?
Al1 Yb1 Al2 5_565 . 3_665 135.157(11) ?
Al1 Yb1 Al2 5_565 . 3_666 135.157(11) ?
Al1 Yb1 Al2 6_555 . 1_565 135.157(12) ?
Al1 Yb1 Al2 6_555 . 1_566 135.157(12) ?
Al1 Yb1 Al2 6_555 . 2_555 86.620(19) ?
Al1 Yb1 Al2 6_555 . 2_556 86.620(19) ?
Al1 Yb1 Al2 6_555 . 3_665 49.452(14) ?
Al1 Yb1 Al2 6_555 . 3_666 49.452(14) ?
Al2 Yb1 Al2 1_565 . 1_566 76.207(7) ?
Al2 Yb1 Al2 1_565 . 2_555 85.918(7) ?
Al2 Yb1 Al2 1_565 . 2_556 133.662(3) ?
Al2 Yb1 Al2 1_565 . 3_665 85.918(5) ?
Al2 Yb1 Al2 1_565 . 3_666 133.661(5) ?
Al2 Yb1 Al2 1_566 . 2_555 133.662(3) ?
Al2 Yb1 Al2 1_566 . 2_556 85.918(7) ?
Al2 Yb1 Al2 1_566 . 3_665 133.661(5) ?
Al2 Yb1 Al2 1_566 . 3_666 85.918(5) ?
Al2 Yb1 Al2 2_555 . 2_556 76.207(7) ?
Al2 Yb1 Al2 2_555 . 3_665 85.918(5) ?
Al2 Yb1 Al2 2_555 . 3_666 133.661(5) ?
Al2 Yb1 Al2 2_556 . 3_665 133.661(5) ?
Al2 Yb1 Al2 2_556 . 3_666 85.918(5) ?
Al2 Yb1 Al2 3_665 . 3_666 76.207(4) ?
Pd Ca1 Pd . . 1_556 82.502(9) ?
Pd Ca1 Pd . . 2_665 81.249(9) ?
Pd Ca1 Pd . . 2_666 135.838(10) ?
Pd Ca1 Pd . . 3_565 81.249(8) ?
Pd Ca1 Pd . . 3_566 135.839(8) ?
Pd Ca1 Al1 . . 1_565 128.397(13) ?
Pd Ca1 Al1 . . 2_555 47.356(11) ?
Pd Ca1 Al1 . . 3_665 93.229(19) ?
Pd Ca1 Al1 . . 4_665 128.397(13) ?
Pd Ca1 Al1 . . 5_565 93.229(17) ?
Pd Ca1 Al1 . . 6_555 47.356(12) ?
Pd Ca1 Al2 . . 1_565 100.645(8) ?
Pd Ca1 Al2 . . 1_566 176.852(4) ?
Pd Ca1 Al2 . . 2_555 45.357(6) ?
Pd Ca1 Al2 . . 2_556 96.377(7) ?
Pd Ca1 Al2 . . 3_665 45.357(6) ?
Pd Ca1 Al2 . . 3_666 96.377(8) ?
Pd Ca1 Pd 1_556 . 2_665 135.838(10) ?
Pd Ca1 Pd 1_556 . 2_666 81.249(9) ?
Pd Ca1 Pd 1_556 . 3_565 135.839(8) ?
Pd Ca1 Pd 1_556 . 3_566 81.249(8) ?
Pd Ca1 Al1 1_556 . 1_565 128.397(13) ?
Pd Ca1 Al1 1_556 . 2_555 47.356(11) ?
Pd Ca1 Al1 1_556 . 3_665 93.229(19) ?
Pd Ca1 Al1 1_556 . 4_665 128.397(13) ?
Pd Ca1 Al1 1_556 . 5_565 93.229(17) ?
Pd Ca1 Al1 1_556 . 6_555 47.356(12) ?
Pd Ca1 Al2 1_556 . 1_565 176.852(4) ?
Pd Ca1 Al2 1_556 . 1_566 100.645(8) ?
Pd Ca1 Al2 1_556 . 2_555 96.377(7) ?
Pd Ca1 Al2 1_556 . 2_556 45.357(6) ?
Pd Ca1 Al2 1_556 . 3_665 96.377(8) ?
Pd Ca1 Al2 1_556 . 3_666 45.357(6) ?
Pd Ca1 Pd 2_665 . 2_666 82.502(9) ?
Pd Ca1 Pd 2_665 . 3_565 81.249(10) ?
Pd Ca1 Pd 2_665 . 3_566 135.839(9) ?
Pd Ca1 Al1 2_665 . 1_565 93.229(19) ?
Pd Ca1 Al1 2_665 . 2_555 128.397(13) ?
Pd Ca1 Al1 2_665 . 3_665 47.356(13) ?
Pd Ca1 Al1 2_665 . 4_665 47.356(11) ?
Pd Ca1 Al1 2_665 . 5_565 128.397(14) ?
Pd Ca1 Al1 2_665 . 6_555 93.23(2) ?
Pd Ca1 Al2 2_665 . 1_565 45.357(9) ?
Pd Ca1 Al2 2_665 . 1_566 96.377(8) ?
Pd Ca1 Al2 2_665 . 2_555 100.645(8) ?
Pd Ca1 Al2 2_665 . 2_556 176.852(4) ?
Pd Ca1 Al2 2_665 . 3_665 45.357(9) ?
Pd Ca1 Al2 2_665 . 3_666 96.377(9) ?
Pd Ca1 Pd 2_666 . 3_565 135.839(9) ?
Pd Ca1 Pd 2_666 . 3_566 81.249(10) ?
Pd Ca1 Al1 2_666 . 1_565 93.229(19) ?
Pd Ca1 Al1 2_666 . 2_555 128.397(13) ?
Pd Ca1 Al1 2_666 . 3_665 47.356(13) ?
Pd Ca1 Al1 2_666 . 4_665 47.356(11) ?
Pd Ca1 Al1 2_666 . 5_565 128.397(14) ?
Pd Ca1 Al1 2_666 . 6_555 93.23(2) ?
Pd Ca1 Al2 2_666 . 1_565 96.377(8) ?
Pd Ca1 Al2 2_666 . 1_566 45.357(9) ?
Pd Ca1 Al2 2_666 . 2_555 176.852(4) ?
Pd Ca1 Al2 2_666 . 2_556 100.645(8) ?
Pd Ca1 Al2 2_666 . 3_665 96.377(9) ?
Pd Ca1 Al2 2_666 . 3_666 45.357(9) ?
Pd Ca1 Pd 3_565 . 3_566 82.503(8) ?
Pd Ca1 Al1 3_565 . 1_565 47.356(10) ?
Pd Ca1 Al1 3_565 . 2_555 93.229(17) ?
Pd Ca1 Al1 3_565 . 3_665 128.397(14) ?
Pd Ca1 Al1 3_565 . 4_665 93.229(18) ?
Pd Ca1 Al1 3_565 . 5_565 47.356(11) ?
Pd Ca1 Al1 3_565 . 6_555 128.397(13) ?
Pd Ca1 Al2 3_565 . 1_565 45.357(7) ?
Pd Ca1 Al2 3_565 . 1_566 96.377(6) ?
Pd Ca1 Al2 3_565 . 2_555 45.357(6) ?
Pd Ca1 Al2 3_565 . 2_556 96.377(8) ?
Pd Ca1 Al2 3_565 . 3_665 100.645(6) ?
Pd Ca1 Al2 3_565 . 3_666 176.852(5) ?
Pd Ca1 Al1 3_566 . 1_565 47.356(10) ?
Pd Ca1 Al1 3_566 . 2_555 93.229(17) ?
Pd Ca1 Al1 3_566 . 3_665 128.397(14) ?
Pd Ca1 Al1 3_566 . 4_665 93.229(18) ?
Pd Ca1 Al1 3_566 . 5_565 47.356(11) ?
Pd Ca1 Al1 3_566 . 6_555 128.397(13) ?
Pd Ca1 Al2 3_566 . 1_565 96.377(6) ?
Pd Ca1 Al2 3_566 . 1_566 45.357(7) ?
Pd Ca1 Al2 3_566 . 2_555 96.377(8) ?
Pd Ca1 Al2 3_566 . 2_556 45.357(6) ?
Pd Ca1 Al2 3_566 . 3_665 176.852(5) ?
Pd Ca1 Al2 3_566 . 3_666 100.645(6) ?
Al1 Ca1 Al1 1_565 . 2_555 120.00(3) ?
Al1 Ca1 Al1 1_565 . 3_665 120.00(3) ?
Al1 Ca1 Al1 1_565 . 4_665 68.59(3) ?
Al1 Ca1 Al1 1_565 . 5_565 51.41(3) ?
Al1 Ca1 Al1 1_565 . 6_555 171.41(3) ?
Al1 Ca1 Al2 1_565 . 1_565 49.452(13) ?
Al1 Ca1 Al2 1_565 . 1_566 49.452(13) ?
Al1 Ca1 Al2 1_565 . 2_555 86.620(18) ?
Al1 Ca1 Al2 1_565 . 2_556 86.620(18) ?
Al1 Ca1 Al2 1_565 . 3_665 135.157(11) ?
Al1 Ca1 Al2 1_565 . 3_666 135.157(11) ?
Al1 Ca1 Al1 2_555 . 3_665 120.00(3) ?
Al1 Ca1 Al1 2_555 . 4_665 171.41(3) ?
Al1 Ca1 Al1 2_555 . 5_565 68.59(3) ?
Al1 Ca1 Al1 2_555 . 6_555 51.41(3) ?
Al1 Ca1 Al2 2_555 . 1_565 135.157(11) ?
Al1 Ca1 Al2 2_555 . 1_566 135.157(11) ?
Al1 Ca1 Al2 2_555 . 2_555 49.452(13) ?
Al1 Ca1 Al2 2_555 . 2_556 49.452(13) ?
Al1 Ca1 Al2 2_555 . 3_665 86.620(18) ?
Al1 Ca1 Al2 2_555 . 3_666 86.620(18) ?
Al1 Ca1 Al1 3_665 . 4_665 51.41(3) ?
Al1 Ca1 Al1 3_665 . 5_565 171.41(3) ?
Al1 Ca1 Al1 3_665 . 6_555 68.59(3) ?
Al1 Ca1 Al2 3_665 . 1_565 86.620(19) ?
Al1 Ca1 Al2 3_665 . 1_566 86.620(19) ?
Al1 Ca1 Al2 3_665 . 2_555 135.157(12) ?
Al1 Ca1 Al2 3_665 . 2_556 135.157(12) ?
Al1 Ca1 Al2 3_665 . 3_665 49.452(14) ?
Al1 Ca1 Al2 3_665 . 3_666 49.452(14) ?
Al1 Ca1 Al1 4_665 . 5_565 120.00(3) ?
Al1 Ca1 Al1 4_665 . 6_555 120.00(3) ?
Al1 Ca1 Al2 4_665 . 1_565 49.452(13) ?
Al1 Ca1 Al2 4_665 . 1_566 49.452(13) ?
Al1 Ca1 Al2 4_665 . 2_555 135.157(11) ?
Al1 Ca1 Al2 4_665 . 2_556 135.157(11) ?
Al1 Ca1 Al2 4_665 . 3_665 86.620(18) ?
Al1 Ca1 Al2 4_665 . 3_666 86.620(18) ?
Al1 Ca1 Al1 5_565 . 6_555 120.00(3) ?
Al1 Ca1 Al2 5_565 . 1_565 86.620(18) ?
Al1 Ca1 Al2 5_565 . 1_566 86.620(18) ?
Al1 Ca1 Al2 5_565 . 2_555 49.452(13) ?
Al1 Ca1 Al2 5_565 . 2_556 49.452(13) ?
Al1 Ca1 Al2 5_565 . 3_665 135.157(11) ?
Al1 Ca1 Al2 5_565 . 3_666 135.157(11) ?
Al1 Ca1 Al2 6_555 . 1_565 135.157(12) ?
Al1 Ca1 Al2 6_555 . 1_566 135.157(12) ?
Al1 Ca1 Al2 6_555 . 2_555 86.620(19) ?
Al1 Ca1 Al2 6_555 . 2_556 86.620(19) ?
Al1 Ca1 Al2 6_555 . 3_665 49.452(14) ?
Al1 Ca1 Al2 6_555 . 3_666 49.452(14) ?
Al2 Ca1 Al2 1_565 . 1_566 76.207(7) ?
Al2 Ca1 Al2 1_565 . 2_555 85.918(7) ?
Al2 Ca1 Al2 1_565 . 2_556 133.662(3) ?
Al2 Ca1 Al2 1_565 . 3_665 85.918(5) ?
Al2 Ca1 Al2 1_565 . 3_666 133.661(5) ?
Al2 Ca1 Al2 1_566 . 2_555 133.662(3) ?
Al2 Ca1 Al2 1_566 . 2_556 85.918(7) ?
Al2 Ca1 Al2 1_566 . 3_665 133.661(5) ?
Al2 Ca1 Al2 1_566 . 3_666 85.918(5) ?
Al2 Ca1 Al2 2_555 . 2_556 76.207(7) ?
Al2 Ca1 Al2 2_555 . 3_665 85.918(5) ?
Al2 Ca1 Al2 2_555 . 3_666 133.661(5) ?
Al2 Ca1 Al2 2_556 . 3_665 133.661(5) ?
Al2 Ca1 Al2 2_556 . 3_666 85.918(5) ?
Al2 Ca1 Al2 3_665 . 3_666 76.207(4) ?
Pd Yb2 Pd . . 2_555 120.000(11) ?
Pd Yb2 Pd . . 3_555 120.000(9) ?
Pd Yb2 Pd . . 4_555 180.0(5) ?
Pd Yb2 Pd . . 5_555 60.000(11) ?
Pd Yb2 Pd . . 6_555 60.000(9) ?
Pd Yb2 Al1 . . 1_554 90.000(6) ?
Pd Yb2 Al1 . . . 90.000(6) ?
Pd Yb2 Al1 . . 2_554 46.063(11) ?
Pd Yb2 Al1 . . 2_555 46.063(11) ?
Pd Yb2 Al1 . . 3_554 133.94(2) ?
Pd Yb2 Al1 . . 3_555 133.94(2) ?
Pd Yb2 Al1 . . 4_554 90.000(6) ?
Pd Yb2 Al1 . . 4_555 90.000(6) ?
Pd Yb2 Al1 . . 5_554 133.937(11) ?
Pd Yb2 Al1 . . 5_555 133.937(11) ?
Pd Yb2 Al1 . . 6_554 46.06(2) ?
Pd Yb2 Al1 . . 6_555 46.06(2) ?
Pd Yb2 Pd 2_555 . 3_555 120.000(11) ?
Pd Yb2 Pd 2_555 . 4_555 60.000(11) ?
Pd Yb2 Pd 2_555 . 5_555 180.0(5) ?
Pd Yb2 Pd 2_555 . 6_555 60.000(11) ?
Pd Yb2 Al1 2_555 . 1_554 133.937(12) ?
Pd Yb2 Al1 2_555 . . 133.937(12) ?
Pd Yb2 Al1 2_555 . 2_554 90.000(8) ?
Pd Yb2 Al1 2_555 . 2_555 90.000(8) ?
Pd Yb2 Al1 2_555 . 3_554 46.06(2) ?
Pd Yb2 Al1 2_555 . 3_555 46.06(2) ?
Pd Yb2 Al1 2_555 . 4_554 46.063(12) ?
Pd Yb2 Al1 2_555 . 4_555 46.063(12) ?
Pd Yb2 Al1 2_555 . 5_554 90.000(8) ?
Pd Yb2 Al1 2_555 . 5_555 90.000(8) ?
Pd Yb2 Al1 2_555 . 6_554 133.94(2) ?
Pd Yb2 Al1 2_555 . 6_555 133.94(2) ?
Pd Yb2 Pd 3_555 . 4_555 60.000(9) ?
Pd Yb2 Pd 3_555 . 5_555 60.000(11) ?
Pd Yb2 Pd 3_555 . 6_555 180.0(5) ?
Pd Yb2 Al1 3_555 . 1_554 46.063(11) ?
Pd Yb2 Al1 3_555 . . 46.063(11) ?
Pd Yb2 Al1 3_555 . 2_554 133.937(11) ?
Pd Yb2 Al1 3_555 . 2_555 133.937(11) ?
Pd Yb2 Al1 3_555 . 3_554 90.00(3) ?
Pd Yb2 Al1 3_555 . 3_555 90.00(3) ?
Pd Yb2 Al1 3_555 . 4_554 133.937(11) ?
Pd Yb2 Al1 3_555 . 4_555 133.937(11) ?
Pd Yb2 Al1 3_555 . 5_554 46.063(11) ?
Pd Yb2 Al1 3_555 . 5_555 46.063(11) ?
Pd Yb2 Al1 3_555 . 6_554 90.00(3) ?
Pd Yb2 Al1 3_555 . 6_555 90.00(3) ?
Pd Yb2 Pd 4_555 . 5_555 120.000(11) ?
Pd Yb2 Pd 4_555 . 6_555 120.000(9) ?
Pd Yb2 Al1 4_555 . 1_554 90.000(6) ?
Pd Yb2 Al1 4_555 . . 90.000(6) ?
Pd Yb2 Al1 4_555 . 2_554 133.937(11) ?
Pd Yb2 Al1 4_555 . 2_555 133.937(11) ?
Pd Yb2 Al1 4_555 . 3_554 46.06(2) ?
Pd Yb2 Al1 4_555 . 3_555 46.06(2) ?
Pd Yb2 Al1 4_555 . 4_554 90.000(6) ?
Pd Yb2 Al1 4_555 . 4_555 90.000(6) ?
Pd Yb2 Al1 4_555 . 5_554 46.063(11) ?
Pd Yb2 Al1 4_555 . 5_555 46.063(11) ?
Pd Yb2 Al1 4_555 . 6_554 133.94(2) ?
Pd Yb2 Al1 4_555 . 6_555 133.94(2) ?
Pd Yb2 Pd 5_555 . 6_555 120.000(11) ?
Pd Yb2 Al1 5_555 . 1_554 46.063(12) ?
Pd Yb2 Al1 5_555 . . 46.063(12) ?
Pd Yb2 Al1 5_555 . 2_554 90.000(8) ?
Pd Yb2 Al1 5_555 . 2_555 90.000(8) ?
Pd Yb2 Al1 5_555 . 3_554 133.94(2) ?
Pd Yb2 Al1 5_555 . 3_555 133.94(2) ?
Pd Yb2 Al1 5_555 . 4_554 133.937(12) ?
Pd Yb2 Al1 5_555 . 4_555 133.937(12) ?
Pd Yb2 Al1 5_555 . 5_554 90.000(8) ?
Pd Yb2 Al1 5_555 . 5_555 90.000(8) ?
Pd Yb2 Al1 5_555 . 6_554 46.06(2) ?
Pd Yb2 Al1 5_555 . 6_555 46.06(2) ?
Pd Yb2 Al1 6_555 . 1_554 133.937(11) ?
Pd Yb2 Al1 6_555 . . 133.937(11) ?
Pd Yb2 Al1 6_555 . 2_554 46.063(11) ?
Pd Yb2 Al1 6_555 . 2_555 46.063(11) ?
Pd Yb2 Al1 6_555 . 3_554 90.00(3) ?
Pd Yb2 Al1 6_555 . 3_555 90.00(3) ?
Pd Yb2 Al1 6_555 . 4_554 46.063(11) ?
Pd Yb2 Al1 6_555 . 4_555 46.063(11) ?
Pd Yb2 Al1 6_555 . 5_554 133.937(11) ?
Pd Yb2 Al1 6_555 . 5_555 133.937(11) ?
Pd Yb2 Al1 6_555 . 6_554 90.00(3) ?
Pd Yb2 Al1 6_555 . 6_555 90.00(3) ?
Al1 Yb2 Al1 1_554 . . 73.51(2) ?
Al1 Yb2 Al1 1_554 . 2_554 87.873(15) ?
Al1 Yb2 Al1 1_554 . 2_555 132.768(8) ?
Al1 Yb2 Al1 1_554 . 3_554 87.87(2) ?
Al1 Yb2 Al1 1_554 . 3_555 132.77(3) ?
Al1 Yb2 Al1 1_554 . 4_554 106.49(2) ?
Al1 Yb2 Al1 1_554 . 4_555 180.0(5) ?
Al1 Yb2 Al1 1_554 . 5_554 47.231(8) ?
Al1 Yb2 Al1 1_554 . 5_555 92.127(15) ?
Al1 Yb2 Al1 1_554 . 6_554 47.23(3) ?
Al1 Yb2 Al1 1_554 . 6_555 92.13(2) ?
Al1 Yb2 Al1 . . 2_554 132.768(8) ?
Al1 Yb2 Al1 . . 2_555 87.873(15) ?
Al1 Yb2 Al1 . . 3_554 132.77(3) ?
Al1 Yb2 Al1 . . 3_555 87.87(2) ?
Al1 Yb2 Al1 . . 4_554 180.0(5) ?
Al1 Yb2 Al1 . . 4_555 106.49(2) ?
Al1 Yb2 Al1 . . 5_554 92.127(15) ?
Al1 Yb2 Al1 . . 5_555 47.231(8) ?
Al1 Yb2 Al1 . . 6_554 92.13(2) ?
Al1 Yb2 Al1 . . 6_555 47.23(3) ?
Al1 Yb2 Al1 2_554 . 2_555 73.51(2) ?
Al1 Yb2 Al1 2_554 . 3_554 87.87(2) ?
Al1 Yb2 Al1 2_554 . 3_555 132.77(3) ?
Al1 Yb2 Al1 2_554 . 4_554 47.231(8) ?
Al1 Yb2 Al1 2_554 . 4_555 92.127(15) ?
Al1 Yb2 Al1 2_554 . 5_554 106.49(2) ?
Al1 Yb2 Al1 2_554 . 5_555 180.0(5) ?
Al1 Yb2 Al1 2_554 . 6_554 47.23(3) ?
Al1 Yb2 Al1 2_554 . 6_555 92.13(2) ?
Al1 Yb2 Al1 2_555 . 3_554 132.77(3) ?
Al1 Yb2 Al1 2_555 . 3_555 87.87(2) ?
Al1 Yb2 Al1 2_555 . 4_554 92.127(15) ?
Al1 Yb2 Al1 2_555 . 4_555 47.231(8) ?
Al1 Yb2 Al1 2_555 . 5_554 180.0(5) ?
Al1 Yb2 Al1 2_555 . 5_555 106.49(2) ?
Al1 Yb2 Al1 2_555 . 6_554 92.13(2) ?
Al1 Yb2 Al1 2_555 . 6_555 47.23(3) ?
Al1 Yb2 Al1 3_554 . 3_555 73.510(16) ?
Al1 Yb2 Al1 3_554 . 4_554 47.23(3) ?
Al1 Yb2 Al1 3_554 . 4_555 92.13(2) ?
Al1 Yb2 Al1 3_554 . 5_554 47.23(3) ?
Al1 Yb2 Al1 3_554 . 5_555 92.13(2) ?
Al1 Yb2 Al1 3_554 . 6_554 106.490(16) ?
Al1 Yb2 Al1 3_554 . 6_555 180.0(5) ?
Al1 Yb2 Al1 3_555 . 4_554 92.13(2) ?
Al1 Yb2 Al1 3_555 . 4_555 47.23(3) ?
Al1 Yb2 Al1 3_555 . 5_554 92.13(2) ?
Al1 Yb2 Al1 3_555 . 5_555 47.23(3) ?
Al1 Yb2 Al1 3_555 . 6_554 180.0(5) ?
Al1 Yb2 Al1 3_555 . 6_555 106.490(16) ?
Al1 Yb2 Al1 4_554 . 4_555 73.51(2) ?
Al1 Yb2 Al1 4_554 . 5_554 87.873(15) ?
Al1 Yb2 Al1 4_554 . 5_555 132.768(8) ?
Al1 Yb2 Al1 4_554 . 6_554 87.87(2) ?
Al1 Yb2 Al1 4_554 . 6_555 132.77(3) ?
Al1 Yb2 Al1 4_555 . 5_554 132.768(8) ?
Al1 Yb2 Al1 4_555 . 5_555 87.873(15) ?
Al1 Yb2 Al1 4_555 . 6_554 132.77(3) ?
Al1 Yb2 Al1 4_555 . 6_555 87.87(2) ?
Al1 Yb2 Al1 5_554 . 5_555 73.51(2) ?
Al1 Yb2 Al1 5_554 . 6_554 87.87(2) ?
Al1 Yb2 Al1 5_554 . 6_555 132.77(3) ?
Al1 Yb2 Al1 5_555 . 6_554 132.77(3) ?
Al1 Yb2 Al1 5_555 . 6_555 87.87(2) ?
Al1 Yb2 Al1 6_554 . 6_555 73.510(16) ?
Pd Ca2 Pd . . 2_555 120.000(11) ?
Pd Ca2 Pd . . 3_555 120.000(9) ?
Pd Ca2 Pd . . 4_555 180.0(5) ?
Pd Ca2 Pd . . 5_555 60.000(11) ?
Pd Ca2 Pd . . 6_555 60.000(9) ?
Pd Ca2 Al1 . . 1_554 90.000(6) ?
Pd Ca2 Al1 . . . 90.000(6) ?
Pd Ca2 Al1 . . 2_554 46.063(11) ?
Pd Ca2 Al1 . . 2_555 46.063(11) ?
Pd Ca2 Al1 . . 3_554 133.94(2) ?
Pd Ca2 Al1 . . 3_555 133.94(2) ?
Pd Ca2 Al1 . . 4_554 90.000(6) ?
Pd Ca2 Al1 . . 4_555 90.000(6) ?
Pd Ca2 Al1 . . 5_554 133.937(11) ?
Pd Ca2 Al1 . . 5_555 133.937(11) ?
Pd Ca2 Al1 . . 6_554 46.06(2) ?
Pd Ca2 Al1 . . 6_555 46.06(2) ?
Pd Ca2 Pd 2_555 . 3_555 120.000(11) ?
Pd Ca2 Pd 2_555 . 4_555 60.000(11) ?
Pd Ca2 Pd 2_555 . 5_555 180.0(5) ?
Pd Ca2 Pd 2_555 . 6_555 60.000(11) ?
Pd Ca2 Al1 2_555 . 1_554 133.937(12) ?
Pd Ca2 Al1 2_555 . . 133.937(12) ?
Pd Ca2 Al1 2_555 . 2_554 90.000(8) ?
Pd Ca2 Al1 2_555 . 2_555 90.000(8) ?
Pd Ca2 Al1 2_555 . 3_554 46.06(2) ?
Pd Ca2 Al1 2_555 . 3_555 46.06(2) ?
Pd Ca2 Al1 2_555 . 4_554 46.063(12) ?
Pd Ca2 Al1 2_555 . 4_555 46.063(12) ?
Pd Ca2 Al1 2_555 . 5_554 90.000(8) ?
Pd Ca2 Al1 2_555 . 5_555 90.000(8) ?
Pd Ca2 Al1 2_555 . 6_554 133.94(2) ?
Pd Ca2 Al1 2_555 . 6_555 133.94(2) ?
Pd Ca2 Pd 3_555 . 4_555 60.000(9) ?
Pd Ca2 Pd 3_555 . 5_555 60.000(11) ?
Pd Ca2 Pd 3_555 . 6_555 180.0(5) ?
Pd Ca2 Al1 3_555 . 1_554 46.063(11) ?
Pd Ca2 Al1 3_555 . . 46.063(11) ?
Pd Ca2 Al1 3_555 . 2_554 133.937(11) ?
Pd Ca2 Al1 3_555 . 2_555 133.937(11) ?
Pd Ca2 Al1 3_555 . 3_554 90.00(3) ?
Pd Ca2 Al1 3_555 . 3_555 90.00(3) ?
Pd Ca2 Al1 3_555 . 4_554 133.937(11) ?
Pd Ca2 Al1 3_555 . 4_555 133.937(11) ?
Pd Ca2 Al1 3_555 . 5_554 46.063(11) ?
Pd Ca2 Al1 3_555 . 5_555 46.063(11) ?
Pd Ca2 Al1 3_555 . 6_554 90.00(3) ?
Pd Ca2 Al1 3_555 . 6_555 90.00(3) ?
Pd Ca2 Pd 4_555 . 5_555 120.000(11) ?
Pd Ca2 Pd 4_555 . 6_555 120.000(9) ?
Pd Ca2 Al1 4_555 . 1_554 90.000(6) ?
Pd Ca2 Al1 4_555 . . 90.000(6) ?
Pd Ca2 Al1 4_555 . 2_554 133.937(11) ?
Pd Ca2 Al1 4_555 . 2_555 133.937(11) ?
Pd Ca2 Al1 4_555 . 3_554 46.06(2) ?
Pd Ca2 Al1 4_555 . 3_555 46.06(2) ?
Pd Ca2 Al1 4_555 . 4_554 90.000(6) ?
Pd Ca2 Al1 4_555 . 4_555 90.000(6) ?
Pd Ca2 Al1 4_555 . 5_554 46.063(11) ?
Pd Ca2 Al1 4_555 . 5_555 46.063(11) ?
Pd Ca2 Al1 4_555 . 6_554 133.94(2) ?
Pd Ca2 Al1 4_555 . 6_555 133.94(2) ?
Pd Ca2 Pd 5_555 . 6_555 120.000(11) ?
Pd Ca2 Al1 5_555 . 1_554 46.063(12) ?
Pd Ca2 Al1 5_555 . . 46.063(12) ?
Pd Ca2 Al1 5_555 . 2_554 90.000(8) ?
Pd Ca2 Al1 5_555 . 2_555 90.000(8) ?
Pd Ca2 Al1 5_555 . 3_554 133.94(2) ?
Pd Ca2 Al1 5_555 . 3_555 133.94(2) ?
Pd Ca2 Al1 5_555 . 4_554 133.937(12) ?
Pd Ca2 Al1 5_555 . 4_555 133.937(12) ?
Pd Ca2 Al1 5_555 . 5_554 90.000(8) ?
Pd Ca2 Al1 5_555 . 5_555 90.000(8) ?
Pd Ca2 Al1 5_555 . 6_554 46.06(2) ?
Pd Ca2 Al1 5_555 . 6_555 46.06(2) ?
Pd Ca2 Al1 6_555 . 1_554 133.937(11) ?
Pd Ca2 Al1 6_555 . . 133.937(11) ?
Pd Ca2 Al1 6_555 . 2_554 46.063(11) ?
Pd Ca2 Al1 6_555 . 2_555 46.063(11) ?
Pd Ca2 Al1 6_555 . 3_554 90.00(3) ?
Pd Ca2 Al1 6_555 . 3_555 90.00(3) ?
Pd Ca2 Al1 6_555 . 4_554 46.063(11) ?
Pd Ca2 Al1 6_555 . 4_555 46.063(11) ?
Pd Ca2 Al1 6_555 . 5_554 133.937(11) ?
Pd Ca2 Al1 6_555 . 5_555 133.937(11) ?
Pd Ca2 Al1 6_555 . 6_554 90.00(3) ?
Pd Ca2 Al1 6_555 . 6_555 90.00(3) ?
Al1 Ca2 Al1 1_554 . . 73.51(2) ?
Al1 Ca2 Al1 1_554 . 2_554 87.873(15) ?
Al1 Ca2 Al1 1_554 . 2_555 132.768(8) ?
Al1 Ca2 Al1 1_554 . 3_554 87.87(2) ?
Al1 Ca2 Al1 1_554 . 3_555 132.77(3) ?
Al1 Ca2 Al1 1_554 . 4_554 106.49(2) ?
Al1 Ca2 Al1 1_554 . 4_555 180.0(5) ?
Al1 Ca2 Al1 1_554 . 5_554 47.231(8) ?
Al1 Ca2 Al1 1_554 . 5_555 92.127(15) ?
Al1 Ca2 Al1 1_554 . 6_554 47.23(3) ?
Al1 Ca2 Al1 1_554 . 6_555 92.13(2) ?
Al1 Ca2 Al1 . . 2_554 132.768(8) ?
Al1 Ca2 Al1 . . 2_555 87.873(15) ?
Al1 Ca2 Al1 . . 3_554 132.77(3) ?
Al1 Ca2 Al1 . . 3_555 87.87(2) ?
Al1 Ca2 Al1 . . 4_554 180.0(5) ?
Al1 Ca2 Al1 . . 4_555 106.49(2) ?
Al1 Ca2 Al1 . . 5_554 92.127(15) ?
Al1 Ca2 Al1 . . 5_555 47.231(8) ?
Al1 Ca2 Al1 . . 6_554 92.13(2) ?
Al1 Ca2 Al1 . . 6_555 47.23(3) ?
Al1 Ca2 Al1 2_554 . 2_555 73.51(2) ?
Al1 Ca2 Al1 2_554 . 3_554 87.87(2) ?
Al1 Ca2 Al1 2_554 . 3_555 132.77(3) ?
Al1 Ca2 Al1 2_554 . 4_554 47.231(8) ?
Al1 Ca2 Al1 2_554 . 4_555 92.127(15) ?
Al1 Ca2 Al1 2_554 . 5_554 106.49(2) ?
Al1 Ca2 Al1 2_554 . 5_555 180.0(5) ?
Al1 Ca2 Al1 2_554 . 6_554 47.23(3) ?
Al1 Ca2 Al1 2_554 . 6_555 92.13(2) ?
Al1 Ca2 Al1 2_555 . 3_554 132.77(3) ?
Al1 Ca2 Al1 2_555 . 3_555 87.87(2) ?
Al1 Ca2 Al1 2_555 . 4_554 92.127(15) ?
Al1 Ca2 Al1 2_555 . 4_555 47.231(8) ?
Al1 Ca2 Al1 2_555 . 5_554 180.0(5) ?
Al1 Ca2 Al1 2_555 . 5_555 106.49(2) ?
Al1 Ca2 Al1 2_555 . 6_554 92.13(2) ?
Al1 Ca2 Al1 2_555 . 6_555 47.23(3) ?
Al1 Ca2 Al1 3_554 . 3_555 73.510(16) ?
Al1 Ca2 Al1 3_554 . 4_554 47.23(3) ?
Al1 Ca2 Al1 3_554 . 4_555 92.13(2) ?
Al1 Ca2 Al1 3_554 . 5_554 47.23(3) ?
Al1 Ca2 Al1 3_554 . 5_555 92.13(2) ?
Al1 Ca2 Al1 3_554 . 6_554 106.490(16) ?
Al1 Ca2 Al1 3_554 . 6_555 180.0(5) ?
Al1 Ca2 Al1 3_555 . 4_554 92.13(2) ?
Al1 Ca2 Al1 3_555 . 4_555 47.23(3) ?
Al1 Ca2 Al1 3_555 . 5_554 92.13(2) ?
Al1 Ca2 Al1 3_555 . 5_555 47.23(3) ?
Al1 Ca2 Al1 3_555 . 6_554 180.0(5) ?
Al1 Ca2 Al1 3_555 . 6_555 106.490(16) ?
Al1 Ca2 Al1 4_554 . 4_555 73.51(2) ?
Al1 Ca2 Al1 4_554 . 5_554 87.873(15) ?
Al1 Ca2 Al1 4_554 . 5_555 132.768(8) ?
Al1 Ca2 Al1 4_554 . 6_554 87.87(2) ?
Al1 Ca2 Al1 4_554 . 6_555 132.77(3) ?
Al1 Ca2 Al1 4_555 . 5_554 132.768(8) ?
Al1 Ca2 Al1 4_555 . 5_555 87.873(15) ?
Al1 Ca2 Al1 4_555 . 6_554 132.77(3) ?
Al1 Ca2 Al1 4_555 . 6_555 87.87(2) ?
Al1 Ca2 Al1 5_554 . 5_555 73.51(2) ?
Al1 Ca2 Al1 5_554 . 6_554 87.87(2) ?
Al1 Ca2 Al1 5_554 . 6_555 132.77(3) ?
Al1 Ca2 Al1 5_555 . 6_554 132.77(3) ?
Al1 Ca2 Al1 5_555 . 6_555 87.87(2) ?
Al1 Ca2 Al1 6_554 . 6_555 73.510(16) ?
Yb1 Pd Yb1 1_554 . . 82.502(10) ?
Yb1 Pd Ca1 1_554 . 1_554 0.0(5) ?
Yb1 Pd Ca1 1_554 . . 82.502(10) ?
Yb1 Pd Yb2 1_554 . . 138.749(5) ?
Yb1 Pd Ca2 1_554 . . 138.749(5) ?
Yb1 Pd Pd 1_554 . 5_555 112.081(8) ?
Yb1 Pd Pd 1_554 . 6_555 112.081(10) ?
Yb1 Pd Al1 1_554 . 2_554 67.47(2) ?
Yb1 Pd Al1 1_554 . 2_555 133.61(4) ?
Yb1 Pd Al1 1_554 . 6_554 67.47(3) ?
Yb1 Pd Al1 1_554 . 6_555 133.61(2) ?
Yb1 Pd Al2 1_554 . 2_555 71.854(9) ?
Yb1 Pd Al2 1_554 . 3_665 71.854(6) ?
Yb1 Pd Ca1 . . 1_554 82.502(10) ?
Yb1 Pd Ca1 . . . 0.0(5) ?
Yb1 Pd Yb2 . . . 138.749(5) ?
Yb1 Pd Ca2 . . . 138.749(5) ?
Yb1 Pd Pd . . 5_555 112.081(8) ?
Yb1 Pd Pd . . 6_555 112.081(10) ?
Yb1 Pd Al1 . . 2_554 133.61(4) ?
Yb1 Pd Al1 . . 2_555 67.47(2) ?
Yb1 Pd Al1 . . 6_554 133.61(2) ?
Yb1 Pd Al1 . . 6_555 67.47(3) ?
Yb1 Pd Al2 . . 2_555 71.854(9) ?
Yb1 Pd Al2 . . 3_665 71.854(6) ?
Ca1 Pd Ca1 1_554 . . 82.502(10) ?
Ca1 Pd Yb2 1_554 . . 138.749(5) ?
Ca1 Pd Ca2 1_554 . . 138.749(5) ?
Ca1 Pd Pd 1_554 . 5_555 112.081(8) ?
Ca1 Pd Pd 1_554 . 6_555 112.081(10) ?
Ca1 Pd Al1 1_554 . 2_554 67.47(2) ?
Ca1 Pd Al1 1_554 . 2_555 133.61(4) ?
Ca1 Pd Al1 1_554 . 6_554 67.47(3) ?
Ca1 Pd Al1 1_554 . 6_555 133.61(2) ?
Ca1 Pd Al2 1_554 . 2_555 71.854(9) ?
Ca1 Pd Al2 1_554 . 3_665 71.854(6) ?
Ca1 Pd Yb2 . . . 138.749(5) ?
Ca1 Pd Ca2 . . . 138.749(5) ?
Ca1 Pd Pd . . 5_555 112.081(8) ?
Ca1 Pd Pd . . 6_555 112.081(10) ?
Ca1 Pd Al1 . . 2_554 133.61(4) ?
Ca1 Pd Al1 . . 2_555 67.47(2) ?
Ca1 Pd Al1 . . 6_554 133.61(2) ?
Ca1 Pd Al1 . . 6_555 67.47(3) ?
Ca1 Pd Al2 . . 2_555 71.854(9) ?
Ca1 Pd Al2 . . 3_665 71.854(6) ?
Yb2 Pd Ca2 . . . 0.0(5) ?
Yb2 Pd Pd . . 5_555 60.000(11) ?
Yb2 Pd Pd . . 6_555 60.000(8) ?
Yb2 Pd Al1 . . 2_554 78.24(3) ?
Yb2 Pd Al1 . . 2_555 78.24(3) ?
Yb2 Pd Al1 . . 6_554 78.24(3) ?
Yb2 Pd Al1 . . 6_555 78.24(3) ?
Yb2 Pd Al2 . . 2_555 114.472(8) ?
Yb2 Pd Al2 . . 3_665 114.472(14) ?
Ca2 Pd Pd . . 5_555 60.000(11) ?
Ca2 Pd Pd . . 6_555 60.000(8) ?
Ca2 Pd Al1 . . 2_554 78.24(3) ?
Ca2 Pd Al1 . . 2_555 78.24(3) ?
Ca2 Pd Al1 . . 6_554 78.24(3) ?
Ca2 Pd Al1 . . 6_555 78.24(3) ?
Ca2 Pd Al2 . . 2_555 114.472(8) ?
Ca2 Pd Al2 . . 3_665 114.472(14) ?
Pd Pd Pd 5_555 . 6_555 120.000(14) ?
Pd Pd Al1 5_555 . 2_554 111.70(3) ?
Pd Pd Al1 5_555 . 2_555 111.70(3) ?
Pd Pd Al1 5_555 . 6_554 55.00(3) ?
Pd Pd Al1 5_555 . 6_555 55.00(3) ?
Pd Pd Al2 5_555 . 2_555 174.472(11) ?
Pd Pd Al2 5_555 . 3_665 54.472(10) ?
Pd Pd Al1 6_555 . 2_554 54.999(5) ?
Pd Pd Al1 6_555 . 2_555 54.999(5) ?
Pd Pd Al1 6_555 . 6_554 111.70(2) ?
Pd Pd Al1 6_555 . 6_555 111.70(2) ?
Pd Pd Al2 6_555 . 2_555 54.472(9) ?
Pd Pd Al2 6_555 . 3_665 174.472(17) ?
Al1 Pd Al1 2_554 . 2_555 108.883(11) ?
Al1 Pd Al1 2_554 . 6_554 66.00(3) ?
Al1 Pd Al1 2_554 . 6_555 156.47(4) ?
Al1 Pd Al2 2_554 . 2_555 65.72(3) ?
Al1 Pd Al2 2_554 . 3_665 125.461(5) ?
Al1 Pd Al1 2_555 . 6_554 156.47(4) ?
Al1 Pd Al1 2_555 . 6_555 66.00(3) ?
Al1 Pd Al2 2_555 . 2_555 65.72(3) ?
Al1 Pd Al2 2_555 . 3_665 125.461(5) ?
Al1 Pd Al1 6_554 . 6_555 108.88(5) ?
Al1 Pd Al2 6_554 . 2_555 125.46(3) ?
Al1 Pd Al2 6_554 . 3_665 65.72(3) ?
Al1 Pd Al2 6_555 . 2_555 125.46(3) ?
Al1 Pd Al2 6_555 . 3_665 65.72(3) ?
Al2 Pd Al2 2_555 . 3_665 131.056(14) ?
Yb1 Al1 Yb1 1_545 . 4_665 111.41(4) ?
Yb1 Al1 Ca1 1_545 . 1_545 0.0(5) ?
Yb1 Al1 Ca1 1_545 . 4_665 111.41(4) ?
Yb1 Al1 Yb2 1_545 . . 116.838(11) ?
Yb1 Al1 Yb2 1_545 . 1_556 116.838(11) ?
Yb1 Al1 Ca2 1_545 . . 116.838(11) ?
Yb1 Al1 Ca2 1_545 . 1_556 116.838(11) ?
Yb1 Al1 Pd 1_545 . 3_555 65.171(15) ?
Yb1 Al1 Pd 1_545 . 3_556 65.171(15) ?
Yb1 Al1 Pd 1_545 . 5_555 121.86(3) ?
Yb1 Al1 Pd 1_545 . 5_556 121.86(3) ?
Yb1 Al1 Al1 1_545 . 4_655 55.70(2) ?
Yb1 Al1 Al1 1_545 . 5_555 64.30(3) ?
Yb1 Al1 Al1 1_545 . 6_555 175.70(5) ?
Yb1 Al1 Al2 1_545 . . 68.30(2) ?
Yb1 Al1 Al2 1_545 . 1_556 68.30(2) ?
Yb1 Al1 Ca1 4_665 . 1_545 111.41(4) ?
Yb1 Al1 Ca1 4_665 . 4_665 0.0(5) ?
Yb1 Al1 Yb2 4_665 . . 116.838(12) ?
Yb1 Al1 Yb2 4_665 . 1_556 116.838(12) ?
Yb1 Al1 Ca2 4_665 . . 116.838(12) ?
Yb1 Al1 Ca2 4_665 . 1_556 116.838(12) ?
Yb1 Al1 Pd 4_665 . 3_555 121.86(3) ?
Yb1 Al1 Pd 4_665 . 3_556 121.86(3) ?
Yb1 Al1 Pd 4_665 . 5_555 65.171(14) ?
Yb1 Al1 Pd 4_665 . 5_556 65.171(14) ?
Yb1 Al1 Al1 4_665 . 4_655 55.70(2) ?
Yb1 Al1 Al1 4_665 . 5_555 175.70(5) ?
Yb1 Al1 Al1 4_665 . 6_555 64.30(3) ?
Yb1 Al1 Al2 4_665 . . 68.30(2) ?
Yb1 Al1 Al2 4_665 . 1_556 68.30(2) ?
Ca1 Al1 Ca1 1_545 . 4_665 111.41(4) ?
Ca1 Al1 Yb2 1_545 . . 116.838(11) ?
Ca1 Al1 Yb2 1_545 . 1_556 116.838(11) ?
Ca1 Al1 Ca2 1_545 . . 116.838(11) ?
Ca1 Al1 Ca2 1_545 . 1_556 116.838(11) ?
Ca1 Al1 Pd 1_545 . 3_555 65.171(15) ?
Ca1 Al1 Pd 1_545 . 3_556 65.171(15) ?
Ca1 Al1 Pd 1_545 . 5_555 121.86(3) ?
Ca1 Al1 Pd 1_545 . 5_556 121.86(3) ?
Ca1 Al1 Al1 1_545 . 4_655 55.70(2) ?
Ca1 Al1 Al1 1_545 . 5_555 64.30(3) ?
Ca1 Al1 Al1 1_545 . 6_555 175.70(5) ?
Ca1 Al1 Al2 1_545 . . 68.30(2) ?
Ca1 Al1 Al2 1_545 . 1_556 68.30(2) ?
Ca1 Al1 Yb2 4_665 . . 116.838(12) ?
Ca1 Al1 Yb2 4_665 . 1_556 116.838(12) ?
Ca1 Al1 Ca2 4_665 . . 116.838(12) ?
Ca1 Al1 Ca2 4_665 . 1_556 116.838(12) ?
Ca1 Al1 Pd 4_665 . 3_555 121.86(3) ?
Ca1 Al1 Pd 4_665 . 3_556 121.86(3) ?
Ca1 Al1 Pd 4_665 . 5_555 65.171(14) ?
Ca1 Al1 Pd 4_665 . 5_556 65.171(14) ?
Ca1 Al1 Al1 4_665 . 4_655 55.70(2) ?
Ca1 Al1 Al1 4_665 . 5_555 175.70(5) ?
Ca1 Al1 Al1 4_665 . 6_555 64.30(3) ?
Ca1 Al1 Al2 4_665 . . 68.30(2) ?
Ca1 Al1 Al2 4_665 . 1_556 68.30(2) ?
Yb2 Al1 Yb2 . . 1_556 73.51(3) ?
Yb2 Al1 Ca2 . . . 0.0(5) ?
Yb2 Al1 Ca2 . . 1_556 73.51(3) ?
Yb2 Al1 Pd . . 3_555 55.70(2) ?
Yb2 Al1 Pd . . 3_556 114.21(4) ?
Yb2 Al1 Pd . . 5_555 55.70(2) ?
Yb2 Al1 Pd . . 5_556 114.21(4) ?
Yb2 Al1 Al1 . . 4_655 143.245(15) ?
Yb2 Al1 Al1 . . 5_555 66.38(3) ?
Yb2 Al1 Al1 . . 6_555 66.38(3) ?
Yb2 Al1 Al2 . . . 94.261(10) ?
Yb2 Al1 Al2 . . 1_556 167.77(4) ?
Yb2 Al1 Ca2 1_556 . . 73.51(3) ?
Yb2 Al1 Ca2 1_556 . 1_556 0.0(5) ?
Yb2 Al1 Pd 1_556 . 3_555 114.21(4) ?
Yb2 Al1 Pd 1_556 . 3_556 55.70(2) ?
Yb2 Al1 Pd 1_556 . 5_555 114.21(4) ?
Yb2 Al1 Pd 1_556 . 5_556 55.70(2) ?
Yb2 Al1 Al1 1_556 . 4_655 143.245(15) ?
Yb2 Al1 Al1 1_556 . 5_555 66.38(3) ?
Yb2 Al1 Al1 1_556 . 6_555 66.38(3) ?
Yb2 Al1 Al2 1_556 . . 167.77(4) ?
Yb2 Al1 Al2 1_556 . 1_556 94.261(10) ?
Ca2 Al1 Ca2 . . 1_556 73.51(3) ?
Ca2 Al1 Pd . . 3_555 55.70(2) ?
Ca2 Al1 Pd . . 3_556 114.21(4) ?
Ca2 Al1 Pd . . 5_555 55.70(2) ?
Ca2 Al1 Pd . . 5_556 114.21(4) ?
Ca2 Al1 Al1 . . 4_655 143.245(15) ?
Ca2 Al1 Al1 . . 5_555 66.38(3) ?
Ca2 Al1 Al1 . . 6_555 66.38(3) ?
Ca2 Al1 Al2 . . . 94.261(10) ?
Ca2 Al1 Al2 . . 1_556 167.77(4) ?
Ca2 Al1 Pd 1_556 . 3_555 114.21(4) ?
Ca2 Al1 Pd 1_556 . 3_556 55.70(2) ?
Ca2 Al1 Pd 1_556 . 5_555 114.21(4) ?
Ca2 Al1 Pd 1_556 . 5_556 55.70(2) ?
Ca2 Al1 Al1 1_556 . 4_655 143.245(15) ?
Ca2 Al1 Al1 1_556 . 5_555 66.38(3) ?
Ca2 Al1 Al1 1_556 . 6_555 66.38(3) ?
Ca2 Al1 Al2 1_556 . . 167.77(4) ?
Ca2 Al1 Al2 1_556 . 1_556 94.261(10) ?
Pd Al1 Pd 3_555 . 3_556 108.883(12) ?
Pd Al1 Pd 3_555 . 5_555 70.003(11) ?
Pd Al1 Pd 3_555 . 5_556 169.01(7) ?
Pd Al1 Al1 3_555 . 4_655 95.49(3) ?
Pd Al1 Al1 3_555 . 5_555 57.001(14) ?
Pd Al1 Al1 3_555 . 6_555 116.67(3) ?
Pd Al1 Al2 3_555 . . 56.565(15) ?
Pd Al1 Al2 3_555 . 1_556 132.58(4) ?
Pd Al1 Pd 3_556 . 5_555 169.01(7) ?
Pd Al1 Pd 3_556 . 5_556 70.003(11) ?
Pd Al1 Al1 3_556 . 4_655 95.49(3) ?
Pd Al1 Al1 3_556 . 5_555 57.001(14) ?
Pd Al1 Al1 3_556 . 6_555 116.67(3) ?
Pd Al1 Al2 3_556 . . 132.58(4) ?
Pd Al1 Al2 3_556 . 1_556 56.565(15) ?
Pd Al1 Pd 5_555 . 5_556 108.883(15) ?
Pd Al1 Al1 5_555 . 4_655 95.49(3) ?
Pd Al1 Al1 5_555 . 5_555 116.67(3) ?
Pd Al1 Al1 5_555 . 6_555 57.001(16) ?
Pd Al1 Al2 5_555 . . 56.565(15) ?
Pd Al1 Al2 5_555 . 1_556 132.58(4) ?
Pd Al1 Al1 5_556 . 4_655 95.49(3) ?
Pd Al1 Al1 5_556 . 5_555 116.67(3) ?
Pd Al1 Al1 5_556 . 6_555 57.001(16) ?
Pd Al1 Al2 5_556 . . 132.58(4) ?
Pd Al1 Al2 5_556 . 1_556 56.565(15) ?
Al1 Al1 Al1 4_655 . 5_555 120.00(4) ?
Al1 Al1 Al1 4_655 . 6_555 120.00(4) ?
Al1 Al1 Al2 4_655 . . 48.98(2) ?
Al1 Al1 Al2 4_655 . 1_556 48.98(2) ?
Al1 Al1 Al1 5_555 . 6_555 120.00(6) ?
Al1 Al1 Al2 5_555 . . 109.156(17) ?
Al1 Al1 Al2 5_555 . 1_556 109.156(17) ?
Al1 Al1 Al2 6_555 . . 109.156(17) ?
Al1 Al1 Al2 6_555 . 1_556 109.156(17) ?
Al2 Al1 Al2 . . 1_556 97.97(5) ?
Yb1 Al2 Yb1 1_544 . 1_545 76.207(7) ?
Yb1 Al2 Yb1 1_544 . 4_664 103.793(7) ?
Yb1 Al2 Yb1 1_544 . 4_665 180.0(5) ?
Yb1 Al2 Ca1 1_544 . 1_544 0.0(5) ?
Yb1 Al2 Ca1 1_544 . 1_545 76.207(7) ?
Yb1 Al2 Ca1 1_544 . 4_664 103.793(7) ?
Yb1 Al2 Ca1 1_544 . 4_665 180.0(5) ?
Yb1 Al2 Pd 1_544 . 2_655 62.789(6) ?
Yb1 Al2 Pd 1_544 . 3_555 62.789(7) ?
Yb1 Al2 Pd 1_544 . 5_555 117.211(6) ?
Yb1 Al2 Pd 1_544 . 6_655 117.211(7) ?
Yb1 Al2 Al1 1_544 . 1_554 62.251(11) ?
Yb1 Al2 Al1 1_544 . . 117.749(12) ?
Yb1 Al2 Al1 1_544 . 4_654 62.251(12) ?
Yb1 Al2 Al1 1_544 . 4_655 117.749(11) ?
Yb1 Al2 Yb1 1_545 . 4_664 180.0(5) ?
Yb1 Al2 Yb1 1_545 . 4_665 103.793(7) ?
Yb1 Al2 Ca1 1_545 . 1_544 76.207(7) ?
Yb1 Al2 Ca1 1_545 . 1_545 0.0(5) ?
Yb1 Al2 Ca1 1_545 . 4_664 180.0(5) ?
Yb1 Al2 Ca1 1_545 . 4_665 103.793(7) ?
Yb1 Al2 Pd 1_545 . 2_655 62.789(6) ?
Yb1 Al2 Pd 1_545 . 3_555 62.789(7) ?
Yb1 Al2 Pd 1_545 . 5_555 117.211(6) ?
Yb1 Al2 Pd 1_545 . 6_655 117.211(7) ?
Yb1 Al2 Al1 1_545 . 1_554 117.749(12) ?
Yb1 Al2 Al1 1_545 . . 62.251(11) ?
Yb1 Al2 Al1 1_545 . 4_654 117.749(11) ?
Yb1 Al2 Al1 1_545 . 4_655 62.251(12) ?
Yb1 Al2 Yb1 4_664 . 4_665 76.207(7) ?
Yb1 Al2 Ca1 4_664 . 1_544 103.793(7) ?
Yb1 Al2 Ca1 4_664 . 1_545 180.0(5) ?
Yb1 Al2 Ca1 4_664 . 4_664 0.0(5) ?
Yb1 Al2 Ca1 4_664 . 4_665 76.207(7) ?
Yb1 Al2 Pd 4_664 . 2_655 117.211(6) ?
Yb1 Al2 Pd 4_664 . 3_555 117.211(7) ?
Yb1 Al2 Pd 4_664 . 5_555 62.789(6) ?
Yb1 Al2 Pd 4_664 . 6_655 62.789(7) ?
Yb1 Al2 Al1 4_664 . 1_554 62.251(12) ?
Yb1 Al2 Al1 4_664 . . 117.749(11) ?
Yb1 Al2 Al1 4_664 . 4_654 62.251(11) ?
Yb1 Al2 Al1 4_664 . 4_655 117.749(12) ?
Yb1 Al2 Ca1 4_665 . 1_544 180.0(5) ?
Yb1 Al2 Ca1 4_665 . 1_545 103.793(7) ?
Yb1 Al2 Ca1 4_665 . 4_664 76.207(7) ?
Yb1 Al2 Ca1 4_665 . 4_665 0.0(5) ?
Yb1 Al2 Pd 4_665 . 2_655 117.211(6) ?
Yb1 Al2 Pd 4_665 . 3_555 117.211(7) ?
Yb1 Al2 Pd 4_665 . 5_555 62.789(6) ?
Yb1 Al2 Pd 4_665 . 6_655 62.789(7) ?
Yb1 Al2 Al1 4_665 . 1_554 117.749(11) ?
Yb1 Al2 Al1 4_665 . . 62.251(12) ?
Yb1 Al2 Al1 4_665 . 4_654 117.749(12) ?
Yb1 Al2 Al1 4_665 . 4_655 62.251(11) ?
Ca1 Al2 Ca1 1_544 . 1_545 76.207(7) ?
Ca1 Al2 Ca1 1_544 . 4_664 103.793(7) ?
Ca1 Al2 Ca1 1_544 . 4_665 180.0(5) ?
Ca1 Al2 Pd 1_544 . 2_655 62.789(6) ?
Ca1 Al2 Pd 1_544 . 3_555 62.789(7) ?
Ca1 Al2 Pd 1_544 . 5_555 117.211(6) ?
Ca1 Al2 Pd 1_544 . 6_655 117.211(7) ?
Ca1 Al2 Al1 1_544 . 1_554 62.251(11) ?
Ca1 Al2 Al1 1_544 . . 117.749(12) ?
Ca1 Al2 Al1 1_544 . 4_654 62.251(12) ?
Ca1 Al2 Al1 1_544 . 4_655 117.749(11) ?
Ca1 Al2 Ca1 1_545 . 4_664 180.0(5) ?
Ca1 Al2 Ca1 1_545 . 4_665 103.793(7) ?
Ca1 Al2 Pd 1_545 . 2_655 62.789(6) ?
Ca1 Al2 Pd 1_545 . 3_555 62.789(7) ?
Ca1 Al2 Pd 1_545 . 5_555 117.211(6) ?
Ca1 Al2 Pd 1_545 . 6_655 117.211(7) ?
Ca1 Al2 Al1 1_545 . 1_554 117.749(12) ?
Ca1 Al2 Al1 1_545 . . 62.251(11) ?
Ca1 Al2 Al1 1_545 . 4_654 117.749(11) ?
Ca1 Al2 Al1 1_545 . 4_655 62.251(12) ?
Ca1 Al2 Ca1 4_664 . 4_665 76.207(7) ?
Ca1 Al2 Pd 4_664 . 2_655 117.211(6) ?
Ca1 Al2 Pd 4_664 . 3_555 117.211(7) ?
Ca1 Al2 Pd 4_664 . 5_555 62.789(6) ?
Ca1 Al2 Pd 4_664 . 6_655 62.789(7) ?
Ca1 Al2 Al1 4_664 . 1_554 62.251(12) ?
Ca1 Al2 Al1 4_664 . . 117.749(11) ?
Ca1 Al2 Al1 4_664 . 4_654 62.251(11) ?
Ca1 Al2 Al1 4_664 . 4_655 117.749(12) ?
Ca1 Al2 Pd 4_665 . 2_655 117.211(6) ?
Ca1 Al2 Pd 4_665 . 3_555 117.211(7) ?
Ca1 Al2 Pd 4_665 . 5_555 62.789(6) ?
Ca1 Al2 Pd 4_665 . 6_655 62.789(7) ?
Ca1 Al2 Al1 4_665 . 1_554 117.749(11) ?
Ca1 Al2 Al1 4_665 . . 62.251(12) ?
Ca1 Al2 Al1 4_665 . 4_654 117.749(12) ?
Ca1 Al2 Al1 4_665 . 4_655 62.251(11) ?
Pd Al2 Pd 2_655 . 3_555 108.944(11) ?
Pd Al2 Pd 2_655 . 5_555 180.0(5) ?
Pd Al2 Pd 2_655 . 6_655 71.056(11) ?
Pd Al2 Al1 2_655 . 1_554 122.283(17) ?
Pd Al2 Al1 2_655 . . 122.283(17) ?
Pd Al2 Al1 2_655 . 4_654 57.717(17) ?
Pd Al2 Al1 2_655 . 4_655 57.717(17) ?
Pd Al2 Pd 3_555 . 5_555 71.056(11) ?
Pd Al2 Pd 3_555 . 6_655 180.0(5) ?
Pd Al2 Al1 3_555 . 1_554 57.717(17) ?
Pd Al2 Al1 3_555 . . 57.717(17) ?
Pd Al2 Al1 3_555 . 4_654 122.283(17) ?
Pd Al2 Al1 3_555 . 4_655 122.283(17) ?
Pd Al2 Pd 5_555 . 6_655 108.944(11) ?
Pd Al2 Al1 5_555 . 1_554 57.717(17) ?
Pd Al2 Al1 5_555 . . 57.717(17) ?
Pd Al2 Al1 5_555 . 4_654 122.283(17) ?
Pd Al2 Al1 5_555 . 4_655 122.283(17) ?
Pd Al2 Al1 6_655 . 1_554 122.283(17) ?
Pd Al2 Al1 6_655 . . 122.283(17) ?
Pd Al2 Al1 6_655 . 4_654 57.717(17) ?
Pd Al2 Al1 6_655 . 4_655 57.717(17) ?
Al1 Al2 Al1 1_554 . . 97.97(3) ?
Al1 Al2 Al1 1_554 . 4_654 82.03(3) ?
Al1 Al2 Al1 1_554 . 4_655 180.0(5) ?
Al1 Al2 Al1 . . 4_654 180.0(5) ?
Al1 Al2 Al1 . . 4_655 82.03(3) ?
Al1 Al2 Al1 4_654 . 4_655 97.97(3) ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion
_geom_torsion_publ_flag
? ? ? ? ? ? ? ? ? ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_D
_geom_hbond_site_symmetry_H
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_publ_flag
? ? ? ? ? ? ? ? ? ? ?


####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_I_CCDC2
_database_code_depnum_ccdc_archive 'CCDC 1880785'
loop_
_audit_author_name
_audit_author_address
'Oliver Janka'
;WWU Muenster
Germany
;
_audit_update_record             
;
2019-04-17 deposited with the CCDC.	2019-10-14 downloaded from the CCDC.
;
#=======================================================================

# 5. CHEMICAL DATA

_chemical_name_systematic        
; ?
;
_chemical_name_common            ?
_chemical_formula_moiety         ?
_chemical_formula_structural     ?
_chemical_formula_analytical     ?
_chemical_formula_iupac          ?
_chemical_formula_sum            'Al3 Pd2 Yb1'
_chemical_formula_weight         466.8
_chemical_melting_point          ?
_chemical_compound_source        ?
_chemical_absolute_configuration .

#=======================================================================

# 6. CRYSTAL DATA

_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_H-M   'P 6/m m m'
_symmetry_space_group_name_Hall  '-P 6;-2'
_symmetry_Int_Tables_number      191

loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -y,x-y,z
3 -x+y,-x,z
4 -x,-y,z
5 y,-x+y,z
6 x-y,x,z
7 y,x,-z
8 x-y,-y,-z
9 -x,-x+y,-z
10 -y,-x,-z
11 -x+y,y,-z
12 x,x-y,-z
13 -x,-y,-z
14 y,-x+y,-z
15 x-y,x,-z
16 x,y,-z
17 -y,x-y,-z
18 -x+y,-x,-z
19 -y,-x,z
20 -x+y,y,z
21 x,x-y,z
22 y,x,z
23 x-y,-y,z
24 -x,-x+y,z

_cell_length_a                   9.2802(6)
_cell_length_b                   9.2802(6)
_cell_length_c                   4.1956(3)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_volume                     312.92(4)

loop_
_twin_individual_id
_twin_individual_mass_fraction_refined
_twin_individual_twin_matrix_11
_twin_individual_twin_matrix_12
_twin_individual_twin_matrix_13
_twin_individual_twin_matrix_21
_twin_individual_twin_matrix_22
_twin_individual_twin_matrix_23
_twin_individual_twin_matrix_31
_twin_individual_twin_matrix_32
_twin_individual_twin_matrix_33
? ? ? ? ? ? ? ? ? ? ?

_cell_formula_units_Z            3

_cell_measurement_reflns_used    10365
_cell_measurement_theta_min      2.54
_cell_measurement_theta_max      33.91
_cell_measurement_temperature    140
_cell_special_details            
; ?
;

_exptl_crystal_density_diffrn    7.43
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_F_000             603

_exptl_absorpt_coefficient_mu    31.2
_exptl_crystal_description       plate
_exptl_crystal_size_max          0.120
_exptl_crystal_size_mid          0.075
_exptl_crystal_size_min          0.025
_exptl_crystal_size_rad          ?
_exptl_crystal_colour            silver
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   ?
_exptl_absorpt_correction_T_min  0.0991
_exptl_absorpt_correction_T_max  0.4928
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
? ? ? ?

#=======================================================================

# 7. EXPERIMENTAL DATA

_exptl_special_details           ?

_diffrn_ambient_temperature      140
_diffrn_source                   ?
_diffrn_source_power             ?
_diffrn_source_voltage           ?
_diffrn_source_current           ?
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_source         'X-ray tube'
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'Stoe StadiVari'
_diffrn_detector                 ?
_diffrn_detector_area_resol_mean ?
_diffrn_measurement_method       '??integration method??'
_diffrn_measurement_specimen_support ?

_diffrn_reflns_number            5089
_diffrn_reflns_theta_min         2.53
_diffrn_reflns_theta_max         33.24
_diffrn_reflns_theta_full        33.24
_diffrn_measured_fraction_theta_max 1
_diffrn_measured_fraction_theta_full 1
_diffrn_reflns_av_R_equivalents  0.0401
_diffrn_reflns_av_unetI/netI     0.0041
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_l_min       -6
_diffrn_reflns_limit_l_max       6
_diffrn_reflns_reduction_process ?

_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
loop_
_diffrn_standard_refln_index_h
_diffrn_standard_refln_index_k
_diffrn_standard_refln_index_l
? ? ?

_diffrn_radiation_probe          X-ray

#=======================================================================

# 8. REFINEMENT DATA

_refine_special_details          
; ?
;

_reflns_number_total             282
_reflns_number_gt                277
_reflns_threshold_expression     I>3σ(I)

_refine_ls_structure_factor_coef Fsqd
_refine_ls_R_factor_gt           0.0166
_refine_ls_wR_factor_gt          0.0422
_refine_ls_R_factor_all          0.0177
_refine_ls_wR_factor_ref         0.0427
_refine_ls_goodness_of_fit_ref   1.81
_refine_ls_goodness_of_fit_gt    1.81
_refine_ls_restrained_S_gt       ?
_refine_ls_restrained_S_all      ?
_refine_ls_number_reflns         282
_refine_ls_number_parameters     17
_refine_ls_number_restraints     0
_refine_ls_number_constraints    0
_refine_ls_weighting_scheme      sigma
_refine_ls_weighting_details     w=1/(σ²(I)+0.0004I²)
_refine_ls_hydrogen_treatment    ?
_refine_ls_shift/su_max          0.0005
_refine_ls_shift/su_mean         0.0001
_refine_diff_density_max         1.33
_refine_diff_density_min         -1.41
_refine_ls_extinction_method     
'B-C type 1 Lorentzian isotropic (Becker & Coppens, 1974)'
_refine_ls_extinction_coef       650(30)
_refine_ls_abs_structure_details ?
_refine_ls_abs_structure_Flack   ?
_refine_ls_abs_structure_Rogers  ?

loop_
_atom_type_symbol
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Al 0.0645 0.0514 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Pd -0.9988 1.0072 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Yb -0.3850 5.5486 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    ?
_computing_structure_refinement  ?
_computing_molecular_graphics    ?
_computing_publication_material  ?

loop_
_restr_distance_atom_site_label_1
_restr_distance_site_symmetry_1
_restr_distance_atom_site_label_2
_restr_distance_site_symmetry_2
_restr_distance_target
_restr_distance_target_weight_param
? ? ? ? ? ?

loop_
_restr_angle_atom_site_label_1
_restr_angle_site_symmetry_1
_restr_angle_atom_site_label_2
_restr_angle_site_symmetry_2
_restr_angle_atom_site_label_3
_restr_angle_site_symmetry_3
_restr_angle_target
_restr_angle_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_torsion_atom_site_label_1
_restr_torsion_site_symmetry_1
_restr_torsion_atom_site_label_2
_restr_torsion_site_symmetry_2
_restr_torsion_atom_site_label_3
_restr_torsion_site_symmetry_3
_restr_torsion_atom_site_label_4
_restr_torsion_site_symmetry_4
_restr_torsion_angle_target
_restr_torsion_weight_param
? ? ? ? ? ? ? ? ? ?

loop_
_restr_equal_distance_atom_site_label_1
_restr_equal_distance_site_symmetry_1
_restr_equal_distance_atom_site_label_2
_restr_equal_distance_site_symmetry_2
_restr_equal_distance_class_class_id
_restr_equal_distance_class_target_weight_param
? ? ? ? ? ?

loop_
_restr_equal_angle_atom_site_label_1
_restr_equal_angle_site_symmetry_1
_restr_equal_angle_atom_site_label_2
_restr_equal_angle_site_symmetry_2
_restr_equal_angle_atom_site_label_3
_restr_equal_angle_site_symmetry_3
_restr_equal_angle_class_class_id
_restr_equal_angle_class_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_equal_torsion_atom_site_label_1
_restr_equal_torsion_site_symmetry_1
_restr_equal_torsion_atom_site_label_2
_restr_equal_torsion_site_symmetry_2
_restr_equal_torsion_atom_site_label_3
_restr_equal_torsion_site_symmetry_3
_restr_equal_torsion_atom_site_label_4
_restr_equal_torsion_site_symmetry_4
_restr_equal_torsion_class_class_id
_restr_equal_torsion_class_target_weight_param
? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 9. ATOMIC COORDINATES AND DISPLACEMENT PARAMETERS

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_adp_type
_atom_site_U_iso_or_equiv
_atom_site_site_symmetry_multiplicity
_atom_site_occupancy
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Yb1 Yb 0.333333 0.666667 0.5 Uani 0.01222(11) 2 1 d . . .
Yb2 Yb 0 0 0 Uani 0.01374(14) 1 1 d . . .
Pd Pd 0.18577(2) 0.37154(5) 0 Uani 0.01171(13) 6 1 d . . .
Al1 Al 0.30443(18) 0 0.5 Uani 0.0129(4) 6 1 d . . .
Al2 Al 0.5 0 0 Uani 0.0131(6) 3 1 d . . .


loop_
_jana_atom_site_ADP_C_label
_jana_atom_site_ADP_C_type_symbol
_jana_atom_site_ADP_C_111
_jana_atom_site_ADP_C_112
_jana_atom_site_ADP_C_113
_jana_atom_site_ADP_C_122
_jana_atom_site_ADP_C_123
_jana_atom_site_ADP_C_133
_jana_atom_site_ADP_C_222
_jana_atom_site_ADP_C_223
_jana_atom_site_ADP_C_233
_jana_atom_site_ADP_C_333
? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_D_label
_jana_atom_site_ADP_D_type_symbol
_jana_atom_site_ADP_D_1111
_jana_atom_site_ADP_D_1112
_jana_atom_site_ADP_D_1113
_jana_atom_site_ADP_D_1122
_jana_atom_site_ADP_D_1123
_jana_atom_site_ADP_D_1133
_jana_atom_site_ADP_D_1222
_jana_atom_site_ADP_D_1223
_jana_atom_site_ADP_D_1233
_jana_atom_site_ADP_D_1333
_jana_atom_site_ADP_D_2222
_jana_atom_site_ADP_D_2223
_jana_atom_site_ADP_D_2233
_jana_atom_site_ADP_D_2333
_jana_atom_site_ADP_D_3333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_E_label
_jana_atom_site_ADP_E_type_symbol
_jana_atom_site_ADP_E_11111
_jana_atom_site_ADP_E_11112
_jana_atom_site_ADP_E_11113
_jana_atom_site_ADP_E_11122
_jana_atom_site_ADP_E_11123
_jana_atom_site_ADP_E_11133
_jana_atom_site_ADP_E_11222
_jana_atom_site_ADP_E_11223
_jana_atom_site_ADP_E_11233
_jana_atom_site_ADP_E_11333
_jana_atom_site_ADP_E_12222
_jana_atom_site_ADP_E_12223
_jana_atom_site_ADP_E_12233
_jana_atom_site_ADP_E_12333
_jana_atom_site_ADP_E_13333
_jana_atom_site_ADP_E_22222
_jana_atom_site_ADP_E_22223
_jana_atom_site_ADP_E_22233
_jana_atom_site_ADP_E_22333
_jana_atom_site_ADP_E_23333
_jana_atom_site_ADP_E_33333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_F_label
_jana_atom_site_ADP_F_type_symbol
_jana_atom_site_ADP_F_111111
_jana_atom_site_ADP_F_111112
_jana_atom_site_ADP_F_111113
_jana_atom_site_ADP_F_111122
_jana_atom_site_ADP_F_111123
_jana_atom_site_ADP_F_111133
_jana_atom_site_ADP_F_111222
_jana_atom_site_ADP_F_111223
_jana_atom_site_ADP_F_111233
_jana_atom_site_ADP_F_111333
_jana_atom_site_ADP_F_112222
_jana_atom_site_ADP_F_112223
_jana_atom_site_ADP_F_112233
_jana_atom_site_ADP_F_112333
_jana_atom_site_ADP_F_113333
_jana_atom_site_ADP_F_122222
_jana_atom_site_ADP_F_122223
_jana_atom_site_ADP_F_122233
_jana_atom_site_ADP_F_122333
_jana_atom_site_ADP_F_123333
_jana_atom_site_ADP_F_133333
_jana_atom_site_ADP_F_222222
_jana_atom_site_ADP_F_222223
_jana_atom_site_ADP_F_222233
_jana_atom_site_ADP_F_222333
_jana_atom_site_ADP_F_223333
_jana_atom_site_ADP_F_233333
_jana_atom_site_ADP_F_333333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 10. MOLECULAR GEOMETRY


loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Yb1 Pd . . 3.1665(5) ?
Yb1 Pd . 1_556 3.1665(5) ?
Yb1 Pd . 2_665 3.1665(5) ?
Yb1 Pd . 2_666 3.1665(5) ?
Yb1 Pd . 3_565 3.1665(4) ?
Yb1 Pd . 3_566 3.1665(4) ?
Yb1 Al1 . 1_565 3.2359(10) ?
Yb1 Al1 . 2_555 3.2359(11) ?
Yb1 Al1 . 3_665 3.2359(18) ?
Yb1 Al1 . 4_665 3.2359(11) ?
Yb1 Al1 . 5_565 3.2359(10) ?
Yb1 Al1 . 6_555 3.2359(18) ?
Yb1 Al2 . 1_565 3.4026(4) ?
Yb1 Al2 . 1_566 3.4026(4) ?
Yb1 Al2 . 2_555 3.4026(4) ?
Yb1 Al2 . 2_556 3.4026(4) ?
Yb1 Al2 . 3_665 3.4026(2) ?
Yb1 Al2 . 3_666 3.4026(2) ?
Yb2 Pd . . 2.9860(7) ?
Yb2 Pd . 2_555 2.9860(7) ?
Yb2 Pd . 3_555 2.9860(5) ?
Yb2 Pd . 4_555 2.9860(7) ?
Yb2 Pd . 5_555 2.9860(7) ?
Yb2 Pd . 6_555 2.9860(5) ?
Yb2 Al1 . 1_554 3.5188(14) ?
Yb2 Al1 . . 3.5188(14) ?
Yb2 Al1 . 2_554 3.5188(14) ?
Yb2 Al1 . 2_555 3.5188(14) ?
Yb2 Al1 . 3_554 3.5188(10) ?
Yb2 Al1 . 3_555 3.5188(10) ?
Yb2 Al1 . 4_554 3.5188(14) ?
Yb2 Al1 . 4_555 3.5188(14) ?
Yb2 Al1 . 5_554 3.5188(14) ?
Yb2 Al1 . 5_555 3.5188(14) ?
Yb2 Al1 . 6_554 3.5188(10) ?
Yb2 Al1 . 6_555 3.5188(10) ?
Pd Pd . 5_555 2.9860(7) ?
Pd Pd . 6_555 2.9860(7) ?
Pd Al1 . 2_554 2.5859(3) ?
Pd Al1 . 2_555 2.5859(3) ?
Pd Al1 . 6_554 2.5859(12) ?
Pd Al1 . 6_555 2.5859(12) ?
Pd Al2 . 2_555 2.5394(4) ?
Pd Al2 . 3_665 2.5394(5) ?
Al1 Al1 . 4_655 3.630(2) ?
Al1 Al1 . 5_555 2.8251(13) ?
Al1 Al1 . 6_555 2.825(2) ?
Al1 Al2 . . 2.7740(11) ?
Al1 Al2 . 1_556 2.7740(11) ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
Pd Yb1 Pd . . 1_556 82.981(9) ?
Pd Yb1 Pd . . 2_665 80.889(9) ?
Pd Yb1 Pd . . 2_666 136.009(12) ?
Pd Yb1 Pd . . 3_565 80.889(9) ?
Pd Yb1 Pd . . 3_566 136.009(9) ?
Pd Yb1 Al1 . . 1_565 128.327(15) ?
Pd Yb1 Al1 . . 2_555 47.629(12) ?
Pd Yb1 Al1 . . 3_665 93.08(2) ?
Pd Yb1 Al1 . . 4_665 128.327(14) ?
Pd Yb1 Al1 . . 5_565 93.083(19) ?
Pd Yb1 Al1 . . 6_555 47.629(14) ?
Pd Yb1 Al2 . . 1_565 100.446(8) ?
Pd Yb1 Al2 . . 1_566 176.573(5) ?
Pd Yb1 Al2 . . 2_555 45.305(7) ?
Pd Yb1 Al2 . . 2_556 96.521(7) ?
Pd Yb1 Al2 . . 3_665 45.305(6) ?
Pd Yb1 Al2 . . 3_666 96.521(8) ?
Pd Yb1 Pd 1_556 . 2_665 136.009(12) ?
Pd Yb1 Pd 1_556 . 2_666 80.889(9) ?
Pd Yb1 Pd 1_556 . 3_565 136.009(9) ?
Pd Yb1 Pd 1_556 . 3_566 80.889(9) ?
Pd Yb1 Al1 1_556 . 1_565 128.327(15) ?
Pd Yb1 Al1 1_556 . 2_555 47.629(12) ?
Pd Yb1 Al1 1_556 . 3_665 93.08(2) ?
Pd Yb1 Al1 1_556 . 4_665 128.327(14) ?
Pd Yb1 Al1 1_556 . 5_565 93.083(19) ?
Pd Yb1 Al1 1_556 . 6_555 47.629(14) ?
Pd Yb1 Al2 1_556 . 1_565 176.573(5) ?
Pd Yb1 Al2 1_556 . 1_566 100.446(8) ?
Pd Yb1 Al2 1_556 . 2_555 96.521(7) ?
Pd Yb1 Al2 1_556 . 2_556 45.305(7) ?
Pd Yb1 Al2 1_556 . 3_665 96.521(8) ?
Pd Yb1 Al2 1_556 . 3_666 45.305(6) ?
Pd Yb1 Pd 2_665 . 2_666 82.981(9) ?
Pd Yb1 Pd 2_665 . 3_565 80.889(12) ?
Pd Yb1 Pd 2_665 . 3_566 136.009(10) ?
Pd Yb1 Al1 2_665 . 1_565 93.08(2) ?
Pd Yb1 Al1 2_665 . 2_555 128.327(15) ?
Pd Yb1 Al1 2_665 . 3_665 47.629(15) ?
Pd Yb1 Al1 2_665 . 4_665 47.629(12) ?
Pd Yb1 Al1 2_665 . 5_565 128.327(16) ?
Pd Yb1 Al1 2_665 . 6_555 93.08(2) ?
Pd Yb1 Al2 2_665 . 1_565 45.305(10) ?
Pd Yb1 Al2 2_665 . 1_566 96.521(9) ?
Pd Yb1 Al2 2_665 . 2_555 100.446(8) ?
Pd Yb1 Al2 2_665 . 2_556 176.573(5) ?
Pd Yb1 Al2 2_665 . 3_665 45.305(10) ?
Pd Yb1 Al2 2_665 . 3_666 96.521(10) ?
Pd Yb1 Pd 2_666 . 3_565 136.009(10) ?
Pd Yb1 Pd 2_666 . 3_566 80.889(12) ?
Pd Yb1 Al1 2_666 . 1_565 93.08(2) ?
Pd Yb1 Al1 2_666 . 2_555 128.327(15) ?
Pd Yb1 Al1 2_666 . 3_665 47.629(15) ?
Pd Yb1 Al1 2_666 . 4_665 47.629(12) ?
Pd Yb1 Al1 2_666 . 5_565 128.327(16) ?
Pd Yb1 Al1 2_666 . 6_555 93.08(2) ?
Pd Yb1 Al2 2_666 . 1_565 96.521(9) ?
Pd Yb1 Al2 2_666 . 1_566 45.305(10) ?
Pd Yb1 Al2 2_666 . 2_555 176.573(5) ?
Pd Yb1 Al2 2_666 . 2_556 100.446(8) ?
Pd Yb1 Al2 2_666 . 3_665 96.521(10) ?
Pd Yb1 Al2 2_666 . 3_666 45.305(10) ?
Pd Yb1 Pd 3_565 . 3_566 82.981(9) ?
Pd Yb1 Al1 3_565 . 1_565 47.629(11) ?
Pd Yb1 Al1 3_565 . 2_555 93.083(19) ?
Pd Yb1 Al1 3_565 . 3_665 128.327(16) ?
Pd Yb1 Al1 3_565 . 4_665 93.083(19) ?
Pd Yb1 Al1 3_565 . 5_565 47.629(13) ?
Pd Yb1 Al1 3_565 . 6_555 128.327(14) ?
Pd Yb1 Al2 3_565 . 1_565 45.305(7) ?
Pd Yb1 Al2 3_565 . 1_566 96.521(6) ?
Pd Yb1 Al2 3_565 . 2_555 45.305(6) ?
Pd Yb1 Al2 3_565 . 2_556 96.521(8) ?
Pd Yb1 Al2 3_565 . 3_665 100.446(7) ?
Pd Yb1 Al2 3_565 . 3_666 176.573(6) ?
Pd Yb1 Al1 3_566 . 1_565 47.629(11) ?
Pd Yb1 Al1 3_566 . 2_555 93.083(19) ?
Pd Yb1 Al1 3_566 . 3_665 128.327(16) ?
Pd Yb1 Al1 3_566 . 4_665 93.083(19) ?
Pd Yb1 Al1 3_566 . 5_565 47.629(13) ?
Pd Yb1 Al1 3_566 . 6_555 128.327(14) ?
Pd Yb1 Al2 3_566 . 1_565 96.521(6) ?
Pd Yb1 Al2 3_566 . 1_566 45.305(7) ?
Pd Yb1 Al2 3_566 . 2_555 96.521(8) ?
Pd Yb1 Al2 3_566 . 2_556 45.305(6) ?
Pd Yb1 Al2 3_566 . 3_665 176.573(6) ?
Pd Yb1 Al2 3_566 . 3_666 100.446(7) ?
Al1 Yb1 Al1 1_565 . 2_555 120.00(3) ?
Al1 Yb1 Al1 1_565 . 3_665 120.00(4) ?
Al1 Yb1 Al1 1_565 . 4_665 68.23(3) ?
Al1 Yb1 Al1 1_565 . 5_565 51.77(3) ?
Al1 Yb1 Al1 1_565 . 6_555 171.77(4) ?
Al1 Yb1 Al2 1_565 . 1_565 49.321(14) ?
Al1 Yb1 Al2 1_565 . 1_566 49.321(14) ?
Al1 Yb1 Al2 1_565 . 2_555 86.760(19) ?
Al1 Yb1 Al2 1_565 . 2_556 86.760(19) ?
Al1 Yb1 Al2 1_565 . 3_665 135.101(12) ?
Al1 Yb1 Al2 1_565 . 3_666 135.101(12) ?
Al1 Yb1 Al1 2_555 . 3_665 120.00(4) ?
Al1 Yb1 Al1 2_555 . 4_665 171.77(3) ?
Al1 Yb1 Al1 2_555 . 5_565 68.23(3) ?
Al1 Yb1 Al1 2_555 . 6_555 51.77(4) ?
Al1 Yb1 Al2 2_555 . 1_565 135.101(12) ?
Al1 Yb1 Al2 2_555 . 1_566 135.101(12) ?
Al1 Yb1 Al2 2_555 . 2_555 49.321(14) ?
Al1 Yb1 Al2 2_555 . 2_556 49.321(14) ?
Al1 Yb1 Al2 2_555 . 3_665 86.760(19) ?
Al1 Yb1 Al2 2_555 . 3_666 86.760(19) ?
Al1 Yb1 Al1 3_665 . 4_665 51.77(4) ?
Al1 Yb1 Al1 3_665 . 5_565 171.77(4) ?
Al1 Yb1 Al1 3_665 . 6_555 68.23(4) ?
Al1 Yb1 Al2 3_665 . 1_565 86.76(2) ?
Al1 Yb1 Al2 3_665 . 1_566 86.76(2) ?
Al1 Yb1 Al2 3_665 . 2_555 135.101(13) ?
Al1 Yb1 Al2 3_665 . 2_556 135.101(13) ?
Al1 Yb1 Al2 3_665 . 3_665 49.320(15) ?
Al1 Yb1 Al2 3_665 . 3_666 49.320(15) ?
Al1 Yb1 Al1 4_665 . 5_565 120.00(3) ?
Al1 Yb1 Al1 4_665 . 6_555 120.00(4) ?
Al1 Yb1 Al2 4_665 . 1_565 49.321(14) ?
Al1 Yb1 Al2 4_665 . 1_566 49.321(14) ?
Al1 Yb1 Al2 4_665 . 2_555 135.101(12) ?
Al1 Yb1 Al2 4_665 . 2_556 135.101(12) ?
Al1 Yb1 Al2 4_665 . 3_665 86.760(19) ?
Al1 Yb1 Al2 4_665 . 3_666 86.760(19) ?
Al1 Yb1 Al1 5_565 . 6_555 120.00(4) ?
Al1 Yb1 Al2 5_565 . 1_565 86.760(19) ?
Al1 Yb1 Al2 5_565 . 1_566 86.760(19) ?
Al1 Yb1 Al2 5_565 . 2_555 49.321(14) ?
Al1 Yb1 Al2 5_565 . 2_556 49.321(14) ?
Al1 Yb1 Al2 5_565 . 3_665 135.101(12) ?
Al1 Yb1 Al2 5_565 . 3_666 135.101(12) ?
Al1 Yb1 Al2 6_555 . 1_565 135.101(13) ?
Al1 Yb1 Al2 6_555 . 1_566 135.101(13) ?
Al1 Yb1 Al2 6_555 . 2_555 86.76(2) ?
Al1 Yb1 Al2 6_555 . 2_556 86.76(2) ?
Al1 Yb1 Al2 6_555 . 3_665 49.320(15) ?
Al1 Yb1 Al2 6_555 . 3_666 49.320(15) ?
Al2 Yb1 Al2 1_565 . 1_566 76.127(6) ?
Al2 Yb1 Al2 1_565 . 2_555 85.977(6) ?
Al2 Yb1 Al2 1_565 . 2_556 133.635(3) ?
Al2 Yb1 Al2 1_565 . 3_665 85.976(5) ?
Al2 Yb1 Al2 1_565 . 3_666 133.634(4) ?
Al2 Yb1 Al2 1_566 . 2_555 133.635(3) ?
Al2 Yb1 Al2 1_566 . 2_556 85.977(6) ?
Al2 Yb1 Al2 1_566 . 3_665 133.634(4) ?
Al2 Yb1 Al2 1_566 . 3_666 85.976(5) ?
Al2 Yb1 Al2 2_555 . 2_556 76.127(6) ?
Al2 Yb1 Al2 2_555 . 3_665 85.977(5) ?
Al2 Yb1 Al2 2_555 . 3_666 133.634(4) ?
Al2 Yb1 Al2 2_556 . 3_665 133.634(4) ?
Al2 Yb1 Al2 2_556 . 3_666 85.977(5) ?
Al2 Yb1 Al2 3_665 . 3_666 76.126(4) ?
Pd Yb2 Pd . . 2_555 120.000(13) ?
Pd Yb2 Pd . . 3_555 120.000(10) ?
Pd Yb2 Pd . . 4_555 180.0(5) ?
Pd Yb2 Pd . . 5_555 60.000(13) ?
Pd Yb2 Pd . . 6_555 60.000(10) ?
Pd Yb2 Al1 . . 1_554 90.000(6) ?
Pd Yb2 Al1 . . . 90.000(6) ?
Pd Yb2 Al1 . . 2_554 45.949(12) ?
Pd Yb2 Al1 . . 2_555 45.949(12) ?
Pd Yb2 Al1 . . 3_554 134.05(2) ?
Pd Yb2 Al1 . . 3_555 134.05(2) ?
Pd Yb2 Al1 . . 4_554 90.000(6) ?
Pd Yb2 Al1 . . 4_555 90.000(6) ?
Pd Yb2 Al1 . . 5_554 134.051(12) ?
Pd Yb2 Al1 . . 5_555 134.051(12) ?
Pd Yb2 Al1 . . 6_554 45.95(2) ?
Pd Yb2 Al1 . . 6_555 45.95(2) ?
Pd Yb2 Pd 2_555 . 3_555 120.000(13) ?
Pd Yb2 Pd 2_555 . 4_555 60.000(13) ?
Pd Yb2 Pd 2_555 . 5_555 180.0(5) ?
Pd Yb2 Pd 2_555 . 6_555 60.000(13) ?
Pd Yb2 Al1 2_555 . 1_554 134.051(13) ?
Pd Yb2 Al1 2_555 . . 134.051(13) ?
Pd Yb2 Al1 2_555 . 2_554 90.000(9) ?
Pd Yb2 Al1 2_555 . 2_555 90.000(9) ?
Pd Yb2 Al1 2_555 . 3_554 45.95(3) ?
Pd Yb2 Al1 2_555 . 3_555 45.95(3) ?
Pd Yb2 Al1 2_555 . 4_554 45.949(13) ?
Pd Yb2 Al1 2_555 . 4_555 45.949(13) ?
Pd Yb2 Al1 2_555 . 5_554 90.000(9) ?
Pd Yb2 Al1 2_555 . 5_555 90.000(9) ?
Pd Yb2 Al1 2_555 . 6_554 134.05(3) ?
Pd Yb2 Al1 2_555 . 6_555 134.05(3) ?
Pd Yb2 Pd 3_555 . 4_555 60.000(10) ?
Pd Yb2 Pd 3_555 . 5_555 60.000(13) ?
Pd Yb2 Pd 3_555 . 6_555 180.0(5) ?
Pd Yb2 Al1 3_555 . 1_554 45.949(12) ?
Pd Yb2 Al1 3_555 . . 45.949(12) ?
Pd Yb2 Al1 3_555 . 2_554 134.051(12) ?
Pd Yb2 Al1 3_555 . 2_555 134.051(12) ?
Pd Yb2 Al1 3_555 . 3_554 90.00(3) ?
Pd Yb2 Al1 3_555 . 3_555 90.00(3) ?
Pd Yb2 Al1 3_555 . 4_554 134.051(12) ?
Pd Yb2 Al1 3_555 . 4_555 134.051(12) ?
Pd Yb2 Al1 3_555 . 5_554 45.949(12) ?
Pd Yb2 Al1 3_555 . 5_555 45.949(12) ?
Pd Yb2 Al1 3_555 . 6_554 90.00(3) ?
Pd Yb2 Al1 3_555 . 6_555 90.00(3) ?
Pd Yb2 Pd 4_555 . 5_555 120.000(13) ?
Pd Yb2 Pd 4_555 . 6_555 120.000(10) ?
Pd Yb2 Al1 4_555 . 1_554 90.000(6) ?
Pd Yb2 Al1 4_555 . . 90.000(6) ?
Pd Yb2 Al1 4_555 . 2_554 134.051(12) ?
Pd Yb2 Al1 4_555 . 2_555 134.051(12) ?
Pd Yb2 Al1 4_555 . 3_554 45.95(2) ?
Pd Yb2 Al1 4_555 . 3_555 45.95(2) ?
Pd Yb2 Al1 4_555 . 4_554 90.000(6) ?
Pd Yb2 Al1 4_555 . 4_555 90.000(6) ?
Pd Yb2 Al1 4_555 . 5_554 45.949(12) ?
Pd Yb2 Al1 4_555 . 5_555 45.949(12) ?
Pd Yb2 Al1 4_555 . 6_554 134.05(2) ?
Pd Yb2 Al1 4_555 . 6_555 134.05(2) ?
Pd Yb2 Pd 5_555 . 6_555 120.000(13) ?
Pd Yb2 Al1 5_555 . 1_554 45.949(13) ?
Pd Yb2 Al1 5_555 . . 45.949(13) ?
Pd Yb2 Al1 5_555 . 2_554 90.000(9) ?
Pd Yb2 Al1 5_555 . 2_555 90.000(9) ?
Pd Yb2 Al1 5_555 . 3_554 134.05(3) ?
Pd Yb2 Al1 5_555 . 3_555 134.05(3) ?
Pd Yb2 Al1 5_555 . 4_554 134.051(13) ?
Pd Yb2 Al1 5_555 . 4_555 134.051(13) ?
Pd Yb2 Al1 5_555 . 5_554 90.000(9) ?
Pd Yb2 Al1 5_555 . 5_555 90.000(9) ?
Pd Yb2 Al1 5_555 . 6_554 45.95(3) ?
Pd Yb2 Al1 5_555 . 6_555 45.95(3) ?
Pd Yb2 Al1 6_555 . 1_554 134.051(12) ?
Pd Yb2 Al1 6_555 . . 134.051(12) ?
Pd Yb2 Al1 6_555 . 2_554 45.949(12) ?
Pd Yb2 Al1 6_555 . 2_555 45.949(12) ?
Pd Yb2 Al1 6_555 . 3_554 90.00(3) ?
Pd Yb2 Al1 6_555 . 3_555 90.00(3) ?
Pd Yb2 Al1 6_555 . 4_554 45.949(12) ?
Pd Yb2 Al1 6_555 . 4_555 45.949(12) ?
Pd Yb2 Al1 6_555 . 5_554 134.051(12) ?
Pd Yb2 Al1 6_555 . 5_555 134.051(12) ?
Pd Yb2 Al1 6_555 . 6_554 90.00(3) ?
Pd Yb2 Al1 6_555 . 6_555 90.00(3) ?
Al1 Yb2 Al1 1_554 . . 73.19(2) ?
Al1 Yb2 Al1 1_554 . 2_554 88.102(16) ?
Al1 Yb2 Al1 1_554 . 2_555 132.665(8) ?
Al1 Yb2 Al1 1_554 . 3_554 88.10(3) ?
Al1 Yb2 Al1 1_554 . 3_555 132.66(3) ?
Al1 Yb2 Al1 1_554 . 4_554 106.81(2) ?
Al1 Yb2 Al1 1_554 . 4_555 180.0(5) ?
Al1 Yb2 Al1 1_554 . 5_554 47.335(8) ?
Al1 Yb2 Al1 1_554 . 5_555 91.898(16) ?
Al1 Yb2 Al1 1_554 . 6_554 47.34(3) ?
Al1 Yb2 Al1 1_554 . 6_555 91.90(3) ?
Al1 Yb2 Al1 . . 2_554 132.665(8) ?
Al1 Yb2 Al1 . . 2_555 88.102(16) ?
Al1 Yb2 Al1 . . 3_554 132.66(3) ?
Al1 Yb2 Al1 . . 3_555 88.10(3) ?
Al1 Yb2 Al1 . . 4_554 180.0(5) ?
Al1 Yb2 Al1 . . 4_555 106.81(2) ?
Al1 Yb2 Al1 . . 5_554 91.898(16) ?
Al1 Yb2 Al1 . . 5_555 47.335(8) ?
Al1 Yb2 Al1 . . 6_554 91.90(3) ?
Al1 Yb2 Al1 . . 6_555 47.34(3) ?
Al1 Yb2 Al1 2_554 . 2_555 73.19(2) ?
Al1 Yb2 Al1 2_554 . 3_554 88.10(3) ?
Al1 Yb2 Al1 2_554 . 3_555 132.66(3) ?
Al1 Yb2 Al1 2_554 . 4_554 47.335(8) ?
Al1 Yb2 Al1 2_554 . 4_555 91.898(16) ?
Al1 Yb2 Al1 2_554 . 5_554 106.81(2) ?
Al1 Yb2 Al1 2_554 . 5_555 180.0(5) ?
Al1 Yb2 Al1 2_554 . 6_554 47.34(3) ?
Al1 Yb2 Al1 2_554 . 6_555 91.90(3) ?
Al1 Yb2 Al1 2_555 . 3_554 132.66(3) ?
Al1 Yb2 Al1 2_555 . 3_555 88.10(3) ?
Al1 Yb2 Al1 2_555 . 4_554 91.898(16) ?
Al1 Yb2 Al1 2_555 . 4_555 47.335(8) ?
Al1 Yb2 Al1 2_555 . 5_554 180.0(5) ?
Al1 Yb2 Al1 2_555 . 5_555 106.81(2) ?
Al1 Yb2 Al1 2_555 . 6_554 91.90(3) ?
Al1 Yb2 Al1 2_555 . 6_555 47.34(3) ?
Al1 Yb2 Al1 3_554 . 3_555 73.191(17) ?
Al1 Yb2 Al1 3_554 . 4_554 47.34(3) ?
Al1 Yb2 Al1 3_554 . 4_555 91.90(3) ?
Al1 Yb2 Al1 3_554 . 5_554 47.34(3) ?
Al1 Yb2 Al1 3_554 . 5_555 91.90(3) ?
Al1 Yb2 Al1 3_554 . 6_554 106.809(17) ?
Al1 Yb2 Al1 3_554 . 6_555 180.0(5) ?
Al1 Yb2 Al1 3_555 . 4_554 91.90(3) ?
Al1 Yb2 Al1 3_555 . 4_555 47.34(3) ?
Al1 Yb2 Al1 3_555 . 5_554 91.90(3) ?
Al1 Yb2 Al1 3_555 . 5_555 47.34(3) ?
Al1 Yb2 Al1 3_555 . 6_554 180.0(5) ?
Al1 Yb2 Al1 3_555 . 6_555 106.809(17) ?
Al1 Yb2 Al1 4_554 . 4_555 73.19(2) ?
Al1 Yb2 Al1 4_554 . 5_554 88.102(16) ?
Al1 Yb2 Al1 4_554 . 5_555 132.665(8) ?
Al1 Yb2 Al1 4_554 . 6_554 88.10(3) ?
Al1 Yb2 Al1 4_554 . 6_555 132.66(3) ?
Al1 Yb2 Al1 4_555 . 5_554 132.665(8) ?
Al1 Yb2 Al1 4_555 . 5_555 88.102(16) ?
Al1 Yb2 Al1 4_555 . 6_554 132.66(3) ?
Al1 Yb2 Al1 4_555 . 6_555 88.10(3) ?
Al1 Yb2 Al1 5_554 . 5_555 73.19(2) ?
Al1 Yb2 Al1 5_554 . 6_554 88.10(3) ?
Al1 Yb2 Al1 5_554 . 6_555 132.66(3) ?
Al1 Yb2 Al1 5_555 . 6_554 132.66(3) ?
Al1 Yb2 Al1 5_555 . 6_555 88.10(3) ?
Al1 Yb2 Al1 6_554 . 6_555 73.191(17) ?
Yb1 Pd Yb1 1_554 . . 82.981(11) ?
Yb1 Pd Yb2 1_554 . . 138.509(6) ?
Yb1 Pd Pd 1_554 . 5_555 111.995(8) ?
Yb1 Pd Pd 1_554 . 6_555 111.995(11) ?
Yb1 Pd Al1 1_554 . 2_554 67.59(3) ?
Yb1 Pd Al1 1_554 . 2_555 133.92(4) ?
Yb1 Pd Al1 1_554 . 6_554 67.59(3) ?
Yb1 Pd Al1 1_554 . 6_555 133.92(3) ?
Yb1 Pd Al2 1_554 . 2_555 72.269(11) ?
Yb1 Pd Al2 1_554 . 3_665 72.269(6) ?
Yb1 Pd Yb2 . . . 138.509(6) ?
Yb1 Pd Pd . . 5_555 111.995(8) ?
Yb1 Pd Pd . . 6_555 111.995(11) ?
Yb1 Pd Al1 . . 2_554 133.92(4) ?
Yb1 Pd Al1 . . 2_555 67.59(3) ?
Yb1 Pd Al1 . . 6_554 133.92(3) ?
Yb1 Pd Al1 . . 6_555 67.59(3) ?
Yb1 Pd Al2 . . 2_555 72.269(11) ?
Yb1 Pd Al2 . . 3_665 72.269(6) ?
Yb2 Pd Pd . . 5_555 60.000(12) ?
Yb2 Pd Pd . . 6_555 60.000(9) ?
Yb2 Pd Al1 . . 2_554 77.96(3) ?
Yb2 Pd Al1 . . 2_555 77.96(3) ?
Yb2 Pd Al1 . . 6_554 77.96(3) ?
Yb2 Pd Al1 . . 6_555 77.96(3) ?
Yb2 Pd Al2 . . 2_555 113.989(9) ?
Yb2 Pd Al2 . . 3_665 113.989(16) ?
Pd Pd Pd 5_555 . 6_555 120.000(17) ?
Pd Pd Al1 5_555 . 2_554 111.64(3) ?
Pd Pd Al1 5_555 . 2_555 111.64(3) ?
Pd Pd Al1 5_555 . 6_554 54.74(4) ?
Pd Pd Al1 5_555 . 6_555 54.74(4) ?
Pd Pd Al2 5_555 . 2_555 173.989(13) ?
Pd Pd Al2 5_555 . 3_665 53.989(11) ?
Pd Pd Al1 6_555 . 2_554 54.735(5) ?
Pd Pd Al1 6_555 . 2_555 54.735(5) ?
Pd Pd Al1 6_555 . 6_554 111.64(3) ?
Pd Pd Al1 6_555 . 6_555 111.64(3) ?
Pd Pd Al2 6_555 . 2_555 53.989(10) ?
Pd Pd Al2 6_555 . 3_665 173.99(2) ?
Al1 Pd Al1 2_554 . 2_555 108.434(12) ?
Al1 Pd Al1 2_554 . 6_554 66.22(4) ?
Al1 Pd Al1 2_554 . 6_555 155.92(5) ?
Al1 Pd Al2 2_554 . 2_555 65.53(3) ?
Al1 Pd Al2 2_554 . 3_665 125.723(5) ?
Al1 Pd Al1 2_555 . 6_554 155.92(5) ?
Al1 Pd Al1 2_555 . 6_555 66.22(4) ?
Al1 Pd Al2 2_555 . 2_555 65.53(3) ?
Al1 Pd Al2 2_555 . 3_665 125.723(5) ?
Al1 Pd Al1 6_554 . 6_555 108.43(5) ?
Al1 Pd Al2 6_554 . 2_555 125.72(4) ?
Al1 Pd Al2 6_554 . 3_665 65.53(3) ?
Al1 Pd Al2 6_555 . 2_555 125.72(4) ?
Al1 Pd Al2 6_555 . 3_665 65.53(3) ?
Al2 Pd Al2 2_555 . 3_665 132.021(17) ?
Yb1 Al1 Yb1 1_545 . 4_665 111.77(5) ?
Yb1 Al1 Yb2 1_545 . . 116.764(12) ?
Yb1 Al1 Yb2 1_545 . 1_556 116.764(12) ?
Yb1 Al1 Pd 1_545 . 3_555 64.779(16) ?
Yb1 Al1 Pd 1_545 . 3_556 64.779(16) ?
Yb1 Al1 Pd 1_545 . 5_555 122.00(3) ?
Yb1 Al1 Pd 1_545 . 5_556 122.00(3) ?
Yb1 Al1 Al1 1_545 . 4_655 55.88(2) ?
Yb1 Al1 Al1 1_545 . 5_555 64.12(3) ?
Yb1 Al1 Al1 1_545 . 6_555 175.88(6) ?
Yb1 Al1 Al2 1_545 . . 68.47(3) ?
Yb1 Al1 Al2 1_545 . 1_556 68.47(3) ?
Yb1 Al1 Yb2 4_665 . . 116.764(13) ?
Yb1 Al1 Yb2 4_665 . 1_556 116.764(13) ?
Yb1 Al1 Pd 4_665 . 3_555 122.00(3) ?
Yb1 Al1 Pd 4_665 . 3_556 122.00(3) ?
Yb1 Al1 Pd 4_665 . 5_555 64.779(16) ?
Yb1 Al1 Pd 4_665 . 5_556 64.779(16) ?
Yb1 Al1 Al1 4_665 . 4_655 55.88(2) ?
Yb1 Al1 Al1 4_665 . 5_555 175.88(6) ?
Yb1 Al1 Al1 4_665 . 6_555 64.12(3) ?
Yb1 Al1 Al2 4_665 . . 68.47(3) ?
Yb1 Al1 Al2 4_665 . 1_556 68.47(3) ?
Yb2 Al1 Yb2 . . 1_556 73.19(3) ?
Yb2 Al1 Pd . . 3_555 56.09(2) ?
Yb2 Al1 Pd . . 3_556 114.17(5) ?
Yb2 Al1 Pd . . 5_555 56.09(2) ?
Yb2 Al1 Pd . . 5_556 114.17(5) ?
Yb2 Al1 Al1 . . 4_655 143.404(16) ?
Yb2 Al1 Al1 . . 5_555 66.33(3) ?
Yb2 Al1 Al1 . . 6_555 66.33(3) ?
Yb2 Al1 Al2 . . . 94.270(11) ?
Yb2 Al1 Al2 . . 1_556 167.46(4) ?
Yb2 Al1 Pd 1_556 . 3_555 114.17(5) ?
Yb2 Al1 Pd 1_556 . 3_556 56.09(2) ?
Yb2 Al1 Pd 1_556 . 5_555 114.17(5) ?
Yb2 Al1 Pd 1_556 . 5_556 56.09(2) ?
Yb2 Al1 Al1 1_556 . 4_655 143.404(16) ?
Yb2 Al1 Al1 1_556 . 5_555 66.33(3) ?
Yb2 Al1 Al1 1_556 . 6_555 66.33(3) ?
Yb2 Al1 Al2 1_556 . . 167.46(4) ?
Yb2 Al1 Al2 1_556 . 1_556 94.270(11) ?
Pd Al1 Pd 3_555 . 3_556 108.434(12) ?
Pd Al1 Pd 3_555 . 5_555 70.530(11) ?
Pd Al1 Pd 3_555 . 5_556 169.39(7) ?
Pd Al1 Al1 3_555 . 4_655 95.31(4) ?
Pd Al1 Al1 3_555 . 5_555 56.890(16) ?
Pd Al1 Al1 3_555 . 6_555 116.99(4) ?
Pd Al1 Al2 3_555 . . 56.428(16) ?
Pd Al1 Al2 3_555 . 1_556 132.38(5) ?
Pd Al1 Pd 3_556 . 5_555 169.39(7) ?
Pd Al1 Pd 3_556 . 5_556 70.530(11) ?
Pd Al1 Al1 3_556 . 4_655 95.31(4) ?
Pd Al1 Al1 3_556 . 5_555 56.890(16) ?
Pd Al1 Al1 3_556 . 6_555 116.99(4) ?
Pd Al1 Al2 3_556 . . 132.38(5) ?
Pd Al1 Al2 3_556 . 1_556 56.428(16) ?
Pd Al1 Pd 5_555 . 5_556 108.434(16) ?
Pd Al1 Al1 5_555 . 4_655 95.31(4) ?
Pd Al1 Al1 5_555 . 5_555 116.99(4) ?
Pd Al1 Al1 5_555 . 6_555 56.890(18) ?
Pd Al1 Al2 5_555 . . 56.428(17) ?
Pd Al1 Al2 5_555 . 1_556 132.38(5) ?
Pd Al1 Al1 5_556 . 4_655 95.31(4) ?
Pd Al1 Al1 5_556 . 5_555 116.99(4) ?
Pd Al1 Al1 5_556 . 6_555 56.890(18) ?
Pd Al1 Al2 5_556 . . 132.38(5) ?
Pd Al1 Al2 5_556 . 1_556 56.428(17) ?
Al1 Al1 Al1 4_655 . 5_555 120.00(4) ?
Al1 Al1 Al1 4_655 . 6_555 120.00(4) ?
Al1 Al1 Al2 4_655 . . 49.13(3) ?
Al1 Al1 Al2 4_655 . 1_556 49.13(3) ?
Al1 Al1 Al1 5_555 . 6_555 120.00(7) ?
Al1 Al1 Al2 5_555 . . 109.095(19) ?
Al1 Al1 Al2 5_555 . 1_556 109.095(19) ?
Al1 Al1 Al2 6_555 . . 109.095(19) ?
Al1 Al1 Al2 6_555 . 1_556 109.095(19) ?
Al2 Al1 Al2 . . 1_556 98.27(5) ?
Yb1 Al2 Yb1 1_544 . 1_545 76.127(6) ?
Yb1 Al2 Yb1 1_544 . 4_664 103.873(6) ?
Yb1 Al2 Yb1 1_544 . 4_665 180.0(5) ?
Yb1 Al2 Pd 1_544 . 2_655 62.426(7) ?
Yb1 Al2 Pd 1_544 . 3_555 62.426(7) ?
Yb1 Al2 Pd 1_544 . 5_555 117.574(7) ?
Yb1 Al2 Pd 1_544 . 6_655 117.574(7) ?
Yb1 Al2 Al1 1_544 . 1_554 62.209(12) ?
Yb1 Al2 Al1 1_544 . . 117.791(13) ?
Yb1 Al2 Al1 1_544 . 4_654 62.209(13) ?
Yb1 Al2 Al1 1_544 . 4_655 117.791(12) ?
Yb1 Al2 Yb1 1_545 . 4_664 180.0(5) ?
Yb1 Al2 Yb1 1_545 . 4_665 103.873(6) ?
Yb1 Al2 Pd 1_545 . 2_655 62.426(7) ?
Yb1 Al2 Pd 1_545 . 3_555 62.426(7) ?
Yb1 Al2 Pd 1_545 . 5_555 117.574(7) ?
Yb1 Al2 Pd 1_545 . 6_655 117.574(7) ?
Yb1 Al2 Al1 1_545 . 1_554 117.791(13) ?
Yb1 Al2 Al1 1_545 . . 62.209(12) ?
Yb1 Al2 Al1 1_545 . 4_654 117.791(12) ?
Yb1 Al2 Al1 1_545 . 4_655 62.209(13) ?
Yb1 Al2 Yb1 4_664 . 4_665 76.127(6) ?
Yb1 Al2 Pd 4_664 . 2_655 117.574(7) ?
Yb1 Al2 Pd 4_664 . 3_555 117.574(7) ?
Yb1 Al2 Pd 4_664 . 5_555 62.426(7) ?
Yb1 Al2 Pd 4_664 . 6_655 62.426(7) ?
Yb1 Al2 Al1 4_664 . 1_554 62.209(13) ?
Yb1 Al2 Al1 4_664 . . 117.791(12) ?
Yb1 Al2 Al1 4_664 . 4_654 62.209(12) ?
Yb1 Al2 Al1 4_664 . 4_655 117.791(13) ?
Yb1 Al2 Pd 4_665 . 2_655 117.574(7) ?
Yb1 Al2 Pd 4_665 . 3_555 117.574(7) ?
Yb1 Al2 Pd 4_665 . 5_555 62.426(7) ?
Yb1 Al2 Pd 4_665 . 6_655 62.426(7) ?
Yb1 Al2 Al1 4_665 . 1_554 117.791(12) ?
Yb1 Al2 Al1 4_665 . . 62.209(13) ?
Yb1 Al2 Al1 4_665 . 4_654 117.791(13) ?
Yb1 Al2 Al1 4_665 . 4_655 62.209(12) ?
Pd Al2 Pd 2_655 . 3_555 107.979(13) ?
Pd Al2 Pd 2_655 . 5_555 180.0(5) ?
Pd Al2 Pd 2_655 . 6_655 72.021(13) ?
Pd Al2 Al1 2_655 . 1_554 121.955(19) ?
Pd Al2 Al1 2_655 . . 121.955(19) ?
Pd Al2 Al1 2_655 . 4_654 58.045(19) ?
Pd Al2 Al1 2_655 . 4_655 58.045(19) ?
Pd Al2 Pd 3_555 . 5_555 72.021(13) ?
Pd Al2 Pd 3_555 . 6_655 180.0(5) ?
Pd Al2 Al1 3_555 . 1_554 58.045(19) ?
Pd Al2 Al1 3_555 . . 58.045(19) ?
Pd Al2 Al1 3_555 . 4_654 121.955(19) ?
Pd Al2 Al1 3_555 . 4_655 121.955(19) ?
Pd Al2 Pd 5_555 . 6_655 107.979(13) ?
Pd Al2 Al1 5_555 . 1_554 58.045(19) ?
Pd Al2 Al1 5_555 . . 58.045(19) ?
Pd Al2 Al1 5_555 . 4_654 121.955(19) ?
Pd Al2 Al1 5_555 . 4_655 121.955(19) ?
Pd Al2 Al1 6_655 . 1_554 121.955(19) ?
Pd Al2 Al1 6_655 . . 121.955(19) ?
Pd Al2 Al1 6_655 . 4_654 58.045(19) ?
Pd Al2 Al1 6_655 . 4_655 58.045(19) ?
Al1 Al2 Al1 1_554 . . 98.27(4) ?
Al1 Al2 Al1 1_554 . 4_654 81.73(4) ?
Al1 Al2 Al1 1_554 . 4_655 180.0(5) ?
Al1 Al2 Al1 . . 4_654 180.0(5) ?
Al1 Al2 Al1 . . 4_655 81.73(4) ?
Al1 Al2 Al1 4_654 . 4_655 98.27(4) ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion
_geom_torsion_publ_flag
? ? ? ? ? ? ? ? ? ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_D
_geom_hbond_site_symmetry_H
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_publ_flag
? ? ? ? ? ? ? ? ? ? ?


####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_I_CCDC3
_database_code_depnum_ccdc_archive 'CCDC 1892594'
loop_
_audit_author_name
_audit_author_address
'Oliver Janka'
;WWU Muenster
Germany
;
_audit_update_record             
;
2019-04-17 deposited with the CCDC.	2019-10-14 downloaded from the CCDC.
;
#=======================================================================

# 5. CHEMICAL DATA

_chemical_name_systematic        
; ?
;
_chemical_name_common            ?
_chemical_formula_moiety         ?
_chemical_formula_structural     ?
_chemical_formula_analytical     ?
_chemical_formula_iupac          ?
_chemical_formula_sum            'Al3 Ca0.316 Pd2 Yb0.684'
_chemical_formula_weight         424.8
_chemical_melting_point          ?
_chemical_compound_source        ?
_chemical_absolute_configuration .

#=======================================================================

# 6. CRYSTAL DATA

_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_H-M   'P 6/m m m'
_symmetry_space_group_name_Hall  '-P 6;-2'
_symmetry_Int_Tables_number      191

loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -y,x-y,z
3 -x+y,-x,z
4 -x,-y,z
5 y,-x+y,z
6 x-y,x,z
7 y,x,-z
8 x-y,-y,-z
9 -x,-x+y,-z
10 -y,-x,-z
11 -x+y,y,-z
12 x,x-y,-z
13 -x,-y,-z
14 y,-x+y,-z
15 x-y,x,-z
16 x,y,-z
17 -y,x-y,-z
18 -x+y,-x,-z
19 -y,-x,z
20 -x+y,y,z
21 x,x-y,z
22 y,x,z
23 x-y,-y,z
24 -x,-x+y,z

_cell_length_a                   9.3110(8)
_cell_length_b                   9.3110(8)
_cell_length_c                   4.2108(3)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_volume                     316.15(4)

loop_
_twin_individual_id
_twin_individual_mass_fraction_refined
_twin_individual_twin_matrix_11
_twin_individual_twin_matrix_12
_twin_individual_twin_matrix_13
_twin_individual_twin_matrix_21
_twin_individual_twin_matrix_22
_twin_individual_twin_matrix_23
_twin_individual_twin_matrix_31
_twin_individual_twin_matrix_32
_twin_individual_twin_matrix_33
? ? ? ? ? ? ? ? ? ? ?

_cell_formula_units_Z            3

_cell_measurement_reflns_used    4067
_cell_measurement_theta_min      2.53
_cell_measurement_theta_max      35.52
_cell_measurement_temperature    293
_cell_special_details            
; ?
;

_exptl_crystal_density_diffrn    6.69
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_F_000             556

_exptl_absorpt_coefficient_mu    24.3
_exptl_crystal_description       plate
_exptl_crystal_size_max          0.085
_exptl_crystal_size_mid          0.030
_exptl_crystal_size_min          0.020
_exptl_crystal_size_rad          ?
_exptl_crystal_colour            silver
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   ?
_exptl_absorpt_correction_T_min  0.2857
_exptl_absorpt_correction_T_max  0.6008
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
? ? ? ?

#=======================================================================

# 7. EXPERIMENTAL DATA

_exptl_special_details           ?

_diffrn_ambient_temperature      293
_diffrn_source                   ?
_diffrn_source_power             ?
_diffrn_source_voltage           ?
_diffrn_source_current           ?
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_source         'X-ray tube'
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'IPDS Stoe'
_diffrn_detector                 ?
_diffrn_detector_area_resol_mean ?
_diffrn_measurement_method       '??integration method??'
_diffrn_measurement_specimen_support ?

_diffrn_reflns_number            3994
_diffrn_reflns_theta_min         2.53
_diffrn_reflns_theta_max         33.36
_diffrn_reflns_theta_full        33.36
_diffrn_measured_fraction_theta_max 1
_diffrn_measured_fraction_theta_full 1
_diffrn_reflns_av_R_equivalents  0.0324
_diffrn_reflns_av_unetI/netI     0.0084
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_l_min       -6
_diffrn_reflns_limit_l_max       6
_diffrn_reflns_reduction_process ?

_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
loop_
_diffrn_standard_refln_index_h
_diffrn_standard_refln_index_k
_diffrn_standard_refln_index_l
? ? ?

_diffrn_radiation_probe          X-ray

#=======================================================================

# 8. REFINEMENT DATA

_refine_special_details          
; ?
;

_reflns_number_total             286
_reflns_number_gt                254
_reflns_threshold_expression     I>3σ(I)

_refine_ls_structure_factor_coef Fsqd
_refine_ls_R_factor_gt           0.0160
_refine_ls_wR_factor_gt          0.0359
_refine_ls_R_factor_all          0.0193
_refine_ls_wR_factor_ref         0.0366
_refine_ls_goodness_of_fit_ref   1.35
_refine_ls_goodness_of_fit_gt    1.41
_refine_ls_restrained_S_gt       ?
_refine_ls_restrained_S_all      ?
_refine_ls_number_reflns         286
_refine_ls_number_parameters     19
_refine_ls_number_restraints     0
_refine_ls_number_constraints    4
_refine_ls_weighting_scheme      sigma
_refine_ls_weighting_details     w=1/(σ²(I)+0.0004I²)
_refine_ls_hydrogen_treatment    ?
_refine_ls_shift/su_max          0.0003
_refine_ls_shift/su_mean         0.0000
_refine_diff_density_max         1.07
_refine_diff_density_min         -0.80
_refine_ls_extinction_method     
'B-C type 1 Lorentzian isotropic (Becker & Coppens, 1974)'
_refine_ls_extinction_coef       2340(70)
_refine_ls_abs_structure_details ?
_refine_ls_abs_structure_Flack   ?
_refine_ls_abs_structure_Rogers  ?

loop_
_atom_type_symbol
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Al 0.0645 0.0514 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Ca 0.2262 0.3064 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Pd -0.9988 1.0072 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Yb -0.3850 5.5486 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    ?
_computing_structure_refinement  ?
_computing_molecular_graphics    ?
_computing_publication_material  ?

loop_
_restr_distance_atom_site_label_1
_restr_distance_site_symmetry_1
_restr_distance_atom_site_label_2
_restr_distance_site_symmetry_2
_restr_distance_target
_restr_distance_target_weight_param
? ? ? ? ? ?

loop_
_restr_angle_atom_site_label_1
_restr_angle_site_symmetry_1
_restr_angle_atom_site_label_2
_restr_angle_site_symmetry_2
_restr_angle_atom_site_label_3
_restr_angle_site_symmetry_3
_restr_angle_target
_restr_angle_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_torsion_atom_site_label_1
_restr_torsion_site_symmetry_1
_restr_torsion_atom_site_label_2
_restr_torsion_site_symmetry_2
_restr_torsion_atom_site_label_3
_restr_torsion_site_symmetry_3
_restr_torsion_atom_site_label_4
_restr_torsion_site_symmetry_4
_restr_torsion_angle_target
_restr_torsion_weight_param
? ? ? ? ? ? ? ? ? ?

loop_
_restr_equal_distance_atom_site_label_1
_restr_equal_distance_site_symmetry_1
_restr_equal_distance_atom_site_label_2
_restr_equal_distance_site_symmetry_2
_restr_equal_distance_class_class_id
_restr_equal_distance_class_target_weight_param
? ? ? ? ? ?

loop_
_restr_equal_angle_atom_site_label_1
_restr_equal_angle_site_symmetry_1
_restr_equal_angle_atom_site_label_2
_restr_equal_angle_site_symmetry_2
_restr_equal_angle_atom_site_label_3
_restr_equal_angle_site_symmetry_3
_restr_equal_angle_class_class_id
_restr_equal_angle_class_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_equal_torsion_atom_site_label_1
_restr_equal_torsion_site_symmetry_1
_restr_equal_torsion_atom_site_label_2
_restr_equal_torsion_site_symmetry_2
_restr_equal_torsion_atom_site_label_3
_restr_equal_torsion_site_symmetry_3
_restr_equal_torsion_atom_site_label_4
_restr_equal_torsion_site_symmetry_4
_restr_equal_torsion_class_class_id
_restr_equal_torsion_class_target_weight_param
? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 9. ATOMIC COORDINATES AND DISPLACEMENT PARAMETERS

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_adp_type
_atom_site_U_iso_or_equiv
_atom_site_site_symmetry_multiplicity
_atom_site_occupancy
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Yb1 Yb 0.333333 0.666667 0.5 Uani 0.00801(13) 2 0.795(4) d . . .
Ca1 Ca 0.333333 0.666667 0.5 Uani 0.00801(13) 2 0.205(4) d . . .
Yb2 Yb 0 0 0 Uani 0.0107(3) 1 0.463(5) d . . .
Ca2 Ca 0 0 0 Uani 0.0107(3) 1 0.537(5) d . . .
Pd Pd 0.18528(2) 0.37056(5) 0 Uani 0.00675(14) 6 1 d . . .
Al1 Al 0.30382(18) 0 0.5 Uani 0.0080(4) 6 1 d . . .
Al2 Al 0.5 0 0 Uani 0.0081(6) 3 1 d . . .


loop_
_jana_atom_site_ADP_C_label
_jana_atom_site_ADP_C_type_symbol
_jana_atom_site_ADP_C_111
_jana_atom_site_ADP_C_112
_jana_atom_site_ADP_C_113
_jana_atom_site_ADP_C_122
_jana_atom_site_ADP_C_123
_jana_atom_site_ADP_C_133
_jana_atom_site_ADP_C_222
_jana_atom_site_ADP_C_223
_jana_atom_site_ADP_C_233
_jana_atom_site_ADP_C_333
? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_D_label
_jana_atom_site_ADP_D_type_symbol
_jana_atom_site_ADP_D_1111
_jana_atom_site_ADP_D_1112
_jana_atom_site_ADP_D_1113
_jana_atom_site_ADP_D_1122
_jana_atom_site_ADP_D_1123
_jana_atom_site_ADP_D_1133
_jana_atom_site_ADP_D_1222
_jana_atom_site_ADP_D_1223
_jana_atom_site_ADP_D_1233
_jana_atom_site_ADP_D_1333
_jana_atom_site_ADP_D_2222
_jana_atom_site_ADP_D_2223
_jana_atom_site_ADP_D_2233
_jana_atom_site_ADP_D_2333
_jana_atom_site_ADP_D_3333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_E_label
_jana_atom_site_ADP_E_type_symbol
_jana_atom_site_ADP_E_11111
_jana_atom_site_ADP_E_11112
_jana_atom_site_ADP_E_11113
_jana_atom_site_ADP_E_11122
_jana_atom_site_ADP_E_11123
_jana_atom_site_ADP_E_11133
_jana_atom_site_ADP_E_11222
_jana_atom_site_ADP_E_11223
_jana_atom_site_ADP_E_11233
_jana_atom_site_ADP_E_11333
_jana_atom_site_ADP_E_12222
_jana_atom_site_ADP_E_12223
_jana_atom_site_ADP_E_12233
_jana_atom_site_ADP_E_12333
_jana_atom_site_ADP_E_13333
_jana_atom_site_ADP_E_22222
_jana_atom_site_ADP_E_22223
_jana_atom_site_ADP_E_22233
_jana_atom_site_ADP_E_22333
_jana_atom_site_ADP_E_23333
_jana_atom_site_ADP_E_33333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_F_label
_jana_atom_site_ADP_F_type_symbol
_jana_atom_site_ADP_F_111111
_jana_atom_site_ADP_F_111112
_jana_atom_site_ADP_F_111113
_jana_atom_site_ADP_F_111122
_jana_atom_site_ADP_F_111123
_jana_atom_site_ADP_F_111133
_jana_atom_site_ADP_F_111222
_jana_atom_site_ADP_F_111223
_jana_atom_site_ADP_F_111233
_jana_atom_site_ADP_F_111333
_jana_atom_site_ADP_F_112222
_jana_atom_site_ADP_F_112223
_jana_atom_site_ADP_F_112233
_jana_atom_site_ADP_F_112333
_jana_atom_site_ADP_F_113333
_jana_atom_site_ADP_F_122222
_jana_atom_site_ADP_F_122223
_jana_atom_site_ADP_F_122233
_jana_atom_site_ADP_F_122333
_jana_atom_site_ADP_F_123333
_jana_atom_site_ADP_F_133333
_jana_atom_site_ADP_F_222222
_jana_atom_site_ADP_F_222223
_jana_atom_site_ADP_F_222233
_jana_atom_site_ADP_F_222333
_jana_atom_site_ADP_F_223333
_jana_atom_site_ADP_F_233333
_jana_atom_site_ADP_F_333333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 10. MOLECULAR GEOMETRY


loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Yb1 Pd . . 3.1834(6) ?
Yb1 Pd . 1_556 3.1834(6) ?
Yb1 Pd . 2_665 3.1834(6) ?
Yb1 Pd . 2_666 3.1834(6) ?
Yb1 Pd . 3_565 3.1834(4) ?
Yb1 Pd . 3_566 3.1834(4) ?
Yb1 Al1 . 1_565 3.2498(11) ?
Yb1 Al1 . 2_555 3.2498(13) ?
Yb1 Al1 . 3_665 3.2498(19) ?
Yb1 Al1 . 4_665 3.2498(13) ?
Yb1 Al1 . 5_565 3.2498(11) ?
Yb1 Al1 . 6_555 3.2498(19) ?
Yb1 Al2 . 1_565 3.4143(5) ?
Yb1 Al2 . 1_566 3.4143(5) ?
Yb1 Al2 . 2_555 3.4143(5) ?
Yb1 Al2 . 2_556 3.4143(5) ?
Yb1 Al2 . 3_665 3.4143(3) ?
Yb1 Al2 . 3_666 3.4143(3) ?
Ca1 Pd . . 3.1834(6) ?
Ca1 Pd . 1_556 3.1834(6) ?
Ca1 Pd . 2_665 3.1834(6) ?
Ca1 Pd . 2_666 3.1834(6) ?
Ca1 Pd . 3_565 3.1834(4) ?
Ca1 Pd . 3_566 3.1834(4) ?
Ca1 Al1 . 1_565 3.2498(11) ?
Ca1 Al1 . 2_555 3.2498(13) ?
Ca1 Al1 . 3_665 3.2498(19) ?
Ca1 Al1 . 4_665 3.2498(13) ?
Ca1 Al1 . 5_565 3.2498(11) ?
Ca1 Al1 . 6_555 3.2498(19) ?
Ca1 Al2 . 1_565 3.4143(5) ?
Ca1 Al2 . 1_566 3.4143(5) ?
Ca1 Al2 . 2_555 3.4143(5) ?
Ca1 Al2 . 2_556 3.4143(5) ?
Ca1 Al2 . 3_665 3.4143(3) ?
Ca1 Al2 . 3_666 3.4143(3) ?
Yb2 Pd . . 2.9880(8) ?
Yb2 Pd . 2_555 2.9880(8) ?
Yb2 Pd . 3_555 2.9880(5) ?
Yb2 Pd . 4_555 2.9880(8) ?
Yb2 Pd . 5_555 2.9880(8) ?
Yb2 Pd . 6_555 2.9880(5) ?
Yb2 Al1 . 1_554 3.5264(14) ?
Yb2 Al1 . . 3.5264(14) ?
Yb2 Al1 . 2_554 3.5264(14) ?
Yb2 Al1 . 2_555 3.5264(14) ?
Yb2 Al1 . 3_554 3.5264(11) ?
Yb2 Al1 . 3_555 3.5264(11) ?
Yb2 Al1 . 4_554 3.5264(14) ?
Yb2 Al1 . 4_555 3.5264(14) ?
Yb2 Al1 . 5_554 3.5264(14) ?
Yb2 Al1 . 5_555 3.5264(14) ?
Yb2 Al1 . 6_554 3.5264(11) ?
Yb2 Al1 . 6_555 3.5264(11) ?
Ca2 Pd . . 2.9880(8) ?
Ca2 Pd . 2_555 2.9880(8) ?
Ca2 Pd . 3_555 2.9880(5) ?
Ca2 Pd . 4_555 2.9880(8) ?
Ca2 Pd . 5_555 2.9880(8) ?
Ca2 Pd . 6_555 2.9880(5) ?
Ca2 Al1 . 1_554 3.5264(14) ?
Ca2 Al1 . . 3.5264(14) ?
Ca2 Al1 . 2_554 3.5264(14) ?
Ca2 Al1 . 2_555 3.5264(14) ?
Ca2 Al1 . 3_554 3.5264(11) ?
Ca2 Al1 . 3_555 3.5264(11) ?
Ca2 Al1 . 4_554 3.5264(14) ?
Ca2 Al1 . 4_555 3.5264(14) ?
Ca2 Al1 . 5_554 3.5264(14) ?
Ca2 Al1 . 5_555 3.5264(14) ?
Ca2 Al1 . 6_554 3.5264(11) ?
Ca2 Al1 . 6_555 3.5264(11) ?
Pd Pd . 5_555 2.9880(8) ?
Pd Pd . 6_555 2.9880(9) ?
Pd Al1 . 2_554 2.5929(4) ?
Pd Al1 . 2_555 2.5929(4) ?
Pd Al1 . 6_554 2.5929(12) ?
Pd Al1 . 6_555 2.5929(12) ?
Pd Al2 . 2_555 2.5511(5) ?
Pd Al2 . 3_665 2.5511(6) ?
Al1 Al1 . 4_655 3.653(2) ?
Al1 Al1 . 5_555 2.8289(14) ?
Al1 Al1 . 6_555 2.829(2) ?
Al1 Al2 . . 2.7873(11) ?
Al1 Al2 . 1_556 2.7873(11) ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
Pd Yb1 Pd . . 1_556 82.809(10) ?
Pd Yb1 Pd . . 2_665 81.018(10) ?
Pd Yb1 Pd . . 2_666 135.948(12) ?
Pd Yb1 Pd . . 3_565 81.018(9) ?
Pd Yb1 Pd . . 3_566 135.948(9) ?
Pd Yb1 Al1 . . 1_565 128.343(15) ?
Pd Yb1 Al1 . . 2_555 47.524(12) ?
Pd Yb1 Al1 . . 3_665 93.15(2) ?
Pd Yb1 Al1 . . 4_665 128.342(14) ?
Pd Yb1 Al1 . . 5_565 93.15(2) ?
Pd Yb1 Al1 . . 6_555 47.524(14) ?
Pd Yb1 Al2 . . 1_565 100.524(9) ?
Pd Yb1 Al2 . . 1_566 176.667(5) ?
Pd Yb1 Al2 . . 2_555 45.326(7) ?
Pd Yb1 Al2 . . 2_556 96.465(8) ?
Pd Yb1 Al2 . . 3_665 45.326(7) ?
Pd Yb1 Al2 . . 3_666 96.465(9) ?
Pd Yb1 Pd 1_556 . 2_665 135.948(12) ?
Pd Yb1 Pd 1_556 . 2_666 81.018(10) ?
Pd Yb1 Pd 1_556 . 3_565 135.948(9) ?
Pd Yb1 Pd 1_556 . 3_566 81.018(9) ?
Pd Yb1 Al1 1_556 . 1_565 128.343(15) ?
Pd Yb1 Al1 1_556 . 2_555 47.524(12) ?
Pd Yb1 Al1 1_556 . 3_665 93.15(2) ?
Pd Yb1 Al1 1_556 . 4_665 128.342(14) ?
Pd Yb1 Al1 1_556 . 5_565 93.15(2) ?
Pd Yb1 Al1 1_556 . 6_555 47.524(14) ?
Pd Yb1 Al2 1_556 . 1_565 176.667(5) ?
Pd Yb1 Al2 1_556 . 1_566 100.524(9) ?
Pd Yb1 Al2 1_556 . 2_555 96.465(8) ?
Pd Yb1 Al2 1_556 . 2_556 45.326(7) ?
Pd Yb1 Al2 1_556 . 3_665 96.465(9) ?
Pd Yb1 Al2 1_556 . 3_666 45.326(7) ?
Pd Yb1 Pd 2_665 . 2_666 82.809(10) ?
Pd Yb1 Pd 2_665 . 3_565 81.018(12) ?
Pd Yb1 Pd 2_665 . 3_566 135.948(11) ?
Pd Yb1 Al1 2_665 . 1_565 93.15(2) ?
Pd Yb1 Al1 2_665 . 2_555 128.342(15) ?
Pd Yb1 Al1 2_665 . 3_665 47.524(15) ?
Pd Yb1 Al1 2_665 . 4_665 47.524(13) ?
Pd Yb1 Al1 2_665 . 5_565 128.343(16) ?
Pd Yb1 Al1 2_665 . 6_555 93.15(2) ?
Pd Yb1 Al2 2_665 . 1_565 45.326(10) ?
Pd Yb1 Al2 2_665 . 1_566 96.465(10) ?
Pd Yb1 Al2 2_665 . 2_555 100.524(9) ?
Pd Yb1 Al2 2_665 . 2_556 176.667(5) ?
Pd Yb1 Al2 2_665 . 3_665 45.326(10) ?
Pd Yb1 Al2 2_665 . 3_666 96.465(10) ?
Pd Yb1 Pd 2_666 . 3_565 135.948(11) ?
Pd Yb1 Pd 2_666 . 3_566 81.018(12) ?
Pd Yb1 Al1 2_666 . 1_565 93.15(2) ?
Pd Yb1 Al1 2_666 . 2_555 128.342(15) ?
Pd Yb1 Al1 2_666 . 3_665 47.524(15) ?
Pd Yb1 Al1 2_666 . 4_665 47.524(13) ?
Pd Yb1 Al1 2_666 . 5_565 128.343(16) ?
Pd Yb1 Al1 2_666 . 6_555 93.15(2) ?
Pd Yb1 Al2 2_666 . 1_565 96.465(10) ?
Pd Yb1 Al2 2_666 . 1_566 45.326(10) ?
Pd Yb1 Al2 2_666 . 2_555 176.667(5) ?
Pd Yb1 Al2 2_666 . 2_556 100.524(9) ?
Pd Yb1 Al2 2_666 . 3_665 96.465(10) ?
Pd Yb1 Al2 2_666 . 3_666 45.326(10) ?
Pd Yb1 Pd 3_565 . 3_566 82.810(9) ?
Pd Yb1 Al1 3_565 . 1_565 47.524(12) ?
Pd Yb1 Al1 3_565 . 2_555 93.15(2) ?
Pd Yb1 Al1 3_565 . 3_665 128.342(16) ?
Pd Yb1 Al1 3_565 . 4_665 93.15(2) ?
Pd Yb1 Al1 3_565 . 5_565 47.524(13) ?
Pd Yb1 Al1 3_565 . 6_555 128.342(15) ?
Pd Yb1 Al2 3_565 . 1_565 45.326(8) ?
Pd Yb1 Al2 3_565 . 1_566 96.465(7) ?
Pd Yb1 Al2 3_565 . 2_555 45.326(7) ?
Pd Yb1 Al2 3_565 . 2_556 96.465(9) ?
Pd Yb1 Al2 3_565 . 3_665 100.524(7) ?
Pd Yb1 Al2 3_565 . 3_666 176.667(6) ?
Pd Yb1 Al1 3_566 . 1_565 47.524(12) ?
Pd Yb1 Al1 3_566 . 2_555 93.15(2) ?
Pd Yb1 Al1 3_566 . 3_665 128.342(16) ?
Pd Yb1 Al1 3_566 . 4_665 93.15(2) ?
Pd Yb1 Al1 3_566 . 5_565 47.524(13) ?
Pd Yb1 Al1 3_566 . 6_555 128.342(15) ?
Pd Yb1 Al2 3_566 . 1_565 96.465(7) ?
Pd Yb1 Al2 3_566 . 1_566 45.326(8) ?
Pd Yb1 Al2 3_566 . 2_555 96.465(9) ?
Pd Yb1 Al2 3_566 . 2_556 45.326(7) ?
Pd Yb1 Al2 3_566 . 3_665 176.667(6) ?
Pd Yb1 Al2 3_566 . 3_666 100.524(7) ?
Al1 Yb1 Al1 1_565 . 2_555 120.00(4) ?
Al1 Yb1 Al1 1_565 . 3_665 120.00(4) ?
Al1 Yb1 Al1 1_565 . 4_665 68.40(4) ?
Al1 Yb1 Al1 1_565 . 5_565 51.60(3) ?
Al1 Yb1 Al1 1_565 . 6_555 171.60(4) ?
Al1 Yb1 Al2 1_565 . 1_565 49.374(15) ?
Al1 Yb1 Al2 1_565 . 1_566 49.374(15) ?
Al1 Yb1 Al2 1_565 . 2_555 86.70(2) ?
Al1 Yb1 Al2 1_565 . 2_556 86.70(2) ?
Al1 Yb1 Al2 1_565 . 3_665 135.134(12) ?
Al1 Yb1 Al2 1_565 . 3_666 135.134(12) ?
Al1 Yb1 Al1 2_555 . 3_665 120.00(4) ?
Al1 Yb1 Al1 2_555 . 4_665 171.60(3) ?
Al1 Yb1 Al1 2_555 . 5_565 68.40(4) ?
Al1 Yb1 Al1 2_555 . 6_555 51.60(4) ?
Al1 Yb1 Al2 2_555 . 1_565 135.134(13) ?
Al1 Yb1 Al2 2_555 . 1_566 135.134(13) ?
Al1 Yb1 Al2 2_555 . 2_555 49.374(15) ?
Al1 Yb1 Al2 2_555 . 2_556 49.374(15) ?
Al1 Yb1 Al2 2_555 . 3_665 86.70(2) ?
Al1 Yb1 Al2 2_555 . 3_666 86.70(2) ?
Al1 Yb1 Al1 3_665 . 4_665 51.60(4) ?
Al1 Yb1 Al1 3_665 . 5_565 171.60(4) ?
Al1 Yb1 Al1 3_665 . 6_555 68.40(4) ?
Al1 Yb1 Al2 3_665 . 1_565 86.70(2) ?
Al1 Yb1 Al2 3_665 . 1_566 86.70(2) ?
Al1 Yb1 Al2 3_665 . 2_555 135.134(14) ?
Al1 Yb1 Al2 3_665 . 2_556 135.134(14) ?
Al1 Yb1 Al2 3_665 . 3_665 49.374(16) ?
Al1 Yb1 Al2 3_665 . 3_666 49.374(16) ?
Al1 Yb1 Al1 4_665 . 5_565 120.00(4) ?
Al1 Yb1 Al1 4_665 . 6_555 120.00(4) ?
Al1 Yb1 Al2 4_665 . 1_565 49.374(15) ?
Al1 Yb1 Al2 4_665 . 1_566 49.374(15) ?
Al1 Yb1 Al2 4_665 . 2_555 135.134(13) ?
Al1 Yb1 Al2 4_665 . 2_556 135.134(13) ?
Al1 Yb1 Al2 4_665 . 3_665 86.70(2) ?
Al1 Yb1 Al2 4_665 . 3_666 86.70(2) ?
Al1 Yb1 Al1 5_565 . 6_555 120.00(4) ?
Al1 Yb1 Al2 5_565 . 1_565 86.70(2) ?
Al1 Yb1 Al2 5_565 . 1_566 86.70(2) ?
Al1 Yb1 Al2 5_565 . 2_555 49.374(15) ?
Al1 Yb1 Al2 5_565 . 2_556 49.374(15) ?
Al1 Yb1 Al2 5_565 . 3_665 135.134(12) ?
Al1 Yb1 Al2 5_565 . 3_666 135.134(12) ?
Al1 Yb1 Al2 6_555 . 1_565 135.134(14) ?
Al1 Yb1 Al2 6_555 . 1_566 135.134(14) ?
Al1 Yb1 Al2 6_555 . 2_555 86.70(2) ?
Al1 Yb1 Al2 6_555 . 2_556 86.70(2) ?
Al1 Yb1 Al2 6_555 . 3_665 49.374(16) ?
Al1 Yb1 Al2 6_555 . 3_666 49.374(16) ?
Al2 Yb1 Al2 1_565 . 1_566 76.143(8) ?
Al2 Yb1 Al2 1_565 . 2_555 85.964(8) ?
Al2 Yb1 Al2 1_565 . 2_556 133.640(3) ?
Al2 Yb1 Al2 1_565 . 3_665 85.964(6) ?
Al2 Yb1 Al2 1_565 . 3_666 133.640(6) ?
Al2 Yb1 Al2 1_566 . 2_555 133.640(3) ?
Al2 Yb1 Al2 1_566 . 2_556 85.964(8) ?
Al2 Yb1 Al2 1_566 . 3_665 133.640(6) ?
Al2 Yb1 Al2 1_566 . 3_666 85.964(6) ?
Al2 Yb1 Al2 2_555 . 2_556 76.143(8) ?
Al2 Yb1 Al2 2_555 . 3_665 85.964(6) ?
Al2 Yb1 Al2 2_555 . 3_666 133.640(6) ?
Al2 Yb1 Al2 2_556 . 3_665 133.640(6) ?
Al2 Yb1 Al2 2_556 . 3_666 85.964(6) ?
Al2 Yb1 Al2 3_665 . 3_666 76.143(5) ?
Pd Ca1 Pd . . 1_556 82.809(10) ?
Pd Ca1 Pd . . 2_665 81.018(10) ?
Pd Ca1 Pd . . 2_666 135.948(12) ?
Pd Ca1 Pd . . 3_565 81.018(9) ?
Pd Ca1 Pd . . 3_566 135.948(9) ?
Pd Ca1 Al1 . . 1_565 128.343(15) ?
Pd Ca1 Al1 . . 2_555 47.524(12) ?
Pd Ca1 Al1 . . 3_665 93.15(2) ?
Pd Ca1 Al1 . . 4_665 128.342(14) ?
Pd Ca1 Al1 . . 5_565 93.15(2) ?
Pd Ca1 Al1 . . 6_555 47.524(14) ?
Pd Ca1 Al2 . . 1_565 100.524(9) ?
Pd Ca1 Al2 . . 1_566 176.667(5) ?
Pd Ca1 Al2 . . 2_555 45.326(7) ?
Pd Ca1 Al2 . . 2_556 96.465(8) ?
Pd Ca1 Al2 . . 3_665 45.326(7) ?
Pd Ca1 Al2 . . 3_666 96.465(9) ?
Pd Ca1 Pd 1_556 . 2_665 135.948(12) ?
Pd Ca1 Pd 1_556 . 2_666 81.018(10) ?
Pd Ca1 Pd 1_556 . 3_565 135.948(9) ?
Pd Ca1 Pd 1_556 . 3_566 81.018(9) ?
Pd Ca1 Al1 1_556 . 1_565 128.343(15) ?
Pd Ca1 Al1 1_556 . 2_555 47.524(12) ?
Pd Ca1 Al1 1_556 . 3_665 93.15(2) ?
Pd Ca1 Al1 1_556 . 4_665 128.342(14) ?
Pd Ca1 Al1 1_556 . 5_565 93.15(2) ?
Pd Ca1 Al1 1_556 . 6_555 47.524(14) ?
Pd Ca1 Al2 1_556 . 1_565 176.667(5) ?
Pd Ca1 Al2 1_556 . 1_566 100.524(9) ?
Pd Ca1 Al2 1_556 . 2_555 96.465(8) ?
Pd Ca1 Al2 1_556 . 2_556 45.326(7) ?
Pd Ca1 Al2 1_556 . 3_665 96.465(9) ?
Pd Ca1 Al2 1_556 . 3_666 45.326(7) ?
Pd Ca1 Pd 2_665 . 2_666 82.809(10) ?
Pd Ca1 Pd 2_665 . 3_565 81.018(12) ?
Pd Ca1 Pd 2_665 . 3_566 135.948(11) ?
Pd Ca1 Al1 2_665 . 1_565 93.15(2) ?
Pd Ca1 Al1 2_665 . 2_555 128.342(15) ?
Pd Ca1 Al1 2_665 . 3_665 47.524(15) ?
Pd Ca1 Al1 2_665 . 4_665 47.524(13) ?
Pd Ca1 Al1 2_665 . 5_565 128.343(16) ?
Pd Ca1 Al1 2_665 . 6_555 93.15(2) ?
Pd Ca1 Al2 2_665 . 1_565 45.326(10) ?
Pd Ca1 Al2 2_665 . 1_566 96.465(10) ?
Pd Ca1 Al2 2_665 . 2_555 100.524(9) ?
Pd Ca1 Al2 2_665 . 2_556 176.667(5) ?
Pd Ca1 Al2 2_665 . 3_665 45.326(10) ?
Pd Ca1 Al2 2_665 . 3_666 96.465(10) ?
Pd Ca1 Pd 2_666 . 3_565 135.948(11) ?
Pd Ca1 Pd 2_666 . 3_566 81.018(12) ?
Pd Ca1 Al1 2_666 . 1_565 93.15(2) ?
Pd Ca1 Al1 2_666 . 2_555 128.342(15) ?
Pd Ca1 Al1 2_666 . 3_665 47.524(15) ?
Pd Ca1 Al1 2_666 . 4_665 47.524(13) ?
Pd Ca1 Al1 2_666 . 5_565 128.343(16) ?
Pd Ca1 Al1 2_666 . 6_555 93.15(2) ?
Pd Ca1 Al2 2_666 . 1_565 96.465(10) ?
Pd Ca1 Al2 2_666 . 1_566 45.326(10) ?
Pd Ca1 Al2 2_666 . 2_555 176.667(5) ?
Pd Ca1 Al2 2_666 . 2_556 100.524(9) ?
Pd Ca1 Al2 2_666 . 3_665 96.465(10) ?
Pd Ca1 Al2 2_666 . 3_666 45.326(10) ?
Pd Ca1 Pd 3_565 . 3_566 82.810(9) ?
Pd Ca1 Al1 3_565 . 1_565 47.524(12) ?
Pd Ca1 Al1 3_565 . 2_555 93.15(2) ?
Pd Ca1 Al1 3_565 . 3_665 128.342(16) ?
Pd Ca1 Al1 3_565 . 4_665 93.15(2) ?
Pd Ca1 Al1 3_565 . 5_565 47.524(13) ?
Pd Ca1 Al1 3_565 . 6_555 128.342(15) ?
Pd Ca1 Al2 3_565 . 1_565 45.326(8) ?
Pd Ca1 Al2 3_565 . 1_566 96.465(7) ?
Pd Ca1 Al2 3_565 . 2_555 45.326(7) ?
Pd Ca1 Al2 3_565 . 2_556 96.465(9) ?
Pd Ca1 Al2 3_565 . 3_665 100.524(7) ?
Pd Ca1 Al2 3_565 . 3_666 176.667(6) ?
Pd Ca1 Al1 3_566 . 1_565 47.524(12) ?
Pd Ca1 Al1 3_566 . 2_555 93.15(2) ?
Pd Ca1 Al1 3_566 . 3_665 128.342(16) ?
Pd Ca1 Al1 3_566 . 4_665 93.15(2) ?
Pd Ca1 Al1 3_566 . 5_565 47.524(13) ?
Pd Ca1 Al1 3_566 . 6_555 128.342(15) ?
Pd Ca1 Al2 3_566 . 1_565 96.465(7) ?
Pd Ca1 Al2 3_566 . 1_566 45.326(8) ?
Pd Ca1 Al2 3_566 . 2_555 96.465(9) ?
Pd Ca1 Al2 3_566 . 2_556 45.326(7) ?
Pd Ca1 Al2 3_566 . 3_665 176.667(6) ?
Pd Ca1 Al2 3_566 . 3_666 100.524(7) ?
Al1 Ca1 Al1 1_565 . 2_555 120.00(4) ?
Al1 Ca1 Al1 1_565 . 3_665 120.00(4) ?
Al1 Ca1 Al1 1_565 . 4_665 68.40(4) ?
Al1 Ca1 Al1 1_565 . 5_565 51.60(3) ?
Al1 Ca1 Al1 1_565 . 6_555 171.60(4) ?
Al1 Ca1 Al2 1_565 . 1_565 49.374(15) ?
Al1 Ca1 Al2 1_565 . 1_566 49.374(15) ?
Al1 Ca1 Al2 1_565 . 2_555 86.70(2) ?
Al1 Ca1 Al2 1_565 . 2_556 86.70(2) ?
Al1 Ca1 Al2 1_565 . 3_665 135.134(12) ?
Al1 Ca1 Al2 1_565 . 3_666 135.134(12) ?
Al1 Ca1 Al1 2_555 . 3_665 120.00(4) ?
Al1 Ca1 Al1 2_555 . 4_665 171.60(3) ?
Al1 Ca1 Al1 2_555 . 5_565 68.40(4) ?
Al1 Ca1 Al1 2_555 . 6_555 51.60(4) ?
Al1 Ca1 Al2 2_555 . 1_565 135.134(13) ?
Al1 Ca1 Al2 2_555 . 1_566 135.134(13) ?
Al1 Ca1 Al2 2_555 . 2_555 49.374(15) ?
Al1 Ca1 Al2 2_555 . 2_556 49.374(15) ?
Al1 Ca1 Al2 2_555 . 3_665 86.70(2) ?
Al1 Ca1 Al2 2_555 . 3_666 86.70(2) ?
Al1 Ca1 Al1 3_665 . 4_665 51.60(4) ?
Al1 Ca1 Al1 3_665 . 5_565 171.60(4) ?
Al1 Ca1 Al1 3_665 . 6_555 68.40(4) ?
Al1 Ca1 Al2 3_665 . 1_565 86.70(2) ?
Al1 Ca1 Al2 3_665 . 1_566 86.70(2) ?
Al1 Ca1 Al2 3_665 . 2_555 135.134(14) ?
Al1 Ca1 Al2 3_665 . 2_556 135.134(14) ?
Al1 Ca1 Al2 3_665 . 3_665 49.374(16) ?
Al1 Ca1 Al2 3_665 . 3_666 49.374(16) ?
Al1 Ca1 Al1 4_665 . 5_565 120.00(4) ?
Al1 Ca1 Al1 4_665 . 6_555 120.00(4) ?
Al1 Ca1 Al2 4_665 . 1_565 49.374(15) ?
Al1 Ca1 Al2 4_665 . 1_566 49.374(15) ?
Al1 Ca1 Al2 4_665 . 2_555 135.134(13) ?
Al1 Ca1 Al2 4_665 . 2_556 135.134(13) ?
Al1 Ca1 Al2 4_665 . 3_665 86.70(2) ?
Al1 Ca1 Al2 4_665 . 3_666 86.70(2) ?
Al1 Ca1 Al1 5_565 . 6_555 120.00(4) ?
Al1 Ca1 Al2 5_565 . 1_565 86.70(2) ?
Al1 Ca1 Al2 5_565 . 1_566 86.70(2) ?
Al1 Ca1 Al2 5_565 . 2_555 49.374(15) ?
Al1 Ca1 Al2 5_565 . 2_556 49.374(15) ?
Al1 Ca1 Al2 5_565 . 3_665 135.134(12) ?
Al1 Ca1 Al2 5_565 . 3_666 135.134(12) ?
Al1 Ca1 Al2 6_555 . 1_565 135.134(14) ?
Al1 Ca1 Al2 6_555 . 1_566 135.134(14) ?
Al1 Ca1 Al2 6_555 . 2_555 86.70(2) ?
Al1 Ca1 Al2 6_555 . 2_556 86.70(2) ?
Al1 Ca1 Al2 6_555 . 3_665 49.374(16) ?
Al1 Ca1 Al2 6_555 . 3_666 49.374(16) ?
Al2 Ca1 Al2 1_565 . 1_566 76.143(8) ?
Al2 Ca1 Al2 1_565 . 2_555 85.964(8) ?
Al2 Ca1 Al2 1_565 . 2_556 133.640(3) ?
Al2 Ca1 Al2 1_565 . 3_665 85.964(6) ?
Al2 Ca1 Al2 1_565 . 3_666 133.640(6) ?
Al2 Ca1 Al2 1_566 . 2_555 133.640(3) ?
Al2 Ca1 Al2 1_566 . 2_556 85.964(8) ?
Al2 Ca1 Al2 1_566 . 3_665 133.640(6) ?
Al2 Ca1 Al2 1_566 . 3_666 85.964(6) ?
Al2 Ca1 Al2 2_555 . 2_556 76.143(8) ?
Al2 Ca1 Al2 2_555 . 3_665 85.964(6) ?
Al2 Ca1 Al2 2_555 . 3_666 133.640(6) ?
Al2 Ca1 Al2 2_556 . 3_665 133.640(6) ?
Al2 Ca1 Al2 2_556 . 3_666 85.964(6) ?
Al2 Ca1 Al2 3_665 . 3_666 76.143(5) ?
Pd Yb2 Pd . . 2_555 120.000(13) ?
Pd Yb2 Pd . . 3_555 120.000(11) ?
Pd Yb2 Pd . . 4_555 180.0(5) ?
Pd Yb2 Pd . . 5_555 60.000(13) ?
Pd Yb2 Pd . . 6_555 60.000(11) ?
Pd Yb2 Al1 . . 1_554 90.000(7) ?
Pd Yb2 Al1 . . . 90.000(7) ?
Pd Yb2 Al1 . . 2_554 45.994(13) ?
Pd Yb2 Al1 . . 2_555 45.994(13) ?
Pd Yb2 Al1 . . 3_554 134.01(3) ?
Pd Yb2 Al1 . . 3_555 134.01(3) ?
Pd Yb2 Al1 . . 4_554 90.000(7) ?
Pd Yb2 Al1 . . 4_555 90.000(7) ?
Pd Yb2 Al1 . . 5_554 134.006(13) ?
Pd Yb2 Al1 . . 5_555 134.006(13) ?
Pd Yb2 Al1 . . 6_554 45.99(3) ?
Pd Yb2 Al1 . . 6_555 45.99(3) ?
Pd Yb2 Pd 2_555 . 3_555 120.000(14) ?
Pd Yb2 Pd 2_555 . 4_555 60.000(13) ?
Pd Yb2 Pd 2_555 . 5_555 180.0(5) ?
Pd Yb2 Pd 2_555 . 6_555 60.000(14) ?
Pd Yb2 Al1 2_555 . 1_554 134.006(14) ?
Pd Yb2 Al1 2_555 . . 134.006(14) ?
Pd Yb2 Al1 2_555 . 2_554 90.000(10) ?
Pd Yb2 Al1 2_555 . 2_555 90.000(10) ?
Pd Yb2 Al1 2_555 . 3_554 45.99(3) ?
Pd Yb2 Al1 2_555 . 3_555 45.99(3) ?
Pd Yb2 Al1 2_555 . 4_554 45.994(14) ?
Pd Yb2 Al1 2_555 . 4_555 45.994(14) ?
Pd Yb2 Al1 2_555 . 5_554 90.000(10) ?
Pd Yb2 Al1 2_555 . 5_555 90.000(10) ?
Pd Yb2 Al1 2_555 . 6_554 134.01(3) ?
Pd Yb2 Al1 2_555 . 6_555 134.01(3) ?
Pd Yb2 Pd 3_555 . 4_555 60.000(11) ?
Pd Yb2 Pd 3_555 . 5_555 60.000(14) ?
Pd Yb2 Pd 3_555 . 6_555 180.0(5) ?
Pd Yb2 Al1 3_555 . 1_554 45.994(12) ?
Pd Yb2 Al1 3_555 . . 45.994(12) ?
Pd Yb2 Al1 3_555 . 2_554 134.006(12) ?
Pd Yb2 Al1 3_555 . 2_555 134.006(12) ?
Pd Yb2 Al1 3_555 . 3_554 90.00(3) ?
Pd Yb2 Al1 3_555 . 3_555 90.00(3) ?
Pd Yb2 Al1 3_555 . 4_554 134.006(12) ?
Pd Yb2 Al1 3_555 . 4_555 134.006(12) ?
Pd Yb2 Al1 3_555 . 5_554 45.994(12) ?
Pd Yb2 Al1 3_555 . 5_555 45.994(12) ?
Pd Yb2 Al1 3_555 . 6_554 90.00(3) ?
Pd Yb2 Al1 3_555 . 6_555 90.00(3) ?
Pd Yb2 Pd 4_555 . 5_555 120.000(13) ?
Pd Yb2 Pd 4_555 . 6_555 120.000(11) ?
Pd Yb2 Al1 4_555 . 1_554 90.000(7) ?
Pd Yb2 Al1 4_555 . . 90.000(7) ?
Pd Yb2 Al1 4_555 . 2_554 134.006(13) ?
Pd Yb2 Al1 4_555 . 2_555 134.006(13) ?
Pd Yb2 Al1 4_555 . 3_554 45.99(3) ?
Pd Yb2 Al1 4_555 . 3_555 45.99(3) ?
Pd Yb2 Al1 4_555 . 4_554 90.000(7) ?
Pd Yb2 Al1 4_555 . 4_555 90.000(7) ?
Pd Yb2 Al1 4_555 . 5_554 45.994(13) ?
Pd Yb2 Al1 4_555 . 5_555 45.994(13) ?
Pd Yb2 Al1 4_555 . 6_554 134.01(3) ?
Pd Yb2 Al1 4_555 . 6_555 134.01(3) ?
Pd Yb2 Pd 5_555 . 6_555 120.000(14) ?
Pd Yb2 Al1 5_555 . 1_554 45.994(14) ?
Pd Yb2 Al1 5_555 . . 45.994(14) ?
Pd Yb2 Al1 5_555 . 2_554 90.000(10) ?
Pd Yb2 Al1 5_555 . 2_555 90.000(10) ?
Pd Yb2 Al1 5_555 . 3_554 134.01(3) ?
Pd Yb2 Al1 5_555 . 3_555 134.01(3) ?
Pd Yb2 Al1 5_555 . 4_554 134.006(14) ?
Pd Yb2 Al1 5_555 . 4_555 134.006(14) ?
Pd Yb2 Al1 5_555 . 5_554 90.000(10) ?
Pd Yb2 Al1 5_555 . 5_555 90.000(10) ?
Pd Yb2 Al1 5_555 . 6_554 45.99(3) ?
Pd Yb2 Al1 5_555 . 6_555 45.99(3) ?
Pd Yb2 Al1 6_555 . 1_554 134.006(12) ?
Pd Yb2 Al1 6_555 . . 134.006(12) ?
Pd Yb2 Al1 6_555 . 2_554 45.994(12) ?
Pd Yb2 Al1 6_555 . 2_555 45.994(12) ?
Pd Yb2 Al1 6_555 . 3_554 90.00(3) ?
Pd Yb2 Al1 6_555 . 3_555 90.00(3) ?
Pd Yb2 Al1 6_555 . 4_554 45.994(12) ?
Pd Yb2 Al1 6_555 . 4_555 45.994(12) ?
Pd Yb2 Al1 6_555 . 5_554 134.006(12) ?
Pd Yb2 Al1 6_555 . 5_555 134.006(12) ?
Pd Yb2 Al1 6_555 . 6_554 90.00(3) ?
Pd Yb2 Al1 6_555 . 6_555 90.00(3) ?
Al1 Yb2 Al1 1_554 . . 73.32(2) ?
Al1 Yb2 Al1 1_554 . 2_554 88.012(17) ?
Al1 Yb2 Al1 1_554 . 2_555 132.706(9) ?
Al1 Yb2 Al1 1_554 . 3_554 88.01(3) ?
Al1 Yb2 Al1 1_554 . 3_555 132.71(3) ?
Al1 Yb2 Al1 1_554 . 4_554 106.68(2) ?
Al1 Yb2 Al1 1_554 . 4_555 180.0(5) ?
Al1 Yb2 Al1 1_554 . 5_554 47.294(9) ?
Al1 Yb2 Al1 1_554 . 5_555 91.988(17) ?
Al1 Yb2 Al1 1_554 . 6_554 47.29(3) ?
Al1 Yb2 Al1 1_554 . 6_555 91.99(3) ?
Al1 Yb2 Al1 . . 2_554 132.706(9) ?
Al1 Yb2 Al1 . . 2_555 88.012(17) ?
Al1 Yb2 Al1 . . 3_554 132.71(3) ?
Al1 Yb2 Al1 . . 3_555 88.01(3) ?
Al1 Yb2 Al1 . . 4_554 180.0(5) ?
Al1 Yb2 Al1 . . 4_555 106.68(2) ?
Al1 Yb2 Al1 . . 5_554 91.988(17) ?
Al1 Yb2 Al1 . . 5_555 47.294(9) ?
Al1 Yb2 Al1 . . 6_554 91.99(3) ?
Al1 Yb2 Al1 . . 6_555 47.29(3) ?
Al1 Yb2 Al1 2_554 . 2_555 73.32(2) ?
Al1 Yb2 Al1 2_554 . 3_554 88.01(3) ?
Al1 Yb2 Al1 2_554 . 3_555 132.71(3) ?
Al1 Yb2 Al1 2_554 . 4_554 47.294(9) ?
Al1 Yb2 Al1 2_554 . 4_555 91.988(17) ?
Al1 Yb2 Al1 2_554 . 5_554 106.68(2) ?
Al1 Yb2 Al1 2_554 . 5_555 180.0(5) ?
Al1 Yb2 Al1 2_554 . 6_554 47.29(3) ?
Al1 Yb2 Al1 2_554 . 6_555 91.99(3) ?
Al1 Yb2 Al1 2_555 . 3_554 132.71(3) ?
Al1 Yb2 Al1 2_555 . 3_555 88.01(3) ?
Al1 Yb2 Al1 2_555 . 4_554 91.988(17) ?
Al1 Yb2 Al1 2_555 . 4_555 47.294(9) ?
Al1 Yb2 Al1 2_555 . 5_554 180.0(5) ?
Al1 Yb2 Al1 2_555 . 5_555 106.68(2) ?
Al1 Yb2 Al1 2_555 . 6_554 91.99(3) ?
Al1 Yb2 Al1 2_555 . 6_555 47.29(3) ?
Al1 Yb2 Al1 3_554 . 3_555 73.317(18) ?
Al1 Yb2 Al1 3_554 . 4_554 47.29(3) ?
Al1 Yb2 Al1 3_554 . 4_555 91.99(3) ?
Al1 Yb2 Al1 3_554 . 5_554 47.29(3) ?
Al1 Yb2 Al1 3_554 . 5_555 91.99(3) ?
Al1 Yb2 Al1 3_554 . 6_554 106.683(18) ?
Al1 Yb2 Al1 3_554 . 6_555 180.0(5) ?
Al1 Yb2 Al1 3_555 . 4_554 91.99(3) ?
Al1 Yb2 Al1 3_555 . 4_555 47.29(3) ?
Al1 Yb2 Al1 3_555 . 5_554 91.99(3) ?
Al1 Yb2 Al1 3_555 . 5_555 47.29(3) ?
Al1 Yb2 Al1 3_555 . 6_554 180.0(5) ?
Al1 Yb2 Al1 3_555 . 6_555 106.683(18) ?
Al1 Yb2 Al1 4_554 . 4_555 73.32(2) ?
Al1 Yb2 Al1 4_554 . 5_554 88.012(17) ?
Al1 Yb2 Al1 4_554 . 5_555 132.706(9) ?
Al1 Yb2 Al1 4_554 . 6_554 88.01(3) ?
Al1 Yb2 Al1 4_554 . 6_555 132.71(3) ?
Al1 Yb2 Al1 4_555 . 5_554 132.706(9) ?
Al1 Yb2 Al1 4_555 . 5_555 88.012(17) ?
Al1 Yb2 Al1 4_555 . 6_554 132.71(3) ?
Al1 Yb2 Al1 4_555 . 6_555 88.01(3) ?
Al1 Yb2 Al1 5_554 . 5_555 73.32(2) ?
Al1 Yb2 Al1 5_554 . 6_554 88.01(3) ?
Al1 Yb2 Al1 5_554 . 6_555 132.71(3) ?
Al1 Yb2 Al1 5_555 . 6_554 132.71(3) ?
Al1 Yb2 Al1 5_555 . 6_555 88.01(3) ?
Al1 Yb2 Al1 6_554 . 6_555 73.317(18) ?
Pd Ca2 Pd . . 2_555 120.000(13) ?
Pd Ca2 Pd . . 3_555 120.000(11) ?
Pd Ca2 Pd . . 4_555 180.0(5) ?
Pd Ca2 Pd . . 5_555 60.000(13) ?
Pd Ca2 Pd . . 6_555 60.000(11) ?
Pd Ca2 Al1 . . 1_554 90.000(7) ?
Pd Ca2 Al1 . . . 90.000(7) ?
Pd Ca2 Al1 . . 2_554 45.994(13) ?
Pd Ca2 Al1 . . 2_555 45.994(13) ?
Pd Ca2 Al1 . . 3_554 134.01(3) ?
Pd Ca2 Al1 . . 3_555 134.01(3) ?
Pd Ca2 Al1 . . 4_554 90.000(7) ?
Pd Ca2 Al1 . . 4_555 90.000(7) ?
Pd Ca2 Al1 . . 5_554 134.006(13) ?
Pd Ca2 Al1 . . 5_555 134.006(13) ?
Pd Ca2 Al1 . . 6_554 45.99(3) ?
Pd Ca2 Al1 . . 6_555 45.99(3) ?
Pd Ca2 Pd 2_555 . 3_555 120.000(14) ?
Pd Ca2 Pd 2_555 . 4_555 60.000(13) ?
Pd Ca2 Pd 2_555 . 5_555 180.0(5) ?
Pd Ca2 Pd 2_555 . 6_555 60.000(14) ?
Pd Ca2 Al1 2_555 . 1_554 134.006(14) ?
Pd Ca2 Al1 2_555 . . 134.006(14) ?
Pd Ca2 Al1 2_555 . 2_554 90.000(10) ?
Pd Ca2 Al1 2_555 . 2_555 90.000(10) ?
Pd Ca2 Al1 2_555 . 3_554 45.99(3) ?
Pd Ca2 Al1 2_555 . 3_555 45.99(3) ?
Pd Ca2 Al1 2_555 . 4_554 45.994(14) ?
Pd Ca2 Al1 2_555 . 4_555 45.994(14) ?
Pd Ca2 Al1 2_555 . 5_554 90.000(10) ?
Pd Ca2 Al1 2_555 . 5_555 90.000(10) ?
Pd Ca2 Al1 2_555 . 6_554 134.01(3) ?
Pd Ca2 Al1 2_555 . 6_555 134.01(3) ?
Pd Ca2 Pd 3_555 . 4_555 60.000(11) ?
Pd Ca2 Pd 3_555 . 5_555 60.000(14) ?
Pd Ca2 Pd 3_555 . 6_555 180.0(5) ?
Pd Ca2 Al1 3_555 . 1_554 45.994(12) ?
Pd Ca2 Al1 3_555 . . 45.994(12) ?
Pd Ca2 Al1 3_555 . 2_554 134.006(12) ?
Pd Ca2 Al1 3_555 . 2_555 134.006(12) ?
Pd Ca2 Al1 3_555 . 3_554 90.00(3) ?
Pd Ca2 Al1 3_555 . 3_555 90.00(3) ?
Pd Ca2 Al1 3_555 . 4_554 134.006(12) ?
Pd Ca2 Al1 3_555 . 4_555 134.006(12) ?
Pd Ca2 Al1 3_555 . 5_554 45.994(12) ?
Pd Ca2 Al1 3_555 . 5_555 45.994(12) ?
Pd Ca2 Al1 3_555 . 6_554 90.00(3) ?
Pd Ca2 Al1 3_555 . 6_555 90.00(3) ?
Pd Ca2 Pd 4_555 . 5_555 120.000(13) ?
Pd Ca2 Pd 4_555 . 6_555 120.000(11) ?
Pd Ca2 Al1 4_555 . 1_554 90.000(7) ?
Pd Ca2 Al1 4_555 . . 90.000(7) ?
Pd Ca2 Al1 4_555 . 2_554 134.006(13) ?
Pd Ca2 Al1 4_555 . 2_555 134.006(13) ?
Pd Ca2 Al1 4_555 . 3_554 45.99(3) ?
Pd Ca2 Al1 4_555 . 3_555 45.99(3) ?
Pd Ca2 Al1 4_555 . 4_554 90.000(7) ?
Pd Ca2 Al1 4_555 . 4_555 90.000(7) ?
Pd Ca2 Al1 4_555 . 5_554 45.994(13) ?
Pd Ca2 Al1 4_555 . 5_555 45.994(13) ?
Pd Ca2 Al1 4_555 . 6_554 134.01(3) ?
Pd Ca2 Al1 4_555 . 6_555 134.01(3) ?
Pd Ca2 Pd 5_555 . 6_555 120.000(14) ?
Pd Ca2 Al1 5_555 . 1_554 45.994(14) ?
Pd Ca2 Al1 5_555 . . 45.994(14) ?
Pd Ca2 Al1 5_555 . 2_554 90.000(10) ?
Pd Ca2 Al1 5_555 . 2_555 90.000(10) ?
Pd Ca2 Al1 5_555 . 3_554 134.01(3) ?
Pd Ca2 Al1 5_555 . 3_555 134.01(3) ?
Pd Ca2 Al1 5_555 . 4_554 134.006(14) ?
Pd Ca2 Al1 5_555 . 4_555 134.006(14) ?
Pd Ca2 Al1 5_555 . 5_554 90.000(10) ?
Pd Ca2 Al1 5_555 . 5_555 90.000(10) ?
Pd Ca2 Al1 5_555 . 6_554 45.99(3) ?
Pd Ca2 Al1 5_555 . 6_555 45.99(3) ?
Pd Ca2 Al1 6_555 . 1_554 134.006(12) ?
Pd Ca2 Al1 6_555 . . 134.006(12) ?
Pd Ca2 Al1 6_555 . 2_554 45.994(12) ?
Pd Ca2 Al1 6_555 . 2_555 45.994(12) ?
Pd Ca2 Al1 6_555 . 3_554 90.00(3) ?
Pd Ca2 Al1 6_555 . 3_555 90.00(3) ?
Pd Ca2 Al1 6_555 . 4_554 45.994(12) ?
Pd Ca2 Al1 6_555 . 4_555 45.994(12) ?
Pd Ca2 Al1 6_555 . 5_554 134.006(12) ?
Pd Ca2 Al1 6_555 . 5_555 134.006(12) ?
Pd Ca2 Al1 6_555 . 6_554 90.00(3) ?
Pd Ca2 Al1 6_555 . 6_555 90.00(3) ?
Al1 Ca2 Al1 1_554 . . 73.32(2) ?
Al1 Ca2 Al1 1_554 . 2_554 88.012(17) ?
Al1 Ca2 Al1 1_554 . 2_555 132.706(9) ?
Al1 Ca2 Al1 1_554 . 3_554 88.01(3) ?
Al1 Ca2 Al1 1_554 . 3_555 132.71(3) ?
Al1 Ca2 Al1 1_554 . 4_554 106.68(2) ?
Al1 Ca2 Al1 1_554 . 4_555 180.0(5) ?
Al1 Ca2 Al1 1_554 . 5_554 47.294(9) ?
Al1 Ca2 Al1 1_554 . 5_555 91.988(17) ?
Al1 Ca2 Al1 1_554 . 6_554 47.29(3) ?
Al1 Ca2 Al1 1_554 . 6_555 91.99(3) ?
Al1 Ca2 Al1 . . 2_554 132.706(9) ?
Al1 Ca2 Al1 . . 2_555 88.012(17) ?
Al1 Ca2 Al1 . . 3_554 132.71(3) ?
Al1 Ca2 Al1 . . 3_555 88.01(3) ?
Al1 Ca2 Al1 . . 4_554 180.0(5) ?
Al1 Ca2 Al1 . . 4_555 106.68(2) ?
Al1 Ca2 Al1 . . 5_554 91.988(17) ?
Al1 Ca2 Al1 . . 5_555 47.294(9) ?
Al1 Ca2 Al1 . . 6_554 91.99(3) ?
Al1 Ca2 Al1 . . 6_555 47.29(3) ?
Al1 Ca2 Al1 2_554 . 2_555 73.32(2) ?
Al1 Ca2 Al1 2_554 . 3_554 88.01(3) ?
Al1 Ca2 Al1 2_554 . 3_555 132.71(3) ?
Al1 Ca2 Al1 2_554 . 4_554 47.294(9) ?
Al1 Ca2 Al1 2_554 . 4_555 91.988(17) ?
Al1 Ca2 Al1 2_554 . 5_554 106.68(2) ?
Al1 Ca2 Al1 2_554 . 5_555 180.0(5) ?
Al1 Ca2 Al1 2_554 . 6_554 47.29(3) ?
Al1 Ca2 Al1 2_554 . 6_555 91.99(3) ?
Al1 Ca2 Al1 2_555 . 3_554 132.71(3) ?
Al1 Ca2 Al1 2_555 . 3_555 88.01(3) ?
Al1 Ca2 Al1 2_555 . 4_554 91.988(17) ?
Al1 Ca2 Al1 2_555 . 4_555 47.294(9) ?
Al1 Ca2 Al1 2_555 . 5_554 180.0(5) ?
Al1 Ca2 Al1 2_555 . 5_555 106.68(2) ?
Al1 Ca2 Al1 2_555 . 6_554 91.99(3) ?
Al1 Ca2 Al1 2_555 . 6_555 47.29(3) ?
Al1 Ca2 Al1 3_554 . 3_555 73.317(18) ?
Al1 Ca2 Al1 3_554 . 4_554 47.29(3) ?
Al1 Ca2 Al1 3_554 . 4_555 91.99(3) ?
Al1 Ca2 Al1 3_554 . 5_554 47.29(3) ?
Al1 Ca2 Al1 3_554 . 5_555 91.99(3) ?
Al1 Ca2 Al1 3_554 . 6_554 106.683(18) ?
Al1 Ca2 Al1 3_554 . 6_555 180.0(5) ?
Al1 Ca2 Al1 3_555 . 4_554 91.99(3) ?
Al1 Ca2 Al1 3_555 . 4_555 47.29(3) ?
Al1 Ca2 Al1 3_555 . 5_554 91.99(3) ?
Al1 Ca2 Al1 3_555 . 5_555 47.29(3) ?
Al1 Ca2 Al1 3_555 . 6_554 180.0(5) ?
Al1 Ca2 Al1 3_555 . 6_555 106.683(18) ?
Al1 Ca2 Al1 4_554 . 4_555 73.32(2) ?
Al1 Ca2 Al1 4_554 . 5_554 88.012(17) ?
Al1 Ca2 Al1 4_554 . 5_555 132.706(9) ?
Al1 Ca2 Al1 4_554 . 6_554 88.01(3) ?
Al1 Ca2 Al1 4_554 . 6_555 132.71(3) ?
Al1 Ca2 Al1 4_555 . 5_554 132.706(9) ?
Al1 Ca2 Al1 4_555 . 5_555 88.012(17) ?
Al1 Ca2 Al1 4_555 . 6_554 132.71(3) ?
Al1 Ca2 Al1 4_555 . 6_555 88.01(3) ?
Al1 Ca2 Al1 5_554 . 5_555 73.32(2) ?
Al1 Ca2 Al1 5_554 . 6_554 88.01(3) ?
Al1 Ca2 Al1 5_554 . 6_555 132.71(3) ?
Al1 Ca2 Al1 5_555 . 6_554 132.71(3) ?
Al1 Ca2 Al1 5_555 . 6_555 88.01(3) ?
Al1 Ca2 Al1 6_554 . 6_555 73.317(18) ?
Yb1 Pd Yb1 1_554 . . 82.809(12) ?
Yb1 Pd Ca1 1_554 . 1_554 0.0(5) ?
Yb1 Pd Ca1 1_554 . . 82.809(12) ?
Yb1 Pd Yb2 1_554 . . 138.595(6) ?
Yb1 Pd Ca2 1_554 . . 138.595(6) ?
Yb1 Pd Pd 1_554 . 5_555 112.026(9) ?
Yb1 Pd Pd 1_554 . 6_555 112.026(12) ?
Yb1 Pd Al1 1_554 . 2_554 67.58(3) ?
Yb1 Pd Al1 1_554 . 2_555 133.84(4) ?
Yb1 Pd Al1 1_554 . 6_554 67.58(3) ?
Yb1 Pd Al1 1_554 . 6_555 133.84(3) ?
Yb1 Pd Al2 1_554 . 2_555 72.128(11) ?
Yb1 Pd Al2 1_554 . 3_665 72.128(7) ?
Yb1 Pd Ca1 . . 1_554 82.809(12) ?
Yb1 Pd Ca1 . . . 0.0(5) ?
Yb1 Pd Yb2 . . . 138.595(6) ?
Yb1 Pd Ca2 . . . 138.595(6) ?
Yb1 Pd Pd . . 5_555 112.026(9) ?
Yb1 Pd Pd . . 6_555 112.026(12) ?
Yb1 Pd Al1 . . 2_554 133.84(4) ?
Yb1 Pd Al1 . . 2_555 67.58(3) ?
Yb1 Pd Al1 . . 6_554 133.84(3) ?
Yb1 Pd Al1 . . 6_555 67.58(3) ?
Yb1 Pd Al2 . . 2_555 72.128(11) ?
Yb1 Pd Al2 . . 3_665 72.128(7) ?
Ca1 Pd Ca1 1_554 . . 82.809(12) ?
Ca1 Pd Yb2 1_554 . . 138.595(6) ?
Ca1 Pd Ca2 1_554 . . 138.595(6) ?
Ca1 Pd Pd 1_554 . 5_555 112.026(9) ?
Ca1 Pd Pd 1_554 . 6_555 112.026(12) ?
Ca1 Pd Al1 1_554 . 2_554 67.58(3) ?
Ca1 Pd Al1 1_554 . 2_555 133.84(4) ?
Ca1 Pd Al1 1_554 . 6_554 67.58(3) ?
Ca1 Pd Al1 1_554 . 6_555 133.84(3) ?
Ca1 Pd Al2 1_554 . 2_555 72.128(11) ?
Ca1 Pd Al2 1_554 . 3_665 72.128(7) ?
Ca1 Pd Yb2 . . . 138.595(6) ?
Ca1 Pd Ca2 . . . 138.595(6) ?
Ca1 Pd Pd . . 5_555 112.026(9) ?
Ca1 Pd Pd . . 6_555 112.026(12) ?
Ca1 Pd Al1 . . 2_554 133.84(4) ?
Ca1 Pd Al1 . . 2_555 67.58(3) ?
Ca1 Pd Al1 . . 6_554 133.84(3) ?
Ca1 Pd Al1 . . 6_555 67.58(3) ?
Ca1 Pd Al2 . . 2_555 72.128(11) ?
Ca1 Pd Al2 . . 3_665 72.128(7) ?
Yb2 Pd Ca2 . . . 0.0(5) ?
Yb2 Pd Pd . . 5_555 60.000(13) ?
Yb2 Pd Pd . . 6_555 60.000(10) ?
Yb2 Pd Al1 . . 2_554 78.02(3) ?
Yb2 Pd Al1 . . 2_555 78.02(3) ?
Yb2 Pd Al1 . . 6_554 78.02(3) ?
Yb2 Pd Al1 . . 6_555 78.02(3) ?
Yb2 Pd Al2 . . 2_555 114.152(10) ?
Yb2 Pd Al2 . . 3_665 114.152(16) ?
Ca2 Pd Pd . . 5_555 60.000(13) ?
Ca2 Pd Pd . . 6_555 60.000(10) ?
Ca2 Pd Al1 . . 2_554 78.02(3) ?
Ca2 Pd Al1 . . 2_555 78.02(3) ?
Ca2 Pd Al1 . . 6_554 78.02(3) ?
Ca2 Pd Al1 . . 6_555 78.02(3) ?
Ca2 Pd Al2 . . 2_555 114.152(10) ?
Ca2 Pd Al2 . . 3_665 114.152(16) ?
Pd Pd Pd 5_555 . 6_555 120.000(17) ?
Pd Pd Al1 5_555 . 2_554 111.63(4) ?
Pd Pd Al1 5_555 . 2_555 111.63(4) ?
Pd Pd Al1 5_555 . 6_554 54.82(4) ?
Pd Pd Al1 5_555 . 6_555 54.82(4) ?
Pd Pd Al2 5_555 . 2_555 174.152(13) ?
Pd Pd Al2 5_555 . 3_665 54.152(11) ?
Pd Pd Al1 6_555 . 2_554 54.816(6) ?
Pd Pd Al1 6_555 . 2_555 54.816(6) ?
Pd Pd Al1 6_555 . 6_554 111.63(3) ?
Pd Pd Al1 6_555 . 6_555 111.63(3) ?
Pd Pd Al2 6_555 . 2_555 54.152(11) ?
Pd Pd Al2 6_555 . 3_665 174.15(2) ?
Al1 Pd Al1 2_554 . 2_555 108.583(13) ?
Al1 Pd Al1 2_554 . 6_554 66.12(4) ?
Al1 Pd Al1 2_554 . 6_555 156.04(5) ?
Al1 Pd Al2 2_554 . 2_555 65.62(3) ?
Al1 Pd Al2 2_554 . 3_665 125.639(6) ?
Al1 Pd Al1 2_555 . 6_554 156.04(5) ?
Al1 Pd Al1 2_555 . 6_555 66.12(4) ?
Al1 Pd Al2 2_555 . 2_555 65.62(3) ?
Al1 Pd Al2 2_555 . 3_665 125.639(6) ?
Al1 Pd Al1 6_554 . 6_555 108.58(5) ?
Al1 Pd Al2 6_554 . 2_555 125.64(4) ?
Al1 Pd Al2 6_554 . 3_665 65.62(3) ?
Al1 Pd Al2 6_555 . 2_555 125.64(4) ?
Al1 Pd Al2 6_555 . 3_665 65.62(3) ?
Al2 Pd Al2 2_555 . 3_665 131.696(17) ?
Yb1 Al1 Yb1 1_545 . 4_665 111.60(5) ?
Yb1 Al1 Ca1 1_545 . 1_545 0.0(5) ?
Yb1 Al1 Ca1 1_545 . 4_665 111.60(5) ?
Yb1 Al1 Yb2 1_545 . . 116.801(13) ?
Yb1 Al1 Yb2 1_545 . 1_556 116.801(13) ?
Yb1 Al1 Ca2 1_545 . . 116.801(13) ?
Yb1 Al1 Ca2 1_545 . 1_556 116.801(13) ?
Yb1 Al1 Pd 1_545 . 3_555 64.895(17) ?
Yb1 Al1 Pd 1_545 . 3_556 64.895(17) ?
Yb1 Al1 Pd 1_545 . 5_555 121.93(3) ?
Yb1 Al1 Pd 1_545 . 5_556 121.93(3) ?
Yb1 Al1 Al1 1_545 . 4_655 55.80(2) ?
Yb1 Al1 Al1 1_545 . 5_555 64.20(3) ?
Yb1 Al1 Al1 1_545 . 6_555 175.80(6) ?
Yb1 Al1 Al2 1_545 . . 68.39(3) ?
Yb1 Al1 Al2 1_545 . 1_556 68.39(3) ?
Yb1 Al1 Ca1 4_665 . 1_545 111.60(5) ?
Yb1 Al1 Ca1 4_665 . 4_665 0.0(5) ?
Yb1 Al1 Yb2 4_665 . . 116.802(13) ?
Yb1 Al1 Yb2 4_665 . 1_556 116.802(13) ?
Yb1 Al1 Ca2 4_665 . . 116.802(13) ?
Yb1 Al1 Ca2 4_665 . 1_556 116.802(13) ?
Yb1 Al1 Pd 4_665 . 3_555 121.93(3) ?
Yb1 Al1 Pd 4_665 . 3_556 121.93(3) ?
Yb1 Al1 Pd 4_665 . 5_555 64.895(16) ?
Yb1 Al1 Pd 4_665 . 5_556 64.895(16) ?
Yb1 Al1 Al1 4_665 . 4_655 55.80(3) ?
Yb1 Al1 Al1 4_665 . 5_555 175.80(6) ?
Yb1 Al1 Al1 4_665 . 6_555 64.20(3) ?
Yb1 Al1 Al2 4_665 . . 68.39(3) ?
Yb1 Al1 Al2 4_665 . 1_556 68.39(3) ?
Ca1 Al1 Ca1 1_545 . 4_665 111.60(5) ?
Ca1 Al1 Yb2 1_545 . . 116.801(13) ?
Ca1 Al1 Yb2 1_545 . 1_556 116.801(13) ?
Ca1 Al1 Ca2 1_545 . . 116.801(13) ?
Ca1 Al1 Ca2 1_545 . 1_556 116.801(13) ?
Ca1 Al1 Pd 1_545 . 3_555 64.895(17) ?
Ca1 Al1 Pd 1_545 . 3_556 64.895(17) ?
Ca1 Al1 Pd 1_545 . 5_555 121.93(3) ?
Ca1 Al1 Pd 1_545 . 5_556 121.93(3) ?
Ca1 Al1 Al1 1_545 . 4_655 55.80(2) ?
Ca1 Al1 Al1 1_545 . 5_555 64.20(3) ?
Ca1 Al1 Al1 1_545 . 6_555 175.80(6) ?
Ca1 Al1 Al2 1_545 . . 68.39(3) ?
Ca1 Al1 Al2 1_545 . 1_556 68.39(3) ?
Ca1 Al1 Yb2 4_665 . . 116.802(13) ?
Ca1 Al1 Yb2 4_665 . 1_556 116.802(13) ?
Ca1 Al1 Ca2 4_665 . . 116.802(13) ?
Ca1 Al1 Ca2 4_665 . 1_556 116.802(13) ?
Ca1 Al1 Pd 4_665 . 3_555 121.93(3) ?
Ca1 Al1 Pd 4_665 . 3_556 121.93(3) ?
Ca1 Al1 Pd 4_665 . 5_555 64.895(16) ?
Ca1 Al1 Pd 4_665 . 5_556 64.895(16) ?
Ca1 Al1 Al1 4_665 . 4_655 55.80(3) ?
Ca1 Al1 Al1 4_665 . 5_555 175.80(6) ?
Ca1 Al1 Al1 4_665 . 6_555 64.20(3) ?
Ca1 Al1 Al2 4_665 . . 68.39(3) ?
Ca1 Al1 Al2 4_665 . 1_556 68.39(3) ?
Yb2 Al1 Yb2 . . 1_556 73.32(3) ?
Yb2 Al1 Ca2 . . . 0.0(5) ?
Yb2 Al1 Ca2 . . 1_556 73.32(3) ?
Yb2 Al1 Pd . . 3_555 55.98(2) ?
Yb2 Al1 Pd . . 3_556 114.22(5) ?
Yb2 Al1 Pd . . 5_555 55.98(2) ?
Yb2 Al1 Pd . . 5_556 114.22(5) ?
Yb2 Al1 Al1 . . 4_655 143.341(16) ?
Yb2 Al1 Al1 . . 5_555 66.35(4) ?
Yb2 Al1 Al1 . . 6_555 66.35(4) ?
Yb2 Al1 Al2 . . . 94.286(12) ?
Yb2 Al1 Al2 . . 1_556 167.60(4) ?
Yb2 Al1 Ca2 1_556 . . 73.32(3) ?
Yb2 Al1 Ca2 1_556 . 1_556 0.0(5) ?
Yb2 Al1 Pd 1_556 . 3_555 114.22(5) ?
Yb2 Al1 Pd 1_556 . 3_556 55.98(2) ?
Yb2 Al1 Pd 1_556 . 5_555 114.22(5) ?
Yb2 Al1 Pd 1_556 . 5_556 55.98(2) ?
Yb2 Al1 Al1 1_556 . 4_655 143.341(16) ?
Yb2 Al1 Al1 1_556 . 5_555 66.35(4) ?
Yb2 Al1 Al1 1_556 . 6_555 66.35(4) ?
Yb2 Al1 Al2 1_556 . . 167.60(4) ?
Yb2 Al1 Al2 1_556 . 1_556 94.286(12) ?
Ca2 Al1 Ca2 . . 1_556 73.32(3) ?
Ca2 Al1 Pd . . 3_555 55.98(2) ?
Ca2 Al1 Pd . . 3_556 114.22(5) ?
Ca2 Al1 Pd . . 5_555 55.98(2) ?
Ca2 Al1 Pd . . 5_556 114.22(5) ?
Ca2 Al1 Al1 . . 4_655 143.341(16) ?
Ca2 Al1 Al1 . . 5_555 66.35(4) ?
Ca2 Al1 Al1 . . 6_555 66.35(4) ?
Ca2 Al1 Al2 . . . 94.286(12) ?
Ca2 Al1 Al2 . . 1_556 167.60(4) ?
Ca2 Al1 Pd 1_556 . 3_555 114.22(5) ?
Ca2 Al1 Pd 1_556 . 3_556 55.98(2) ?
Ca2 Al1 Pd 1_556 . 5_555 114.22(5) ?
Ca2 Al1 Pd 1_556 . 5_556 55.98(2) ?
Ca2 Al1 Al1 1_556 . 4_655 143.341(16) ?
Ca2 Al1 Al1 1_556 . 5_555 66.35(4) ?
Ca2 Al1 Al1 1_556 . 6_555 66.35(4) ?
Ca2 Al1 Al2 1_556 . . 167.60(4) ?
Ca2 Al1 Al2 1_556 . 1_556 94.286(12) ?
Pd Al1 Pd 3_555 . 3_556 108.583(13) ?
Pd Al1 Pd 3_555 . 5_555 70.367(12) ?
Pd Al1 Pd 3_555 . 5_556 169.33(7) ?
Pd Al1 Al1 3_555 . 4_655 95.34(4) ?
Pd Al1 Al1 3_555 . 5_555 56.940(16) ?
Pd Al1 Al1 3_555 . 6_555 116.90(4) ?
Pd Al1 Al2 3_555 . . 56.470(17) ?
Pd Al1 Al2 3_555 . 1_556 132.40(5) ?
Pd Al1 Pd 3_556 . 5_555 169.33(7) ?
Pd Al1 Pd 3_556 . 5_556 70.367(12) ?
Pd Al1 Al1 3_556 . 4_655 95.34(4) ?
Pd Al1 Al1 3_556 . 5_555 56.940(16) ?
Pd Al1 Al1 3_556 . 6_555 116.90(4) ?
Pd Al1 Al2 3_556 . . 132.40(5) ?
Pd Al1 Al2 3_556 . 1_556 56.470(17) ?
Pd Al1 Pd 5_555 . 5_556 108.583(17) ?
Pd Al1 Al1 5_555 . 4_655 95.34(4) ?
Pd Al1 Al1 5_555 . 5_555 116.90(4) ?
Pd Al1 Al1 5_555 . 6_555 56.940(18) ?
Pd Al1 Al2 5_555 . . 56.470(17) ?
Pd Al1 Al2 5_555 . 1_556 132.40(5) ?
Pd Al1 Al1 5_556 . 4_655 95.34(4) ?
Pd Al1 Al1 5_556 . 5_555 116.90(4) ?
Pd Al1 Al1 5_556 . 6_555 56.940(18) ?
Pd Al1 Al2 5_556 . . 132.40(5) ?
Pd Al1 Al2 5_556 . 1_556 56.470(17) ?
Al1 Al1 Al1 4_655 . 5_555 120.00(4) ?
Al1 Al1 Al1 4_655 . 6_555 120.00(4) ?
Al1 Al1 Al2 4_655 . . 49.06(3) ?
Al1 Al1 Al2 4_655 . 1_556 49.06(3) ?
Al1 Al1 Al1 5_555 . 6_555 120.00(7) ?
Al1 Al1 Al2 5_555 . . 109.13(2) ?
Al1 Al1 Al2 5_555 . 1_556 109.13(2) ?
Al1 Al1 Al2 6_555 . . 109.127(19) ?
Al1 Al1 Al2 6_555 . 1_556 109.127(19) ?
Al2 Al1 Al2 . . 1_556 98.11(5) ?
Yb1 Al2 Yb1 1_544 . 1_545 76.143(8) ?
Yb1 Al2 Yb1 1_544 . 4_664 103.857(8) ?
Yb1 Al2 Yb1 1_544 . 4_665 180.0(5) ?
Yb1 Al2 Ca1 1_544 . 1_544 0.0(5) ?
Yb1 Al2 Ca1 1_544 . 1_545 76.143(8) ?
Yb1 Al2 Ca1 1_544 . 4_664 103.857(8) ?
Yb1 Al2 Ca1 1_544 . 4_665 180.0(5) ?
Yb1 Al2 Pd 1_544 . 2_655 62.546(8) ?
Yb1 Al2 Pd 1_544 . 3_555 62.546(8) ?
Yb1 Al2 Pd 1_544 . 5_555 117.454(8) ?
Yb1 Al2 Pd 1_544 . 6_655 117.454(8) ?
Yb1 Al2 Al1 1_544 . 1_554 62.239(12) ?
Yb1 Al2 Al1 1_544 . . 117.761(13) ?
Yb1 Al2 Al1 1_544 . 4_654 62.239(13) ?
Yb1 Al2 Al1 1_544 . 4_655 117.761(12) ?
Yb1 Al2 Yb1 1_545 . 4_664 180.0(5) ?
Yb1 Al2 Yb1 1_545 . 4_665 103.857(8) ?
Yb1 Al2 Ca1 1_545 . 1_544 76.143(8) ?
Yb1 Al2 Ca1 1_545 . 1_545 0.0(5) ?
Yb1 Al2 Ca1 1_545 . 4_664 180.0(5) ?
Yb1 Al2 Ca1 1_545 . 4_665 103.857(8) ?
Yb1 Al2 Pd 1_545 . 2_655 62.546(8) ?
Yb1 Al2 Pd 1_545 . 3_555 62.546(8) ?
Yb1 Al2 Pd 1_545 . 5_555 117.454(8) ?
Yb1 Al2 Pd 1_545 . 6_655 117.454(8) ?
Yb1 Al2 Al1 1_545 . 1_554 117.761(13) ?
Yb1 Al2 Al1 1_545 . . 62.239(12) ?
Yb1 Al2 Al1 1_545 . 4_654 117.761(12) ?
Yb1 Al2 Al1 1_545 . 4_655 62.239(13) ?
Yb1 Al2 Yb1 4_664 . 4_665 76.143(8) ?
Yb1 Al2 Ca1 4_664 . 1_544 103.857(8) ?
Yb1 Al2 Ca1 4_664 . 1_545 180.0(5) ?
Yb1 Al2 Ca1 4_664 . 4_664 0.0(5) ?
Yb1 Al2 Ca1 4_664 . 4_665 76.143(8) ?
Yb1 Al2 Pd 4_664 . 2_655 117.454(8) ?
Yb1 Al2 Pd 4_664 . 3_555 117.454(8) ?
Yb1 Al2 Pd 4_664 . 5_555 62.546(8) ?
Yb1 Al2 Pd 4_664 . 6_655 62.546(8) ?
Yb1 Al2 Al1 4_664 . 1_554 62.239(13) ?
Yb1 Al2 Al1 4_664 . . 117.761(12) ?
Yb1 Al2 Al1 4_664 . 4_654 62.239(12) ?
Yb1 Al2 Al1 4_664 . 4_655 117.761(13) ?
Yb1 Al2 Ca1 4_665 . 1_544 180.0(5) ?
Yb1 Al2 Ca1 4_665 . 1_545 103.857(8) ?
Yb1 Al2 Ca1 4_665 . 4_664 76.143(8) ?
Yb1 Al2 Ca1 4_665 . 4_665 0.0(5) ?
Yb1 Al2 Pd 4_665 . 2_655 117.454(8) ?
Yb1 Al2 Pd 4_665 . 3_555 117.454(8) ?
Yb1 Al2 Pd 4_665 . 5_555 62.546(8) ?
Yb1 Al2 Pd 4_665 . 6_655 62.546(8) ?
Yb1 Al2 Al1 4_665 . 1_554 117.761(12) ?
Yb1 Al2 Al1 4_665 . . 62.239(13) ?
Yb1 Al2 Al1 4_665 . 4_654 117.761(13) ?
Yb1 Al2 Al1 4_665 . 4_655 62.239(12) ?
Ca1 Al2 Ca1 1_544 . 1_545 76.143(8) ?
Ca1 Al2 Ca1 1_544 . 4_664 103.857(8) ?
Ca1 Al2 Ca1 1_544 . 4_665 180.0(5) ?
Ca1 Al2 Pd 1_544 . 2_655 62.546(8) ?
Ca1 Al2 Pd 1_544 . 3_555 62.546(8) ?
Ca1 Al2 Pd 1_544 . 5_555 117.454(8) ?
Ca1 Al2 Pd 1_544 . 6_655 117.454(8) ?
Ca1 Al2 Al1 1_544 . 1_554 62.239(12) ?
Ca1 Al2 Al1 1_544 . . 117.761(13) ?
Ca1 Al2 Al1 1_544 . 4_654 62.239(13) ?
Ca1 Al2 Al1 1_544 . 4_655 117.761(12) ?
Ca1 Al2 Ca1 1_545 . 4_664 180.0(5) ?
Ca1 Al2 Ca1 1_545 . 4_665 103.857(8) ?
Ca1 Al2 Pd 1_545 . 2_655 62.546(8) ?
Ca1 Al2 Pd 1_545 . 3_555 62.546(8) ?
Ca1 Al2 Pd 1_545 . 5_555 117.454(8) ?
Ca1 Al2 Pd 1_545 . 6_655 117.454(8) ?
Ca1 Al2 Al1 1_545 . 1_554 117.761(13) ?
Ca1 Al2 Al1 1_545 . . 62.239(12) ?
Ca1 Al2 Al1 1_545 . 4_654 117.761(12) ?
Ca1 Al2 Al1 1_545 . 4_655 62.239(13) ?
Ca1 Al2 Ca1 4_664 . 4_665 76.143(8) ?
Ca1 Al2 Pd 4_664 . 2_655 117.454(8) ?
Ca1 Al2 Pd 4_664 . 3_555 117.454(8) ?
Ca1 Al2 Pd 4_664 . 5_555 62.546(8) ?
Ca1 Al2 Pd 4_664 . 6_655 62.546(8) ?
Ca1 Al2 Al1 4_664 . 1_554 62.239(13) ?
Ca1 Al2 Al1 4_664 . . 117.761(12) ?
Ca1 Al2 Al1 4_664 . 4_654 62.239(12) ?
Ca1 Al2 Al1 4_664 . 4_655 117.761(13) ?
Ca1 Al2 Pd 4_665 . 2_655 117.454(8) ?
Ca1 Al2 Pd 4_665 . 3_555 117.454(8) ?
Ca1 Al2 Pd 4_665 . 5_555 62.546(8) ?
Ca1 Al2 Pd 4_665 . 6_655 62.546(8) ?
Ca1 Al2 Al1 4_665 . 1_554 117.761(12) ?
Ca1 Al2 Al1 4_665 . . 62.239(13) ?
Ca1 Al2 Al1 4_665 . 4_654 117.761(13) ?
Ca1 Al2 Al1 4_665 . 4_655 62.239(12) ?
Pd Al2 Pd 2_655 . 3_555 108.304(13) ?
Pd Al2 Pd 2_655 . 5_555 180.0(5) ?
Pd Al2 Pd 2_655 . 6_655 71.696(13) ?
Pd Al2 Al1 2_655 . 1_554 122.086(19) ?
Pd Al2 Al1 2_655 . . 122.086(19) ?
Pd Al2 Al1 2_655 . 4_654 57.914(19) ?
Pd Al2 Al1 2_655 . 4_655 57.914(19) ?
Pd Al2 Pd 3_555 . 5_555 71.696(13) ?
Pd Al2 Pd 3_555 . 6_655 180.0(5) ?
Pd Al2 Al1 3_555 . 1_554 57.91(2) ?
Pd Al2 Al1 3_555 . . 57.91(2) ?
Pd Al2 Al1 3_555 . 4_654 122.09(2) ?
Pd Al2 Al1 3_555 . 4_655 122.09(2) ?
Pd Al2 Pd 5_555 . 6_655 108.304(13) ?
Pd Al2 Al1 5_555 . 1_554 57.914(19) ?
Pd Al2 Al1 5_555 . . 57.914(19) ?
Pd Al2 Al1 5_555 . 4_654 122.086(19) ?
Pd Al2 Al1 5_555 . 4_655 122.086(19) ?
Pd Al2 Al1 6_655 . 1_554 122.09(2) ?
Pd Al2 Al1 6_655 . . 122.09(2) ?
Pd Al2 Al1 6_655 . 4_654 57.91(2) ?
Pd Al2 Al1 6_655 . 4_655 57.91(2) ?
Al1 Al2 Al1 1_554 . . 98.11(4) ?
Al1 Al2 Al1 1_554 . 4_654 81.89(4) ?
Al1 Al2 Al1 1_554 . 4_655 180.0(5) ?
Al1 Al2 Al1 . . 4_654 180.0(5) ?
Al1 Al2 Al1 . . 4_655 81.89(4) ?
Al1 Al2 Al1 4_654 . 4_655 98.11(4) ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion
_geom_torsion_publ_flag
? ? ? ? ? ? ? ? ? ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_D
_geom_hbond_site_symmetry_H
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_publ_flag
? ? ? ? ? ? ? ? ? ? ?


####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_I_CCDC4
_database_code_depnum_ccdc_archive 'CCDC 1875396'
loop_
_audit_author_name
_audit_author_address
'Oliver Janka'
;WWU Muenster
Germany
;
_audit_update_record             
;
2019-04-17 deposited with the CCDC.	2019-10-14 downloaded from the CCDC.
;
#=======================================================================

# 5. CHEMICAL DATA

_chemical_name_systematic        
; ?
;
_chemical_name_common            ?
_chemical_formula_moiety         ?
_chemical_formula_structural     ?
_chemical_formula_analytical     ?
_chemical_formula_iupac          ?
_chemical_formula_sum            'Al3 Ca0.316 Pd2 Yb0.684'
_chemical_formula_weight         424.8
_chemical_melting_point          ?
_chemical_compound_source        ?
_chemical_absolute_configuration .

#=======================================================================

# 6. CRYSTAL DATA

_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_H-M   'P 6/m m m'
_symmetry_space_group_name_Hall  '-P 6;-2'
_symmetry_Int_Tables_number      191

loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -y,x-y,z
3 -x+y,-x,z
4 -x,-y,z
5 y,-x+y,z
6 x-y,x,z
7 y,x,-z
8 x-y,-y,-z
9 -x,-x+y,-z
10 -y,-x,-z
11 -x+y,y,-z
12 x,x-y,-z
13 -x,-y,-z
14 y,-x+y,-z
15 x-y,x,-z
16 x,y,-z
17 -y,x-y,-z
18 -x+y,-x,-z
19 -y,-x,z
20 -x+y,y,z
21 x,x-y,z
22 y,x,z
23 x-y,-y,z
24 -x,-x+y,z

_cell_length_a                   9.3098(7)
_cell_length_b                   9.3098(7)
_cell_length_c                   4.2140(3)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_volume                     316.30(4)

loop_
_twin_individual_id
_twin_individual_mass_fraction_refined
_twin_individual_twin_matrix_11
_twin_individual_twin_matrix_12
_twin_individual_twin_matrix_13
_twin_individual_twin_matrix_21
_twin_individual_twin_matrix_22
_twin_individual_twin_matrix_23
_twin_individual_twin_matrix_31
_twin_individual_twin_matrix_32
_twin_individual_twin_matrix_33
? ? ? ? ? ? ? ? ? ? ?

_cell_formula_units_Z            3

_cell_measurement_reflns_used    5003
_cell_measurement_theta_min      4.38
_cell_measurement_theta_max      33.55
_cell_measurement_temperature    293
_cell_special_details            
; ?
;

_exptl_crystal_density_diffrn    6.69
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_F_000             556

_exptl_absorpt_coefficient_mu    24.3
_exptl_crystal_description       plate
_exptl_crystal_size_max          0.120
_exptl_crystal_size_mid          0.085
_exptl_crystal_size_min          0.040
_exptl_crystal_size_rad          ?
_exptl_crystal_colour            silver
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   ?
_exptl_absorpt_correction_T_min  0.2298
_exptl_absorpt_correction_T_max  0.5706
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
? ? ? ?

#=======================================================================

# 7. EXPERIMENTAL DATA

_exptl_special_details           ?

_diffrn_ambient_temperature      293
_diffrn_source                   ?
_diffrn_source_power             ?
_diffrn_source_voltage           ?
_diffrn_source_current           ?
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_source         'X-ray tube'
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'IPDS Stoe'
_diffrn_detector                 ?
_diffrn_detector_area_resol_mean ?
_diffrn_measurement_method       '??integration method??'
_diffrn_measurement_specimen_support ?

_diffrn_reflns_number            4800
_diffrn_reflns_theta_min         2.53
_diffrn_reflns_theta_max         33.34
_diffrn_reflns_theta_full        33.34
_diffrn_measured_fraction_theta_max 0.99
_diffrn_measured_fraction_theta_full 0.99
_diffrn_reflns_av_R_equivalents  0.0258
_diffrn_reflns_av_unetI/netI     0.0064
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_l_min       -6
_diffrn_reflns_limit_l_max       6
_diffrn_reflns_reduction_process ?

_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
loop_
_diffrn_standard_refln_index_h
_diffrn_standard_refln_index_k
_diffrn_standard_refln_index_l
? ? ?

_diffrn_radiation_probe          X-ray

#=======================================================================

# 8. REFINEMENT DATA

_refine_special_details          
; ?
;

_reflns_number_total             284
_reflns_number_gt                248
_reflns_threshold_expression     I>3σ(I)

_refine_ls_structure_factor_coef Fsqd
_refine_ls_R_factor_gt           0.0084
_refine_ls_wR_factor_gt          0.0206
_refine_ls_R_factor_all          0.0124
_refine_ls_wR_factor_ref         0.0223
_refine_ls_goodness_of_fit_ref   0.85
_refine_ls_goodness_of_fit_gt    0.84
_refine_ls_restrained_S_gt       ?
_refine_ls_restrained_S_all      ?
_refine_ls_number_reflns         284
_refine_ls_number_parameters     19
_refine_ls_number_restraints     0
_refine_ls_number_constraints    4
_refine_ls_weighting_scheme      sigma
_refine_ls_weighting_details     w=1/(σ²(I)+0.0004I²)
_refine_ls_hydrogen_treatment    ?
_refine_ls_shift/su_max          0.0002
_refine_ls_shift/su_mean         0.0000
_refine_diff_density_max         0.39
_refine_diff_density_min         -0.39
_refine_ls_extinction_method     
'B-C type 1 Lorentzian isotropic (Becker & Coppens, 1974)'
_refine_ls_extinction_coef       464(19)
_refine_ls_abs_structure_details ?
_refine_ls_abs_structure_Flack   ?
_refine_ls_abs_structure_Rogers  ?

loop_
_atom_type_symbol
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Al 0.0645 0.0514 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Ca 0.2262 0.3064 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Pd -0.9988 1.0072 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Yb -0.3850 5.5486 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    ?
_computing_structure_refinement  ?
_computing_molecular_graphics    ?
_computing_publication_material  ?

loop_
_restr_distance_atom_site_label_1
_restr_distance_site_symmetry_1
_restr_distance_atom_site_label_2
_restr_distance_site_symmetry_2
_restr_distance_target
_restr_distance_target_weight_param
? ? ? ? ? ?

loop_
_restr_angle_atom_site_label_1
_restr_angle_site_symmetry_1
_restr_angle_atom_site_label_2
_restr_angle_site_symmetry_2
_restr_angle_atom_site_label_3
_restr_angle_site_symmetry_3
_restr_angle_target
_restr_angle_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_torsion_atom_site_label_1
_restr_torsion_site_symmetry_1
_restr_torsion_atom_site_label_2
_restr_torsion_site_symmetry_2
_restr_torsion_atom_site_label_3
_restr_torsion_site_symmetry_3
_restr_torsion_atom_site_label_4
_restr_torsion_site_symmetry_4
_restr_torsion_angle_target
_restr_torsion_weight_param
? ? ? ? ? ? ? ? ? ?

loop_
_restr_equal_distance_atom_site_label_1
_restr_equal_distance_site_symmetry_1
_restr_equal_distance_atom_site_label_2
_restr_equal_distance_site_symmetry_2
_restr_equal_distance_class_class_id
_restr_equal_distance_class_target_weight_param
? ? ? ? ? ?

loop_
_restr_equal_angle_atom_site_label_1
_restr_equal_angle_site_symmetry_1
_restr_equal_angle_atom_site_label_2
_restr_equal_angle_site_symmetry_2
_restr_equal_angle_atom_site_label_3
_restr_equal_angle_site_symmetry_3
_restr_equal_angle_class_class_id
_restr_equal_angle_class_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_equal_torsion_atom_site_label_1
_restr_equal_torsion_site_symmetry_1
_restr_equal_torsion_atom_site_label_2
_restr_equal_torsion_site_symmetry_2
_restr_equal_torsion_atom_site_label_3
_restr_equal_torsion_site_symmetry_3
_restr_equal_torsion_atom_site_label_4
_restr_equal_torsion_site_symmetry_4
_restr_equal_torsion_class_class_id
_restr_equal_torsion_class_target_weight_param
? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 9. ATOMIC COORDINATES AND DISPLACEMENT PARAMETERS

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_adp_type
_atom_site_U_iso_or_equiv
_atom_site_site_symmetry_multiplicity
_atom_site_occupancy
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ca1 Ca 0.333333 0.666667 0.5 Uani 0.00845(7) 2 0.206(2) d . . .
Yb1 Yb 0.333333 0.666667 0.5 Uani 0.00845(7) 2 0.794(2) d . . .
Ca2 Ca 0 0 0 Uani 0.01107(16) 1 0.536(3) d . . .
Yb2 Yb 0 0 0 Uani 0.01107(16) 1 0.464(3) d . . .
Pd Pd 0.185280(13) 0.37056(3) 0 Uani 0.00727(8) 6 1 d . . .
Al1 Al 0.30395(10) 0 0.5 Uani 0.0086(2) 6 1 d . . .
Al2 Al 0.5 0 0 Uani 0.0089(4) 3 1 d . . .


loop_
_jana_atom_site_ADP_C_label
_jana_atom_site_ADP_C_type_symbol
_jana_atom_site_ADP_C_111
_jana_atom_site_ADP_C_112
_jana_atom_site_ADP_C_113
_jana_atom_site_ADP_C_122
_jana_atom_site_ADP_C_123
_jana_atom_site_ADP_C_133
_jana_atom_site_ADP_C_222
_jana_atom_site_ADP_C_223
_jana_atom_site_ADP_C_233
_jana_atom_site_ADP_C_333
? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_D_label
_jana_atom_site_ADP_D_type_symbol
_jana_atom_site_ADP_D_1111
_jana_atom_site_ADP_D_1112
_jana_atom_site_ADP_D_1113
_jana_atom_site_ADP_D_1122
_jana_atom_site_ADP_D_1123
_jana_atom_site_ADP_D_1133
_jana_atom_site_ADP_D_1222
_jana_atom_site_ADP_D_1223
_jana_atom_site_ADP_D_1233
_jana_atom_site_ADP_D_1333
_jana_atom_site_ADP_D_2222
_jana_atom_site_ADP_D_2223
_jana_atom_site_ADP_D_2233
_jana_atom_site_ADP_D_2333
_jana_atom_site_ADP_D_3333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_E_label
_jana_atom_site_ADP_E_type_symbol
_jana_atom_site_ADP_E_11111
_jana_atom_site_ADP_E_11112
_jana_atom_site_ADP_E_11113
_jana_atom_site_ADP_E_11122
_jana_atom_site_ADP_E_11123
_jana_atom_site_ADP_E_11133
_jana_atom_site_ADP_E_11222
_jana_atom_site_ADP_E_11223
_jana_atom_site_ADP_E_11233
_jana_atom_site_ADP_E_11333
_jana_atom_site_ADP_E_12222
_jana_atom_site_ADP_E_12223
_jana_atom_site_ADP_E_12233
_jana_atom_site_ADP_E_12333
_jana_atom_site_ADP_E_13333
_jana_atom_site_ADP_E_22222
_jana_atom_site_ADP_E_22223
_jana_atom_site_ADP_E_22233
_jana_atom_site_ADP_E_22333
_jana_atom_site_ADP_E_23333
_jana_atom_site_ADP_E_33333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_F_label
_jana_atom_site_ADP_F_type_symbol
_jana_atom_site_ADP_F_111111
_jana_atom_site_ADP_F_111112
_jana_atom_site_ADP_F_111113
_jana_atom_site_ADP_F_111122
_jana_atom_site_ADP_F_111123
_jana_atom_site_ADP_F_111133
_jana_atom_site_ADP_F_111222
_jana_atom_site_ADP_F_111223
_jana_atom_site_ADP_F_111233
_jana_atom_site_ADP_F_111333
_jana_atom_site_ADP_F_112222
_jana_atom_site_ADP_F_112223
_jana_atom_site_ADP_F_112233
_jana_atom_site_ADP_F_112333
_jana_atom_site_ADP_F_113333
_jana_atom_site_ADP_F_122222
_jana_atom_site_ADP_F_122223
_jana_atom_site_ADP_F_122233
_jana_atom_site_ADP_F_122333
_jana_atom_site_ADP_F_123333
_jana_atom_site_ADP_F_133333
_jana_atom_site_ADP_F_222222
_jana_atom_site_ADP_F_222223
_jana_atom_site_ADP_F_222233
_jana_atom_site_ADP_F_222333
_jana_atom_site_ADP_F_223333
_jana_atom_site_ADP_F_233333
_jana_atom_site_ADP_F_333333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 10. MOLECULAR GEOMETRY


loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Yb1 Pd . . 3.1842(5) ?
Yb1 Pd . 1_556 3.1842(5) ?
Yb1 Pd . 2_665 3.1842(5) ?
Yb1 Pd . 2_666 3.1842(5) ?
Yb1 Pd . 3_565 3.1842(3) ?
Yb1 Pd . 3_566 3.1842(3) ?
Yb1 Al1 . 1_565 3.2487(7) ?
Yb1 Al1 . 2_555 3.2487(9) ?
Yb1 Al1 . 3_665 3.2487(11) ?
Yb1 Al1 . 4_665 3.2487(9) ?
Yb1 Al1 . 5_565 3.2487(7) ?
Yb1 Al1 . 6_555 3.2487(11) ?
Yb1 Al2 . 1_565 3.4150(5) ?
Yb1 Al2 . 1_566 3.4150(5) ?
Yb1 Al2 . 2_555 3.4150(5) ?
Yb1 Al2 . 2_556 3.4150(5) ?
Yb1 Al2 . 3_665 3.4150(2) ?
Yb1 Al2 . 3_666 3.4150(2) ?
Ca1 Pd . . 3.1842(5) ?
Ca1 Pd . 1_556 3.1842(5) ?
Ca1 Pd . 2_665 3.1842(5) ?
Ca1 Pd . 2_666 3.1842(5) ?
Ca1 Pd . 3_565 3.1842(3) ?
Ca1 Pd . 3_566 3.1842(3) ?
Ca1 Al1 . 1_565 3.2487(7) ?
Ca1 Al1 . 2_555 3.2487(9) ?
Ca1 Al1 . 3_665 3.2487(11) ?
Ca1 Al1 . 4_665 3.2487(9) ?
Ca1 Al1 . 5_565 3.2487(7) ?
Ca1 Al1 . 6_555 3.2487(11) ?
Ca1 Al2 . 1_565 3.4150(5) ?
Ca1 Al2 . 1_566 3.4150(5) ?
Ca1 Al2 . 2_555 3.4150(5) ?
Ca1 Al2 . 2_556 3.4150(5) ?
Ca1 Al2 . 3_665 3.4150(2) ?
Ca1 Al2 . 3_666 3.4150(2) ?
Yb2 Pd . . 2.9876(7) ?
Yb2 Pd . 2_555 2.9876(7) ?
Yb2 Pd . 3_555 2.9876(3) ?
Yb2 Pd . 4_555 2.9876(7) ?
Yb2 Pd . 5_555 2.9876(7) ?
Yb2 Pd . 6_555 2.9876(3) ?
Yb2 Al1 . 1_554 3.5280(8) ?
Yb2 Al1 . . 3.5280(8) ?
Yb2 Al1 . 2_554 3.5280(8) ?
Yb2 Al1 . 2_555 3.5280(8) ?
Yb2 Al1 . 3_554 3.5280(7) ?
Yb2 Al1 . 3_555 3.5280(7) ?
Yb2 Al1 . 4_554 3.5280(8) ?
Yb2 Al1 . 4_555 3.5280(8) ?
Yb2 Al1 . 5_554 3.5280(8) ?
Yb2 Al1 . 5_555 3.5280(8) ?
Yb2 Al1 . 6_554 3.5280(7) ?
Yb2 Al1 . 6_555 3.5280(7) ?
Ca2 Pd . . 2.9876(7) ?
Ca2 Pd . 2_555 2.9876(7) ?
Ca2 Pd . 3_555 2.9876(3) ?
Ca2 Pd . 4_555 2.9876(7) ?
Ca2 Pd . 5_555 2.9876(7) ?
Ca2 Pd . 6_555 2.9876(3) ?
Ca2 Al1 . 1_554 3.5280(8) ?
Ca2 Al1 . . 3.5280(8) ?
Ca2 Al1 . 2_554 3.5280(8) ?
Ca2 Al1 . 2_555 3.5280(8) ?
Ca2 Al1 . 3_554 3.5280(7) ?
Ca2 Al1 . 3_555 3.5280(7) ?
Ca2 Al1 . 4_554 3.5280(8) ?
Ca2 Al1 . 4_555 3.5280(8) ?
Ca2 Al1 . 5_554 3.5280(8) ?
Ca2 Al1 . 5_555 3.5280(8) ?
Ca2 Al1 . 6_554 3.5280(7) ?
Ca2 Al1 . 6_555 3.5280(7) ?
Pd Pd . 5_555 2.9876(4) ?
Pd Pd . 6_555 2.9876(7) ?
Pd Al1 . 2_554 2.5942(3) ?
Pd Al1 . 2_555 2.5942(3) ?
Pd Al1 . 6_554 2.5942(7) ?
Pd Al1 . 6_555 2.5942(7) ?
Pd Al2 . 2_555 2.5507(3) ?
Pd Al2 . 3_665 2.5507(5) ?
Al1 Al1 . 4_655 3.6504(14) ?
Al1 Al1 . 5_555 2.8297(9) ?
Al1 Al1 . 6_555 2.8297(12) ?
Al1 Al2 . . 2.7876(7) ?
Al1 Al2 . 1_556 2.7876(7) ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
Pd Yb1 Pd . . 1_556 82.861(8) ?
Pd Yb1 Pd . . 2_665 80.979(8) ?
Pd Yb1 Pd . . 2_666 135.966(7) ?
Pd Yb1 Pd . . 3_565 80.980(7) ?
Pd Yb1 Pd . . 3_566 135.966(6) ?
Pd Yb1 Al1 . . 1_565 128.334(9) ?
Pd Yb1 Al1 . . 2_555 47.552(7) ?
Pd Yb1 Al1 . . 3_665 93.134(12) ?
Pd Yb1 Al1 . . 4_665 128.334(8) ?
Pd Yb1 Al1 . . 5_565 93.134(11) ?
Pd Yb1 Al1 . . 6_555 47.552(8) ?
Pd Yb1 Al2 . . 1_565 100.473(8) ?
Pd Yb1 Al2 . . 1_566 176.666(2) ?
Pd Yb1 Al2 . . 2_555 45.309(4) ?
Pd Yb1 Al2 . . 2_556 96.502(7) ?
Pd Yb1 Al2 . . 3_665 45.309(5) ?
Pd Yb1 Al2 . . 3_666 96.502(6) ?
Pd Yb1 Pd 1_556 . 2_665 135.966(7) ?
Pd Yb1 Pd 1_556 . 2_666 80.979(8) ?
Pd Yb1 Pd 1_556 . 3_565 135.966(6) ?
Pd Yb1 Pd 1_556 . 3_566 80.980(7) ?
Pd Yb1 Al1 1_556 . 1_565 128.334(9) ?
Pd Yb1 Al1 1_556 . 2_555 47.552(7) ?
Pd Yb1 Al1 1_556 . 3_665 93.134(12) ?
Pd Yb1 Al1 1_556 . 4_665 128.334(8) ?
Pd Yb1 Al1 1_556 . 5_565 93.134(11) ?
Pd Yb1 Al1 1_556 . 6_555 47.552(8) ?
Pd Yb1 Al2 1_556 . 1_565 176.666(2) ?
Pd Yb1 Al2 1_556 . 1_566 100.473(8) ?
Pd Yb1 Al2 1_556 . 2_555 96.502(7) ?
Pd Yb1 Al2 1_556 . 2_556 45.309(4) ?
Pd Yb1 Al2 1_556 . 3_665 96.502(6) ?
Pd Yb1 Al2 1_556 . 3_666 45.309(5) ?
Pd Yb1 Pd 2_665 . 2_666 82.861(8) ?
Pd Yb1 Pd 2_665 . 3_565 80.980(8) ?
Pd Yb1 Pd 2_665 . 3_566 135.966(7) ?
Pd Yb1 Al1 2_665 . 1_565 93.134(12) ?
Pd Yb1 Al1 2_665 . 2_555 128.334(9) ?
Pd Yb1 Al1 2_665 . 3_665 47.552(9) ?
Pd Yb1 Al1 2_665 . 4_665 47.552(8) ?
Pd Yb1 Al1 2_665 . 5_565 128.334(9) ?
Pd Yb1 Al1 2_665 . 6_555 93.134(13) ?
Pd Yb1 Al2 2_665 . 1_565 45.309(6) ?
Pd Yb1 Al2 2_665 . 1_566 96.502(8) ?
Pd Yb1 Al2 2_665 . 2_555 100.473(8) ?
Pd Yb1 Al2 2_665 . 2_556 176.666(2) ?
Pd Yb1 Al2 2_665 . 3_665 45.309(7) ?
Pd Yb1 Al2 2_665 . 3_666 96.502(7) ?
Pd Yb1 Pd 2_666 . 3_565 135.966(7) ?
Pd Yb1 Pd 2_666 . 3_566 80.980(8) ?
Pd Yb1 Al1 2_666 . 1_565 93.134(12) ?
Pd Yb1 Al1 2_666 . 2_555 128.334(9) ?
Pd Yb1 Al1 2_666 . 3_665 47.552(9) ?
Pd Yb1 Al1 2_666 . 4_665 47.552(8) ?
Pd Yb1 Al1 2_666 . 5_565 128.334(9) ?
Pd Yb1 Al1 2_666 . 6_555 93.134(13) ?
Pd Yb1 Al2 2_666 . 1_565 96.502(8) ?
Pd Yb1 Al2 2_666 . 1_566 45.309(6) ?
Pd Yb1 Al2 2_666 . 2_555 176.666(2) ?
Pd Yb1 Al2 2_666 . 2_556 100.473(8) ?
Pd Yb1 Al2 2_666 . 3_665 96.502(7) ?
Pd Yb1 Al2 2_666 . 3_666 45.309(7) ?
Pd Yb1 Pd 3_565 . 3_566 82.861(6) ?
Pd Yb1 Al1 3_565 . 1_565 47.552(6) ?
Pd Yb1 Al1 3_565 . 2_555 93.134(12) ?
Pd Yb1 Al1 3_565 . 3_665 128.334(9) ?
Pd Yb1 Al1 3_565 . 4_665 93.134(12) ?
Pd Yb1 Al1 3_565 . 5_565 47.552(7) ?
Pd Yb1 Al1 3_565 . 6_555 128.334(8) ?
Pd Yb1 Al2 3_565 . 1_565 45.309(6) ?
Pd Yb1 Al2 3_565 . 1_566 96.502(6) ?
Pd Yb1 Al2 3_565 . 2_555 45.309(5) ?
Pd Yb1 Al2 3_565 . 2_556 96.503(6) ?
Pd Yb1 Al2 3_565 . 3_665 100.473(5) ?
Pd Yb1 Al2 3_565 . 3_666 176.666(3) ?
Pd Yb1 Al1 3_566 . 1_565 47.552(6) ?
Pd Yb1 Al1 3_566 . 2_555 93.134(12) ?
Pd Yb1 Al1 3_566 . 3_665 128.334(9) ?
Pd Yb1 Al1 3_566 . 4_665 93.134(12) ?
Pd Yb1 Al1 3_566 . 5_565 47.552(7) ?
Pd Yb1 Al1 3_566 . 6_555 128.334(8) ?
Pd Yb1 Al2 3_566 . 1_565 96.502(6) ?
Pd Yb1 Al2 3_566 . 1_566 45.309(6) ?
Pd Yb1 Al2 3_566 . 2_555 96.503(6) ?
Pd Yb1 Al2 3_566 . 2_556 45.309(5) ?
Pd Yb1 Al2 3_566 . 3_665 176.666(3) ?
Pd Yb1 Al2 3_566 . 3_666 100.473(5) ?
Al1 Yb1 Al1 1_565 . 2_555 120.00(2) ?
Al1 Yb1 Al1 1_565 . 3_665 120.00(2) ?
Al1 Yb1 Al1 1_565 . 4_665 68.36(2) ?
Al1 Yb1 Al1 1_565 . 5_565 51.637(19) ?
Al1 Yb1 Al1 1_565 . 6_555 171.64(2) ?
Al1 Yb1 Al2 1_565 . 1_565 49.381(9) ?
Al1 Yb1 Al2 1_565 . 1_566 49.381(9) ?
Al1 Yb1 Al2 1_565 . 2_555 86.710(11) ?
Al1 Yb1 Al2 1_565 . 2_556 86.710(11) ?
Al1 Yb1 Al2 1_565 . 3_665 135.106(7) ?
Al1 Yb1 Al2 1_565 . 3_666 135.106(7) ?
Al1 Yb1 Al1 2_555 . 3_665 120.00(2) ?
Al1 Yb1 Al1 2_555 . 4_665 171.636(19) ?
Al1 Yb1 Al1 2_555 . 5_565 68.36(2) ?
Al1 Yb1 Al1 2_555 . 6_555 51.64(2) ?
Al1 Yb1 Al2 2_555 . 1_565 135.106(8) ?
Al1 Yb1 Al2 2_555 . 1_566 135.106(8) ?
Al1 Yb1 Al2 2_555 . 2_555 49.381(9) ?
Al1 Yb1 Al2 2_555 . 2_556 49.381(9) ?
Al1 Yb1 Al2 2_555 . 3_665 86.710(12) ?
Al1 Yb1 Al2 2_555 . 3_666 86.710(12) ?
Al1 Yb1 Al1 3_665 . 4_665 51.64(2) ?
Al1 Yb1 Al1 3_665 . 5_565 171.64(2) ?
Al1 Yb1 Al1 3_665 . 6_555 68.36(2) ?
Al1 Yb1 Al2 3_665 . 1_565 86.710(12) ?
Al1 Yb1 Al2 3_665 . 1_566 86.710(12) ?
Al1 Yb1 Al2 3_665 . 2_555 135.106(8) ?
Al1 Yb1 Al2 3_665 . 2_556 135.106(8) ?
Al1 Yb1 Al2 3_665 . 3_665 49.380(9) ?
Al1 Yb1 Al2 3_665 . 3_666 49.380(9) ?
Al1 Yb1 Al1 4_665 . 5_565 120.00(2) ?
Al1 Yb1 Al1 4_665 . 6_555 120.00(2) ?
Al1 Yb1 Al2 4_665 . 1_565 49.381(9) ?
Al1 Yb1 Al2 4_665 . 1_566 49.381(9) ?
Al1 Yb1 Al2 4_665 . 2_555 135.106(8) ?
Al1 Yb1 Al2 4_665 . 2_556 135.106(8) ?
Al1 Yb1 Al2 4_665 . 3_665 86.710(12) ?
Al1 Yb1 Al2 4_665 . 3_666 86.710(12) ?
Al1 Yb1 Al1 5_565 . 6_555 120.00(2) ?
Al1 Yb1 Al2 5_565 . 1_565 86.710(11) ?
Al1 Yb1 Al2 5_565 . 1_566 86.710(11) ?
Al1 Yb1 Al2 5_565 . 2_555 49.381(9) ?
Al1 Yb1 Al2 5_565 . 2_556 49.381(9) ?
Al1 Yb1 Al2 5_565 . 3_665 135.106(7) ?
Al1 Yb1 Al2 5_565 . 3_666 135.106(7) ?
Al1 Yb1 Al2 6_555 . 1_565 135.106(8) ?
Al1 Yb1 Al2 6_555 . 1_566 135.106(8) ?
Al1 Yb1 Al2 6_555 . 2_555 86.710(12) ?
Al1 Yb1 Al2 6_555 . 2_556 86.710(12) ?
Al1 Yb1 Al2 6_555 . 3_665 49.380(9) ?
Al1 Yb1 Al2 6_555 . 3_666 49.380(9) ?
Al2 Yb1 Al2 1_565 . 1_566 76.193(7) ?
Al2 Yb1 Al2 1_565 . 2_555 85.928(7) ?
Al2 Yb1 Al2 1_565 . 2_556 133.657(3) ?
Al2 Yb1 Al2 1_565 . 3_665 85.928(5) ?
Al2 Yb1 Al2 1_565 . 3_666 133.657(5) ?
Al2 Yb1 Al2 1_566 . 2_555 133.657(3) ?
Al2 Yb1 Al2 1_566 . 2_556 85.928(7) ?
Al2 Yb1 Al2 1_566 . 3_665 133.657(5) ?
Al2 Yb1 Al2 1_566 . 3_666 85.928(5) ?
Al2 Yb1 Al2 2_555 . 2_556 76.193(7) ?
Al2 Yb1 Al2 2_555 . 3_665 85.928(5) ?
Al2 Yb1 Al2 2_555 . 3_666 133.657(5) ?
Al2 Yb1 Al2 2_556 . 3_665 133.657(5) ?
Al2 Yb1 Al2 2_556 . 3_666 85.928(5) ?
Al2 Yb1 Al2 3_665 . 3_666 76.193(4) ?
Pd Ca1 Pd . . 1_556 82.861(8) ?
Pd Ca1 Pd . . 2_665 80.979(8) ?
Pd Ca1 Pd . . 2_666 135.966(7) ?
Pd Ca1 Pd . . 3_565 80.980(7) ?
Pd Ca1 Pd . . 3_566 135.966(6) ?
Pd Ca1 Al1 . . 1_565 128.334(9) ?
Pd Ca1 Al1 . . 2_555 47.552(7) ?
Pd Ca1 Al1 . . 3_665 93.134(12) ?
Pd Ca1 Al1 . . 4_665 128.334(8) ?
Pd Ca1 Al1 . . 5_565 93.134(11) ?
Pd Ca1 Al1 . . 6_555 47.552(8) ?
Pd Ca1 Al2 . . 1_565 100.473(8) ?
Pd Ca1 Al2 . . 1_566 176.666(2) ?
Pd Ca1 Al2 . . 2_555 45.309(4) ?
Pd Ca1 Al2 . . 2_556 96.502(7) ?
Pd Ca1 Al2 . . 3_665 45.309(5) ?
Pd Ca1 Al2 . . 3_666 96.502(6) ?
Pd Ca1 Pd 1_556 . 2_665 135.966(7) ?
Pd Ca1 Pd 1_556 . 2_666 80.979(8) ?
Pd Ca1 Pd 1_556 . 3_565 135.966(6) ?
Pd Ca1 Pd 1_556 . 3_566 80.980(7) ?
Pd Ca1 Al1 1_556 . 1_565 128.334(9) ?
Pd Ca1 Al1 1_556 . 2_555 47.552(7) ?
Pd Ca1 Al1 1_556 . 3_665 93.134(12) ?
Pd Ca1 Al1 1_556 . 4_665 128.334(8) ?
Pd Ca1 Al1 1_556 . 5_565 93.134(11) ?
Pd Ca1 Al1 1_556 . 6_555 47.552(8) ?
Pd Ca1 Al2 1_556 . 1_565 176.666(2) ?
Pd Ca1 Al2 1_556 . 1_566 100.473(8) ?
Pd Ca1 Al2 1_556 . 2_555 96.502(7) ?
Pd Ca1 Al2 1_556 . 2_556 45.309(4) ?
Pd Ca1 Al2 1_556 . 3_665 96.502(6) ?
Pd Ca1 Al2 1_556 . 3_666 45.309(5) ?
Pd Ca1 Pd 2_665 . 2_666 82.861(8) ?
Pd Ca1 Pd 2_665 . 3_565 80.980(8) ?
Pd Ca1 Pd 2_665 . 3_566 135.966(7) ?
Pd Ca1 Al1 2_665 . 1_565 93.134(12) ?
Pd Ca1 Al1 2_665 . 2_555 128.334(9) ?
Pd Ca1 Al1 2_665 . 3_665 47.552(9) ?
Pd Ca1 Al1 2_665 . 4_665 47.552(8) ?
Pd Ca1 Al1 2_665 . 5_565 128.334(9) ?
Pd Ca1 Al1 2_665 . 6_555 93.134(13) ?
Pd Ca1 Al2 2_665 . 1_565 45.309(6) ?
Pd Ca1 Al2 2_665 . 1_566 96.502(8) ?
Pd Ca1 Al2 2_665 . 2_555 100.473(8) ?
Pd Ca1 Al2 2_665 . 2_556 176.666(2) ?
Pd Ca1 Al2 2_665 . 3_665 45.309(7) ?
Pd Ca1 Al2 2_665 . 3_666 96.502(7) ?
Pd Ca1 Pd 2_666 . 3_565 135.966(7) ?
Pd Ca1 Pd 2_666 . 3_566 80.980(8) ?
Pd Ca1 Al1 2_666 . 1_565 93.134(12) ?
Pd Ca1 Al1 2_666 . 2_555 128.334(9) ?
Pd Ca1 Al1 2_666 . 3_665 47.552(9) ?
Pd Ca1 Al1 2_666 . 4_665 47.552(8) ?
Pd Ca1 Al1 2_666 . 5_565 128.334(9) ?
Pd Ca1 Al1 2_666 . 6_555 93.134(13) ?
Pd Ca1 Al2 2_666 . 1_565 96.502(8) ?
Pd Ca1 Al2 2_666 . 1_566 45.309(6) ?
Pd Ca1 Al2 2_666 . 2_555 176.666(2) ?
Pd Ca1 Al2 2_666 . 2_556 100.473(8) ?
Pd Ca1 Al2 2_666 . 3_665 96.502(7) ?
Pd Ca1 Al2 2_666 . 3_666 45.309(7) ?
Pd Ca1 Pd 3_565 . 3_566 82.861(6) ?
Pd Ca1 Al1 3_565 . 1_565 47.552(6) ?
Pd Ca1 Al1 3_565 . 2_555 93.134(12) ?
Pd Ca1 Al1 3_565 . 3_665 128.334(9) ?
Pd Ca1 Al1 3_565 . 4_665 93.134(12) ?
Pd Ca1 Al1 3_565 . 5_565 47.552(7) ?
Pd Ca1 Al1 3_565 . 6_555 128.334(8) ?
Pd Ca1 Al2 3_565 . 1_565 45.309(6) ?
Pd Ca1 Al2 3_565 . 1_566 96.502(6) ?
Pd Ca1 Al2 3_565 . 2_555 45.309(5) ?
Pd Ca1 Al2 3_565 . 2_556 96.503(6) ?
Pd Ca1 Al2 3_565 . 3_665 100.473(5) ?
Pd Ca1 Al2 3_565 . 3_666 176.666(3) ?
Pd Ca1 Al1 3_566 . 1_565 47.552(6) ?
Pd Ca1 Al1 3_566 . 2_555 93.134(12) ?
Pd Ca1 Al1 3_566 . 3_665 128.334(9) ?
Pd Ca1 Al1 3_566 . 4_665 93.134(12) ?
Pd Ca1 Al1 3_566 . 5_565 47.552(7) ?
Pd Ca1 Al1 3_566 . 6_555 128.334(8) ?
Pd Ca1 Al2 3_566 . 1_565 96.502(6) ?
Pd Ca1 Al2 3_566 . 1_566 45.309(6) ?
Pd Ca1 Al2 3_566 . 2_555 96.503(6) ?
Pd Ca1 Al2 3_566 . 2_556 45.309(5) ?
Pd Ca1 Al2 3_566 . 3_665 176.666(3) ?
Pd Ca1 Al2 3_566 . 3_666 100.473(5) ?
Al1 Ca1 Al1 1_565 . 2_555 120.00(2) ?
Al1 Ca1 Al1 1_565 . 3_665 120.00(2) ?
Al1 Ca1 Al1 1_565 . 4_665 68.36(2) ?
Al1 Ca1 Al1 1_565 . 5_565 51.637(19) ?
Al1 Ca1 Al1 1_565 . 6_555 171.64(2) ?
Al1 Ca1 Al2 1_565 . 1_565 49.381(9) ?
Al1 Ca1 Al2 1_565 . 1_566 49.381(9) ?
Al1 Ca1 Al2 1_565 . 2_555 86.710(11) ?
Al1 Ca1 Al2 1_565 . 2_556 86.710(11) ?
Al1 Ca1 Al2 1_565 . 3_665 135.106(7) ?
Al1 Ca1 Al2 1_565 . 3_666 135.106(7) ?
Al1 Ca1 Al1 2_555 . 3_665 120.00(2) ?
Al1 Ca1 Al1 2_555 . 4_665 171.636(19) ?
Al1 Ca1 Al1 2_555 . 5_565 68.36(2) ?
Al1 Ca1 Al1 2_555 . 6_555 51.64(2) ?
Al1 Ca1 Al2 2_555 . 1_565 135.106(8) ?
Al1 Ca1 Al2 2_555 . 1_566 135.106(8) ?
Al1 Ca1 Al2 2_555 . 2_555 49.381(9) ?
Al1 Ca1 Al2 2_555 . 2_556 49.381(9) ?
Al1 Ca1 Al2 2_555 . 3_665 86.710(12) ?
Al1 Ca1 Al2 2_555 . 3_666 86.710(12) ?
Al1 Ca1 Al1 3_665 . 4_665 51.64(2) ?
Al1 Ca1 Al1 3_665 . 5_565 171.64(2) ?
Al1 Ca1 Al1 3_665 . 6_555 68.36(2) ?
Al1 Ca1 Al2 3_665 . 1_565 86.710(12) ?
Al1 Ca1 Al2 3_665 . 1_566 86.710(12) ?
Al1 Ca1 Al2 3_665 . 2_555 135.106(8) ?
Al1 Ca1 Al2 3_665 . 2_556 135.106(8) ?
Al1 Ca1 Al2 3_665 . 3_665 49.380(9) ?
Al1 Ca1 Al2 3_665 . 3_666 49.380(9) ?
Al1 Ca1 Al1 4_665 . 5_565 120.00(2) ?
Al1 Ca1 Al1 4_665 . 6_555 120.00(2) ?
Al1 Ca1 Al2 4_665 . 1_565 49.381(9) ?
Al1 Ca1 Al2 4_665 . 1_566 49.381(9) ?
Al1 Ca1 Al2 4_665 . 2_555 135.106(8) ?
Al1 Ca1 Al2 4_665 . 2_556 135.106(8) ?
Al1 Ca1 Al2 4_665 . 3_665 86.710(12) ?
Al1 Ca1 Al2 4_665 . 3_666 86.710(12) ?
Al1 Ca1 Al1 5_565 . 6_555 120.00(2) ?
Al1 Ca1 Al2 5_565 . 1_565 86.710(11) ?
Al1 Ca1 Al2 5_565 . 1_566 86.710(11) ?
Al1 Ca1 Al2 5_565 . 2_555 49.381(9) ?
Al1 Ca1 Al2 5_565 . 2_556 49.381(9) ?
Al1 Ca1 Al2 5_565 . 3_665 135.106(7) ?
Al1 Ca1 Al2 5_565 . 3_666 135.106(7) ?
Al1 Ca1 Al2 6_555 . 1_565 135.106(8) ?
Al1 Ca1 Al2 6_555 . 1_566 135.106(8) ?
Al1 Ca1 Al2 6_555 . 2_555 86.710(12) ?
Al1 Ca1 Al2 6_555 . 2_556 86.710(12) ?
Al1 Ca1 Al2 6_555 . 3_665 49.380(9) ?
Al1 Ca1 Al2 6_555 . 3_666 49.380(9) ?
Al2 Ca1 Al2 1_565 . 1_566 76.193(7) ?
Al2 Ca1 Al2 1_565 . 2_555 85.928(7) ?
Al2 Ca1 Al2 1_565 . 2_556 133.657(3) ?
Al2 Ca1 Al2 1_565 . 3_665 85.928(5) ?
Al2 Ca1 Al2 1_565 . 3_666 133.657(5) ?
Al2 Ca1 Al2 1_566 . 2_555 133.657(3) ?
Al2 Ca1 Al2 1_566 . 2_556 85.928(7) ?
Al2 Ca1 Al2 1_566 . 3_665 133.657(5) ?
Al2 Ca1 Al2 1_566 . 3_666 85.928(5) ?
Al2 Ca1 Al2 2_555 . 2_556 76.193(7) ?
Al2 Ca1 Al2 2_555 . 3_665 85.928(5) ?
Al2 Ca1 Al2 2_555 . 3_666 133.657(5) ?
Al2 Ca1 Al2 2_556 . 3_665 133.657(5) ?
Al2 Ca1 Al2 2_556 . 3_666 85.928(5) ?
Al2 Ca1 Al2 3_665 . 3_666 76.193(4) ?
Pd Yb2 Pd . . 2_555 120.000(8) ?
Pd Yb2 Pd . . 3_555 120.000(8) ?
Pd Yb2 Pd . . 4_555 180.0(5) ?
Pd Yb2 Pd . . 5_555 60.000(8) ?
Pd Yb2 Pd . . 6_555 60.000(8) ?
Pd Yb2 Al1 . . 1_554 90.000(6) ?
Pd Yb2 Al1 . . . 90.000(6) ?
Pd Yb2 Al1 . . 2_554 46.003(8) ?
Pd Yb2 Al1 . . 2_555 46.003(8) ?
Pd Yb2 Al1 . . 3_554 133.997(14) ?
Pd Yb2 Al1 . . 3_555 133.997(14) ?
Pd Yb2 Al1 . . 4_554 90.000(6) ?
Pd Yb2 Al1 . . 4_555 90.000(6) ?
Pd Yb2 Al1 . . 5_554 133.997(8) ?
Pd Yb2 Al1 . . 5_555 133.997(8) ?
Pd Yb2 Al1 . . 6_554 46.003(14) ?
Pd Yb2 Al1 . . 6_555 46.003(14) ?
Pd Yb2 Pd 2_555 . 3_555 120.000(9) ?
Pd Yb2 Pd 2_555 . 4_555 60.000(8) ?
Pd Yb2 Pd 2_555 . 5_555 180.0(5) ?
Pd Yb2 Pd 2_555 . 6_555 60.000(9) ?
Pd Yb2 Al1 2_555 . 1_554 133.997(8) ?
Pd Yb2 Al1 2_555 . . 133.997(8) ?
Pd Yb2 Al1 2_555 . 2_554 90.000(7) ?
Pd Yb2 Al1 2_555 . 2_555 90.000(7) ?
Pd Yb2 Al1 2_555 . 3_554 46.003(14) ?
Pd Yb2 Al1 2_555 . 3_555 46.003(14) ?
Pd Yb2 Al1 2_555 . 4_554 46.003(8) ?
Pd Yb2 Al1 2_555 . 4_555 46.003(8) ?
Pd Yb2 Al1 2_555 . 5_554 90.000(7) ?
Pd Yb2 Al1 2_555 . 5_555 90.000(7) ?
Pd Yb2 Al1 2_555 . 6_554 133.997(14) ?
Pd Yb2 Al1 2_555 . 6_555 133.997(14) ?
Pd Yb2 Pd 3_555 . 4_555 60.000(8) ?
Pd Yb2 Pd 3_555 . 5_555 60.000(9) ?
Pd Yb2 Pd 3_555 . 6_555 180.0(5) ?
Pd Yb2 Al1 3_555 . 1_554 46.003(7) ?
Pd Yb2 Al1 3_555 . . 46.003(7) ?
Pd Yb2 Al1 3_555 . 2_554 133.997(7) ?
Pd Yb2 Al1 3_555 . 2_555 133.997(7) ?
Pd Yb2 Al1 3_555 . 3_554 90.000(19) ?
Pd Yb2 Al1 3_555 . 3_555 90.000(19) ?
Pd Yb2 Al1 3_555 . 4_554 133.997(7) ?
Pd Yb2 Al1 3_555 . 4_555 133.997(7) ?
Pd Yb2 Al1 3_555 . 5_554 46.003(7) ?
Pd Yb2 Al1 3_555 . 5_555 46.003(7) ?
Pd Yb2 Al1 3_555 . 6_554 90.000(19) ?
Pd Yb2 Al1 3_555 . 6_555 90.000(19) ?
Pd Yb2 Pd 4_555 . 5_555 120.000(8) ?
Pd Yb2 Pd 4_555 . 6_555 120.000(8) ?
Pd Yb2 Al1 4_555 . 1_554 90.000(6) ?
Pd Yb2 Al1 4_555 . . 90.000(6) ?
Pd Yb2 Al1 4_555 . 2_554 133.997(8) ?
Pd Yb2 Al1 4_555 . 2_555 133.997(8) ?
Pd Yb2 Al1 4_555 . 3_554 46.003(14) ?
Pd Yb2 Al1 4_555 . 3_555 46.003(14) ?
Pd Yb2 Al1 4_555 . 4_554 90.000(6) ?
Pd Yb2 Al1 4_555 . 4_555 90.000(6) ?
Pd Yb2 Al1 4_555 . 5_554 46.003(8) ?
Pd Yb2 Al1 4_555 . 5_555 46.003(8) ?
Pd Yb2 Al1 4_555 . 6_554 133.997(14) ?
Pd Yb2 Al1 4_555 . 6_555 133.997(14) ?
Pd Yb2 Pd 5_555 . 6_555 120.000(9) ?
Pd Yb2 Al1 5_555 . 1_554 46.003(8) ?
Pd Yb2 Al1 5_555 . . 46.003(8) ?
Pd Yb2 Al1 5_555 . 2_554 90.000(7) ?
Pd Yb2 Al1 5_555 . 2_555 90.000(7) ?
Pd Yb2 Al1 5_555 . 3_554 133.997(14) ?
Pd Yb2 Al1 5_555 . 3_555 133.997(14) ?
Pd Yb2 Al1 5_555 . 4_554 133.997(8) ?
Pd Yb2 Al1 5_555 . 4_555 133.997(8) ?
Pd Yb2 Al1 5_555 . 5_554 90.000(7) ?
Pd Yb2 Al1 5_555 . 5_555 90.000(7) ?
Pd Yb2 Al1 5_555 . 6_554 46.003(14) ?
Pd Yb2 Al1 5_555 . 6_555 46.003(14) ?
Pd Yb2 Al1 6_555 . 1_554 133.997(7) ?
Pd Yb2 Al1 6_555 . . 133.997(7) ?
Pd Yb2 Al1 6_555 . 2_554 46.003(7) ?
Pd Yb2 Al1 6_555 . 2_555 46.003(7) ?
Pd Yb2 Al1 6_555 . 3_554 90.000(19) ?
Pd Yb2 Al1 6_555 . 3_555 90.000(19) ?
Pd Yb2 Al1 6_555 . 4_554 46.003(7) ?
Pd Yb2 Al1 6_555 . 4_555 46.003(7) ?
Pd Yb2 Al1 6_555 . 5_554 133.997(7) ?
Pd Yb2 Al1 6_555 . 5_555 133.997(7) ?
Pd Yb2 Al1 6_555 . 6_554 90.000(19) ?
Pd Yb2 Al1 6_555 . 6_555 90.000(19) ?
Al1 Yb2 Al1 1_554 . . 73.342(14) ?
Al1 Yb2 Al1 1_554 . 2_554 87.994(10) ?
Al1 Yb2 Al1 1_554 . 2_555 132.714(6) ?
Al1 Yb2 Al1 1_554 . 3_554 87.994(16) ?
Al1 Yb2 Al1 1_554 . 3_555 132.714(18) ?
Al1 Yb2 Al1 1_554 . 4_554 106.658(14) ?
Al1 Yb2 Al1 1_554 . 4_555 180.0(5) ?
Al1 Yb2 Al1 1_554 . 5_554 47.286(6) ?
Al1 Yb2 Al1 1_554 . 5_555 92.006(10) ?
Al1 Yb2 Al1 1_554 . 6_554 47.286(18) ?
Al1 Yb2 Al1 1_554 . 6_555 92.006(16) ?
Al1 Yb2 Al1 . . 2_554 132.714(6) ?
Al1 Yb2 Al1 . . 2_555 87.994(10) ?
Al1 Yb2 Al1 . . 3_554 132.714(18) ?
Al1 Yb2 Al1 . . 3_555 87.994(16) ?
Al1 Yb2 Al1 . . 4_554 180.0(5) ?
Al1 Yb2 Al1 . . 4_555 106.658(14) ?
Al1 Yb2 Al1 . . 5_554 92.006(10) ?
Al1 Yb2 Al1 . . 5_555 47.286(6) ?
Al1 Yb2 Al1 . . 6_554 92.006(16) ?
Al1 Yb2 Al1 . . 6_555 47.286(18) ?
Al1 Yb2 Al1 2_554 . 2_555 73.342(14) ?
Al1 Yb2 Al1 2_554 . 3_554 87.994(16) ?
Al1 Yb2 Al1 2_554 . 3_555 132.714(18) ?
Al1 Yb2 Al1 2_554 . 4_554 47.286(6) ?
Al1 Yb2 Al1 2_554 . 4_555 92.006(10) ?
Al1 Yb2 Al1 2_554 . 5_554 106.658(14) ?
Al1 Yb2 Al1 2_554 . 5_555 180.0(5) ?
Al1 Yb2 Al1 2_554 . 6_554 47.286(18) ?
Al1 Yb2 Al1 2_554 . 6_555 92.006(16) ?
Al1 Yb2 Al1 2_555 . 3_554 132.714(18) ?
Al1 Yb2 Al1 2_555 . 3_555 87.994(16) ?
Al1 Yb2 Al1 2_555 . 4_554 92.006(10) ?
Al1 Yb2 Al1 2_555 . 4_555 47.286(6) ?
Al1 Yb2 Al1 2_555 . 5_554 180.0(5) ?
Al1 Yb2 Al1 2_555 . 5_555 106.658(14) ?
Al1 Yb2 Al1 2_555 . 6_554 92.006(16) ?
Al1 Yb2 Al1 2_555 . 6_555 47.286(18) ?
Al1 Yb2 Al1 3_554 . 3_555 73.342(11) ?
Al1 Yb2 Al1 3_554 . 4_554 47.286(18) ?
Al1 Yb2 Al1 3_554 . 4_555 92.006(16) ?
Al1 Yb2 Al1 3_554 . 5_554 47.286(18) ?
Al1 Yb2 Al1 3_554 . 5_555 92.006(16) ?
Al1 Yb2 Al1 3_554 . 6_554 106.658(11) ?
Al1 Yb2 Al1 3_554 . 6_555 180.0(5) ?
Al1 Yb2 Al1 3_555 . 4_554 92.006(16) ?
Al1 Yb2 Al1 3_555 . 4_555 47.286(18) ?
Al1 Yb2 Al1 3_555 . 5_554 92.006(16) ?
Al1 Yb2 Al1 3_555 . 5_555 47.286(18) ?
Al1 Yb2 Al1 3_555 . 6_554 180.0(5) ?
Al1 Yb2 Al1 3_555 . 6_555 106.658(11) ?
Al1 Yb2 Al1 4_554 . 4_555 73.342(14) ?
Al1 Yb2 Al1 4_554 . 5_554 87.994(10) ?
Al1 Yb2 Al1 4_554 . 5_555 132.714(6) ?
Al1 Yb2 Al1 4_554 . 6_554 87.994(16) ?
Al1 Yb2 Al1 4_554 . 6_555 132.714(18) ?
Al1 Yb2 Al1 4_555 . 5_554 132.714(6) ?
Al1 Yb2 Al1 4_555 . 5_555 87.994(10) ?
Al1 Yb2 Al1 4_555 . 6_554 132.714(18) ?
Al1 Yb2 Al1 4_555 . 6_555 87.994(16) ?
Al1 Yb2 Al1 5_554 . 5_555 73.342(14) ?
Al1 Yb2 Al1 5_554 . 6_554 87.994(16) ?
Al1 Yb2 Al1 5_554 . 6_555 132.714(18) ?
Al1 Yb2 Al1 5_555 . 6_554 132.714(18) ?
Al1 Yb2 Al1 5_555 . 6_555 87.994(16) ?
Al1 Yb2 Al1 6_554 . 6_555 73.342(11) ?
Pd Ca2 Pd . . 2_555 120.000(8) ?
Pd Ca2 Pd . . 3_555 120.000(8) ?
Pd Ca2 Pd . . 4_555 180.0(5) ?
Pd Ca2 Pd . . 5_555 60.000(8) ?
Pd Ca2 Pd . . 6_555 60.000(8) ?
Pd Ca2 Al1 . . 1_554 90.000(6) ?
Pd Ca2 Al1 . . . 90.000(6) ?
Pd Ca2 Al1 . . 2_554 46.003(8) ?
Pd Ca2 Al1 . . 2_555 46.003(8) ?
Pd Ca2 Al1 . . 3_554 133.997(14) ?
Pd Ca2 Al1 . . 3_555 133.997(14) ?
Pd Ca2 Al1 . . 4_554 90.000(6) ?
Pd Ca2 Al1 . . 4_555 90.000(6) ?
Pd Ca2 Al1 . . 5_554 133.997(8) ?
Pd Ca2 Al1 . . 5_555 133.997(8) ?
Pd Ca2 Al1 . . 6_554 46.003(14) ?
Pd Ca2 Al1 . . 6_555 46.003(14) ?
Pd Ca2 Pd 2_555 . 3_555 120.000(9) ?
Pd Ca2 Pd 2_555 . 4_555 60.000(8) ?
Pd Ca2 Pd 2_555 . 5_555 180.0(5) ?
Pd Ca2 Pd 2_555 . 6_555 60.000(9) ?
Pd Ca2 Al1 2_555 . 1_554 133.997(8) ?
Pd Ca2 Al1 2_555 . . 133.997(8) ?
Pd Ca2 Al1 2_555 . 2_554 90.000(7) ?
Pd Ca2 Al1 2_555 . 2_555 90.000(7) ?
Pd Ca2 Al1 2_555 . 3_554 46.003(14) ?
Pd Ca2 Al1 2_555 . 3_555 46.003(14) ?
Pd Ca2 Al1 2_555 . 4_554 46.003(8) ?
Pd Ca2 Al1 2_555 . 4_555 46.003(8) ?
Pd Ca2 Al1 2_555 . 5_554 90.000(7) ?
Pd Ca2 Al1 2_555 . 5_555 90.000(7) ?
Pd Ca2 Al1 2_555 . 6_554 133.997(14) ?
Pd Ca2 Al1 2_555 . 6_555 133.997(14) ?
Pd Ca2 Pd 3_555 . 4_555 60.000(8) ?
Pd Ca2 Pd 3_555 . 5_555 60.000(9) ?
Pd Ca2 Pd 3_555 . 6_555 180.0(5) ?
Pd Ca2 Al1 3_555 . 1_554 46.003(7) ?
Pd Ca2 Al1 3_555 . . 46.003(7) ?
Pd Ca2 Al1 3_555 . 2_554 133.997(7) ?
Pd Ca2 Al1 3_555 . 2_555 133.997(7) ?
Pd Ca2 Al1 3_555 . 3_554 90.000(19) ?
Pd Ca2 Al1 3_555 . 3_555 90.000(19) ?
Pd Ca2 Al1 3_555 . 4_554 133.997(7) ?
Pd Ca2 Al1 3_555 . 4_555 133.997(7) ?
Pd Ca2 Al1 3_555 . 5_554 46.003(7) ?
Pd Ca2 Al1 3_555 . 5_555 46.003(7) ?
Pd Ca2 Al1 3_555 . 6_554 90.000(19) ?
Pd Ca2 Al1 3_555 . 6_555 90.000(19) ?
Pd Ca2 Pd 4_555 . 5_555 120.000(8) ?
Pd Ca2 Pd 4_555 . 6_555 120.000(8) ?
Pd Ca2 Al1 4_555 . 1_554 90.000(6) ?
Pd Ca2 Al1 4_555 . . 90.000(6) ?
Pd Ca2 Al1 4_555 . 2_554 133.997(8) ?
Pd Ca2 Al1 4_555 . 2_555 133.997(8) ?
Pd Ca2 Al1 4_555 . 3_554 46.003(14) ?
Pd Ca2 Al1 4_555 . 3_555 46.003(14) ?
Pd Ca2 Al1 4_555 . 4_554 90.000(6) ?
Pd Ca2 Al1 4_555 . 4_555 90.000(6) ?
Pd Ca2 Al1 4_555 . 5_554 46.003(8) ?
Pd Ca2 Al1 4_555 . 5_555 46.003(8) ?
Pd Ca2 Al1 4_555 . 6_554 133.997(14) ?
Pd Ca2 Al1 4_555 . 6_555 133.997(14) ?
Pd Ca2 Pd 5_555 . 6_555 120.000(9) ?
Pd Ca2 Al1 5_555 . 1_554 46.003(8) ?
Pd Ca2 Al1 5_555 . . 46.003(8) ?
Pd Ca2 Al1 5_555 . 2_554 90.000(7) ?
Pd Ca2 Al1 5_555 . 2_555 90.000(7) ?
Pd Ca2 Al1 5_555 . 3_554 133.997(14) ?
Pd Ca2 Al1 5_555 . 3_555 133.997(14) ?
Pd Ca2 Al1 5_555 . 4_554 133.997(8) ?
Pd Ca2 Al1 5_555 . 4_555 133.997(8) ?
Pd Ca2 Al1 5_555 . 5_554 90.000(7) ?
Pd Ca2 Al1 5_555 . 5_555 90.000(7) ?
Pd Ca2 Al1 5_555 . 6_554 46.003(14) ?
Pd Ca2 Al1 5_555 . 6_555 46.003(14) ?
Pd Ca2 Al1 6_555 . 1_554 133.997(7) ?
Pd Ca2 Al1 6_555 . . 133.997(7) ?
Pd Ca2 Al1 6_555 . 2_554 46.003(7) ?
Pd Ca2 Al1 6_555 . 2_555 46.003(7) ?
Pd Ca2 Al1 6_555 . 3_554 90.000(19) ?
Pd Ca2 Al1 6_555 . 3_555 90.000(19) ?
Pd Ca2 Al1 6_555 . 4_554 46.003(7) ?
Pd Ca2 Al1 6_555 . 4_555 46.003(7) ?
Pd Ca2 Al1 6_555 . 5_554 133.997(7) ?
Pd Ca2 Al1 6_555 . 5_555 133.997(7) ?
Pd Ca2 Al1 6_555 . 6_554 90.000(19) ?
Pd Ca2 Al1 6_555 . 6_555 90.000(19) ?
Al1 Ca2 Al1 1_554 . . 73.342(14) ?
Al1 Ca2 Al1 1_554 . 2_554 87.994(10) ?
Al1 Ca2 Al1 1_554 . 2_555 132.714(6) ?
Al1 Ca2 Al1 1_554 . 3_554 87.994(16) ?
Al1 Ca2 Al1 1_554 . 3_555 132.714(18) ?
Al1 Ca2 Al1 1_554 . 4_554 106.658(14) ?
Al1 Ca2 Al1 1_554 . 4_555 180.0(5) ?
Al1 Ca2 Al1 1_554 . 5_554 47.286(6) ?
Al1 Ca2 Al1 1_554 . 5_555 92.006(10) ?
Al1 Ca2 Al1 1_554 . 6_554 47.286(18) ?
Al1 Ca2 Al1 1_554 . 6_555 92.006(16) ?
Al1 Ca2 Al1 . . 2_554 132.714(6) ?
Al1 Ca2 Al1 . . 2_555 87.994(10) ?
Al1 Ca2 Al1 . . 3_554 132.714(18) ?
Al1 Ca2 Al1 . . 3_555 87.994(16) ?
Al1 Ca2 Al1 . . 4_554 180.0(5) ?
Al1 Ca2 Al1 . . 4_555 106.658(14) ?
Al1 Ca2 Al1 . . 5_554 92.006(10) ?
Al1 Ca2 Al1 . . 5_555 47.286(6) ?
Al1 Ca2 Al1 . . 6_554 92.006(16) ?
Al1 Ca2 Al1 . . 6_555 47.286(18) ?
Al1 Ca2 Al1 2_554 . 2_555 73.342(14) ?
Al1 Ca2 Al1 2_554 . 3_554 87.994(16) ?
Al1 Ca2 Al1 2_554 . 3_555 132.714(18) ?
Al1 Ca2 Al1 2_554 . 4_554 47.286(6) ?
Al1 Ca2 Al1 2_554 . 4_555 92.006(10) ?
Al1 Ca2 Al1 2_554 . 5_554 106.658(14) ?
Al1 Ca2 Al1 2_554 . 5_555 180.0(5) ?
Al1 Ca2 Al1 2_554 . 6_554 47.286(18) ?
Al1 Ca2 Al1 2_554 . 6_555 92.006(16) ?
Al1 Ca2 Al1 2_555 . 3_554 132.714(18) ?
Al1 Ca2 Al1 2_555 . 3_555 87.994(16) ?
Al1 Ca2 Al1 2_555 . 4_554 92.006(10) ?
Al1 Ca2 Al1 2_555 . 4_555 47.286(6) ?
Al1 Ca2 Al1 2_555 . 5_554 180.0(5) ?
Al1 Ca2 Al1 2_555 . 5_555 106.658(14) ?
Al1 Ca2 Al1 2_555 . 6_554 92.006(16) ?
Al1 Ca2 Al1 2_555 . 6_555 47.286(18) ?
Al1 Ca2 Al1 3_554 . 3_555 73.342(11) ?
Al1 Ca2 Al1 3_554 . 4_554 47.286(18) ?
Al1 Ca2 Al1 3_554 . 4_555 92.006(16) ?
Al1 Ca2 Al1 3_554 . 5_554 47.286(18) ?
Al1 Ca2 Al1 3_554 . 5_555 92.006(16) ?
Al1 Ca2 Al1 3_554 . 6_554 106.658(11) ?
Al1 Ca2 Al1 3_554 . 6_555 180.0(5) ?
Al1 Ca2 Al1 3_555 . 4_554 92.006(16) ?
Al1 Ca2 Al1 3_555 . 4_555 47.286(18) ?
Al1 Ca2 Al1 3_555 . 5_554 92.006(16) ?
Al1 Ca2 Al1 3_555 . 5_555 47.286(18) ?
Al1 Ca2 Al1 3_555 . 6_554 180.0(5) ?
Al1 Ca2 Al1 3_555 . 6_555 106.658(11) ?
Al1 Ca2 Al1 4_554 . 4_555 73.342(14) ?
Al1 Ca2 Al1 4_554 . 5_554 87.994(10) ?
Al1 Ca2 Al1 4_554 . 5_555 132.714(6) ?
Al1 Ca2 Al1 4_554 . 6_554 87.994(16) ?
Al1 Ca2 Al1 4_554 . 6_555 132.714(18) ?
Al1 Ca2 Al1 4_555 . 5_554 132.714(6) ?
Al1 Ca2 Al1 4_555 . 5_555 87.994(10) ?
Al1 Ca2 Al1 4_555 . 6_554 132.714(18) ?
Al1 Ca2 Al1 4_555 . 6_555 87.994(16) ?
Al1 Ca2 Al1 5_554 . 5_555 73.342(14) ?
Al1 Ca2 Al1 5_554 . 6_554 87.994(16) ?
Al1 Ca2 Al1 5_554 . 6_555 132.714(18) ?
Al1 Ca2 Al1 5_555 . 6_554 132.714(18) ?
Al1 Ca2 Al1 5_555 . 6_555 87.994(16) ?
Al1 Ca2 Al1 6_554 . 6_555 73.342(11) ?
Yb1 Pd Yb1 1_554 . . 82.861(9) ?
Yb1 Pd Ca1 1_554 . 1_554 0.0(5) ?
Yb1 Pd Ca1 1_554 . . 82.861(9) ?
Yb1 Pd Yb2 1_554 . . 138.570(4) ?
Yb1 Pd Ca2 1_554 . . 138.570(4) ?
Yb1 Pd Pd 1_554 . 5_555 112.017(6) ?
Yb1 Pd Pd 1_554 . 6_555 112.017(7) ?
Yb1 Pd Al1 1_554 . 2_554 67.528(15) ?
Yb1 Pd Al1 1_554 . 2_555 133.84(2) ?
Yb1 Pd Al1 1_554 . 6_554 67.528(19) ?
Yb1 Pd Al1 1_554 . 6_555 133.841(15) ?
Yb1 Pd Al2 1_554 . 2_555 72.136(7) ?
Yb1 Pd Al2 1_554 . 3_665 72.136(5) ?
Yb1 Pd Ca1 . . 1_554 82.861(9) ?
Yb1 Pd Ca1 . . . 0.0(5) ?
Yb1 Pd Yb2 . . . 138.570(4) ?
Yb1 Pd Ca2 . . . 138.570(4) ?
Yb1 Pd Pd . . 5_555 112.017(6) ?
Yb1 Pd Pd . . 6_555 112.017(7) ?
Yb1 Pd Al1 . . 2_554 133.84(2) ?
Yb1 Pd Al1 . . 2_555 67.528(15) ?
Yb1 Pd Al1 . . 6_554 133.841(15) ?
Yb1 Pd Al1 . . 6_555 67.528(19) ?
Yb1 Pd Al2 . . 2_555 72.136(7) ?
Yb1 Pd Al2 . . 3_665 72.136(5) ?
Ca1 Pd Ca1 1_554 . . 82.861(9) ?
Ca1 Pd Yb2 1_554 . . 138.570(4) ?
Ca1 Pd Ca2 1_554 . . 138.570(4) ?
Ca1 Pd Pd 1_554 . 5_555 112.017(6) ?
Ca1 Pd Pd 1_554 . 6_555 112.017(7) ?
Ca1 Pd Al1 1_554 . 2_554 67.528(15) ?
Ca1 Pd Al1 1_554 . 2_555 133.84(2) ?
Ca1 Pd Al1 1_554 . 6_554 67.528(19) ?
Ca1 Pd Al1 1_554 . 6_555 133.841(15) ?
Ca1 Pd Al2 1_554 . 2_555 72.136(7) ?
Ca1 Pd Al2 1_554 . 3_665 72.136(5) ?
Ca1 Pd Yb2 . . . 138.570(4) ?
Ca1 Pd Ca2 . . . 138.570(4) ?
Ca1 Pd Pd . . 5_555 112.017(6) ?
Ca1 Pd Pd . . 6_555 112.017(7) ?
Ca1 Pd Al1 . . 2_554 133.84(2) ?
Ca1 Pd Al1 . . 2_555 67.528(15) ?
Ca1 Pd Al1 . . 6_554 133.841(15) ?
Ca1 Pd Al1 . . 6_555 67.528(19) ?
Ca1 Pd Al2 . . 2_555 72.136(7) ?
Ca1 Pd Al2 . . 3_665 72.136(5) ?
Yb2 Pd Ca2 . . . 0.0(5) ?
Yb2 Pd Pd . . 5_555 60.000(8) ?
Yb2 Pd Pd . . 6_555 60.000(7) ?
Yb2 Pd Al1 . . 2_554 78.053(19) ?
Yb2 Pd Al1 . . 2_555 78.053(19) ?
Yb2 Pd Al1 . . 6_554 78.053(17) ?
Yb2 Pd Al1 . . 6_555 78.053(17) ?
Yb2 Pd Al2 . . 2_555 114.151(7) ?
Yb2 Pd Al2 . . 3_665 114.151(10) ?
Ca2 Pd Pd . . 5_555 60.000(8) ?
Ca2 Pd Pd . . 6_555 60.000(7) ?
Ca2 Pd Al1 . . 2_554 78.053(19) ?
Ca2 Pd Al1 . . 2_555 78.053(19) ?
Ca2 Pd Al1 . . 6_554 78.053(17) ?
Ca2 Pd Al1 . . 6_555 78.053(17) ?
Ca2 Pd Al2 . . 2_555 114.151(7) ?
Ca2 Pd Al2 . . 3_665 114.151(10) ?
Pd Pd Pd 5_555 . 6_555 120.000(10) ?
Pd Pd Al1 5_555 . 2_554 111.643(19) ?
Pd Pd Al1 5_555 . 2_555 111.643(19) ?
Pd Pd Al1 5_555 . 6_554 54.84(2) ?
Pd Pd Al1 5_555 . 6_555 54.84(2) ?
Pd Pd Al2 5_555 . 2_555 174.151(7) ?
Pd Pd Al2 5_555 . 3_665 54.151(8) ?
Pd Pd Al1 6_555 . 2_554 54.842(4) ?
Pd Pd Al1 6_555 . 2_555 54.842(4) ?
Pd Pd Al1 6_555 . 6_554 111.643(16) ?
Pd Pd Al1 6_555 . 6_555 111.643(16) ?
Pd Pd Al2 6_555 . 2_555 54.151(7) ?
Pd Pd Al2 6_555 . 3_665 174.151(11) ?
Al1 Pd Al1 2_554 . 2_555 108.625(9) ?
Al1 Pd Al1 2_554 . 6_554 66.10(2) ?
Al1 Pd Al1 2_554 . 6_555 156.11(3) ?
Al1 Pd Al2 2_554 . 2_555 65.609(18) ?
Al1 Pd Al2 2_554 . 3_665 125.617(4) ?
Al1 Pd Al1 2_555 . 6_554 156.11(3) ?
Al1 Pd Al1 2_555 . 6_555 66.10(2) ?
Al1 Pd Al2 2_555 . 2_555 65.609(18) ?
Al1 Pd Al2 2_555 . 3_665 125.617(4) ?
Al1 Pd Al1 6_554 . 6_555 108.62(3) ?
Al1 Pd Al2 6_554 . 2_555 125.62(2) ?
Al1 Pd Al2 6_554 . 3_665 65.609(16) ?
Al1 Pd Al2 6_555 . 2_555 125.62(2) ?
Al1 Pd Al2 6_555 . 3_665 65.609(16) ?
Al2 Pd Al2 2_555 . 3_665 131.697(10) ?
Yb1 Al1 Yb1 1_545 . 4_665 111.64(3) ?
Yb1 Al1 Ca1 1_545 . 1_545 0.0(5) ?
Yb1 Al1 Ca1 1_545 . 4_665 111.64(3) ?
Yb1 Al1 Yb2 1_545 . . 116.784(7) ?
Yb1 Al1 Yb2 1_545 . 1_556 116.784(7) ?
Yb1 Al1 Ca2 1_545 . . 116.784(7) ?
Yb1 Al1 Ca2 1_545 . 1_556 116.784(7) ?
Yb1 Al1 Pd 1_545 . 3_555 64.920(9) ?
Yb1 Al1 Pd 1_545 . 3_556 64.920(9) ?
Yb1 Al1 Pd 1_545 . 5_555 121.928(17) ?
Yb1 Al1 Pd 1_545 . 5_556 121.928(17) ?
Yb1 Al1 Al1 1_545 . 4_655 55.818(14) ?
Yb1 Al1 Al1 1_545 . 5_555 64.182(17) ?
Yb1 Al1 Al1 1_545 . 6_555 175.82(3) ?
Yb1 Al1 Al2 1_545 . . 68.417(14) ?
Yb1 Al1 Al2 1_545 . 1_556 68.417(14) ?
Yb1 Al1 Ca1 4_665 . 1_545 111.64(3) ?
Yb1 Al1 Ca1 4_665 . 4_665 0.0(5) ?
Yb1 Al1 Yb2 4_665 . . 116.784(8) ?
Yb1 Al1 Yb2 4_665 . 1_556 116.784(8) ?
Yb1 Al1 Ca2 4_665 . . 116.784(8) ?
Yb1 Al1 Ca2 4_665 . 1_556 116.784(8) ?
Yb1 Al1 Pd 4_665 . 3_555 121.928(17) ?
Yb1 Al1 Pd 4_665 . 3_556 121.928(17) ?
Yb1 Al1 Pd 4_665 . 5_555 64.920(9) ?
Yb1 Al1 Pd 4_665 . 5_556 64.920(9) ?
Yb1 Al1 Al1 4_665 . 4_655 55.818(15) ?
Yb1 Al1 Al1 4_665 . 5_555 175.82(3) ?
Yb1 Al1 Al1 4_665 . 6_555 64.182(17) ?
Yb1 Al1 Al2 4_665 . . 68.417(15) ?
Yb1 Al1 Al2 4_665 . 1_556 68.417(15) ?
Ca1 Al1 Ca1 1_545 . 4_665 111.64(3) ?
Ca1 Al1 Yb2 1_545 . . 116.784(7) ?
Ca1 Al1 Yb2 1_545 . 1_556 116.784(7) ?
Ca1 Al1 Ca2 1_545 . . 116.784(7) ?
Ca1 Al1 Ca2 1_545 . 1_556 116.784(7) ?
Ca1 Al1 Pd 1_545 . 3_555 64.920(9) ?
Ca1 Al1 Pd 1_545 . 3_556 64.920(9) ?
Ca1 Al1 Pd 1_545 . 5_555 121.928(17) ?
Ca1 Al1 Pd 1_545 . 5_556 121.928(17) ?
Ca1 Al1 Al1 1_545 . 4_655 55.818(14) ?
Ca1 Al1 Al1 1_545 . 5_555 64.182(17) ?
Ca1 Al1 Al1 1_545 . 6_555 175.82(3) ?
Ca1 Al1 Al2 1_545 . . 68.417(14) ?
Ca1 Al1 Al2 1_545 . 1_556 68.417(14) ?
Ca1 Al1 Yb2 4_665 . . 116.784(8) ?
Ca1 Al1 Yb2 4_665 . 1_556 116.784(8) ?
Ca1 Al1 Ca2 4_665 . . 116.784(8) ?
Ca1 Al1 Ca2 4_665 . 1_556 116.784(8) ?
Ca1 Al1 Pd 4_665 . 3_555 121.928(17) ?
Ca1 Al1 Pd 4_665 . 3_556 121.928(17) ?
Ca1 Al1 Pd 4_665 . 5_555 64.920(9) ?
Ca1 Al1 Pd 4_665 . 5_556 64.920(9) ?
Ca1 Al1 Al1 4_665 . 4_655 55.818(15) ?
Ca1 Al1 Al1 4_665 . 5_555 175.82(3) ?
Ca1 Al1 Al1 4_665 . 6_555 64.182(17) ?
Ca1 Al1 Al2 4_665 . . 68.417(15) ?
Ca1 Al1 Al2 4_665 . 1_556 68.417(15) ?
Yb2 Al1 Yb2 . . 1_556 73.342(18) ?
Yb2 Al1 Ca2 . . . 0.0(5) ?
Yb2 Al1 Ca2 . . 1_556 73.342(18) ?
Yb2 Al1 Pd . . 3_555 55.944(13) ?
Yb2 Al1 Pd . . 3_556 114.21(3) ?
Yb2 Al1 Pd . . 5_555 55.944(14) ?
Yb2 Al1 Pd . . 5_556 114.21(3) ?
Yb2 Al1 Al1 . . 4_655 143.329(9) ?
Yb2 Al1 Al1 . . 5_555 66.36(2) ?
Yb2 Al1 Al1 . . 6_555 66.357(19) ?
Yb2 Al1 Al2 . . . 94.229(8) ?
Yb2 Al1 Al2 . . 1_556 167.57(2) ?
Yb2 Al1 Ca2 1_556 . . 73.342(18) ?
Yb2 Al1 Ca2 1_556 . 1_556 0.0(5) ?
Yb2 Al1 Pd 1_556 . 3_555 114.21(3) ?
Yb2 Al1 Pd 1_556 . 3_556 55.944(13) ?
Yb2 Al1 Pd 1_556 . 5_555 114.21(3) ?
Yb2 Al1 Pd 1_556 . 5_556 55.944(14) ?
Yb2 Al1 Al1 1_556 . 4_655 143.329(9) ?
Yb2 Al1 Al1 1_556 . 5_555 66.36(2) ?
Yb2 Al1 Al1 1_556 . 6_555 66.357(19) ?
Yb2 Al1 Al2 1_556 . . 167.57(2) ?
Yb2 Al1 Al2 1_556 . 1_556 94.229(8) ?
Ca2 Al1 Ca2 . . 1_556 73.342(18) ?
Ca2 Al1 Pd . . 3_555 55.944(13) ?
Ca2 Al1 Pd . . 3_556 114.21(3) ?
Ca2 Al1 Pd . . 5_555 55.944(14) ?
Ca2 Al1 Pd . . 5_556 114.21(3) ?
Ca2 Al1 Al1 . . 4_655 143.329(9) ?
Ca2 Al1 Al1 . . 5_555 66.36(2) ?
Ca2 Al1 Al1 . . 6_555 66.357(19) ?
Ca2 Al1 Al2 . . . 94.229(8) ?
Ca2 Al1 Al2 . . 1_556 167.57(2) ?
Ca2 Al1 Pd 1_556 . 3_555 114.21(3) ?
Ca2 Al1 Pd 1_556 . 3_556 55.944(13) ?
Ca2 Al1 Pd 1_556 . 5_555 114.21(3) ?
Ca2 Al1 Pd 1_556 . 5_556 55.944(14) ?
Ca2 Al1 Al1 1_556 . 4_655 143.329(9) ?
Ca2 Al1 Al1 1_556 . 5_555 66.36(2) ?
Ca2 Al1 Al1 1_556 . 6_555 66.357(19) ?
Ca2 Al1 Al2 1_556 . . 167.57(2) ?
Ca2 Al1 Al2 1_556 . 1_556 94.229(8) ?
Pd Al1 Pd 3_555 . 3_556 108.625(9) ?
Pd Al1 Pd 3_555 . 5_555 70.317(9) ?
Pd Al1 Pd 3_555 . 5_556 169.28(4) ?
Pd Al1 Al1 3_555 . 4_655 95.36(2) ?
Pd Al1 Al1 3_555 . 5_555 56.948(9) ?
Pd Al1 Al1 3_555 . 6_555 116.87(2) ?
Pd Al1 Al2 3_555 . . 56.445(10) ?
Pd Al1 Al2 3_555 . 1_556 132.46(3) ?
Pd Al1 Pd 3_556 . 5_555 169.28(4) ?
Pd Al1 Pd 3_556 . 5_556 70.317(9) ?
Pd Al1 Al1 3_556 . 4_655 95.36(2) ?
Pd Al1 Al1 3_556 . 5_555 56.948(9) ?
Pd Al1 Al1 3_556 . 6_555 116.87(2) ?
Pd Al1 Al2 3_556 . . 132.46(3) ?
Pd Al1 Al2 3_556 . 1_556 56.445(10) ?
Pd Al1 Pd 5_555 . 5_556 108.624(11) ?
Pd Al1 Al1 5_555 . 4_655 95.36(2) ?
Pd Al1 Al1 5_555 . 5_555 116.87(2) ?
Pd Al1 Al1 5_555 . 6_555 56.948(10) ?
Pd Al1 Al2 5_555 . . 56.445(10) ?
Pd Al1 Al2 5_555 . 1_556 132.46(3) ?
Pd Al1 Al1 5_556 . 4_655 95.36(2) ?
Pd Al1 Al1 5_556 . 5_555 116.87(2) ?
Pd Al1 Al1 5_556 . 6_555 56.948(10) ?
Pd Al1 Al2 5_556 . . 132.46(3) ?
Pd Al1 Al2 5_556 . 1_556 56.445(10) ?
Al1 Al1 Al1 4_655 . 5_555 120.00(2) ?
Al1 Al1 Al1 4_655 . 6_555 120.00(2) ?
Al1 Al1 Al2 4_655 . . 49.099(14) ?
Al1 Al1 Al2 4_655 . 1_556 49.099(14) ?
Al1 Al1 Al1 5_555 . 6_555 120.00(4) ?
Al1 Al1 Al2 5_555 . . 109.109(11) ?
Al1 Al1 Al2 5_555 . 1_556 109.109(11) ?
Al1 Al1 Al2 6_555 . . 109.109(11) ?
Al1 Al1 Al2 6_555 . 1_556 109.109(11) ?
Al2 Al1 Al2 . . 1_556 98.20(3) ?
Yb1 Al2 Yb1 1_544 . 1_545 76.193(7) ?
Yb1 Al2 Yb1 1_544 . 4_664 103.807(7) ?
Yb1 Al2 Yb1 1_544 . 4_665 180.0(5) ?
Yb1 Al2 Ca1 1_544 . 1_544 0.0(5) ?
Yb1 Al2 Ca1 1_544 . 1_545 76.193(7) ?
Yb1 Al2 Ca1 1_544 . 4_664 103.807(7) ?
Yb1 Al2 Ca1 1_544 . 4_665 180.0(5) ?
Yb1 Al2 Pd 1_544 . 2_655 62.556(6) ?
Yb1 Al2 Pd 1_544 . 3_555 62.555(5) ?
Yb1 Al2 Pd 1_544 . 5_555 117.444(6) ?
Yb1 Al2 Pd 1_544 . 6_655 117.445(5) ?
Yb1 Al2 Al1 1_544 . 1_554 62.202(7) ?
Yb1 Al2 Al1 1_544 . . 117.797(9) ?
Yb1 Al2 Al1 1_544 . 4_654 62.203(9) ?
Yb1 Al2 Al1 1_544 . 4_655 117.798(7) ?
Yb1 Al2 Yb1 1_545 . 4_664 180.0(5) ?
Yb1 Al2 Yb1 1_545 . 4_665 103.807(7) ?
Yb1 Al2 Ca1 1_545 . 1_544 76.193(7) ?
Yb1 Al2 Ca1 1_545 . 1_545 0.0(5) ?
Yb1 Al2 Ca1 1_545 . 4_664 180.0(5) ?
Yb1 Al2 Ca1 1_545 . 4_665 103.807(7) ?
Yb1 Al2 Pd 1_545 . 2_655 62.556(6) ?
Yb1 Al2 Pd 1_545 . 3_555 62.555(5) ?
Yb1 Al2 Pd 1_545 . 5_555 117.444(6) ?
Yb1 Al2 Pd 1_545 . 6_655 117.445(5) ?
Yb1 Al2 Al1 1_545 . 1_554 117.797(9) ?
Yb1 Al2 Al1 1_545 . . 62.202(7) ?
Yb1 Al2 Al1 1_545 . 4_654 117.798(7) ?
Yb1 Al2 Al1 1_545 . 4_655 62.203(9) ?
Yb1 Al2 Yb1 4_664 . 4_665 76.193(7) ?
Yb1 Al2 Ca1 4_664 . 1_544 103.807(7) ?
Yb1 Al2 Ca1 4_664 . 1_545 180.0(5) ?
Yb1 Al2 Ca1 4_664 . 4_664 0.0(5) ?
Yb1 Al2 Ca1 4_664 . 4_665 76.193(7) ?
Yb1 Al2 Pd 4_664 . 2_655 117.444(6) ?
Yb1 Al2 Pd 4_664 . 3_555 117.445(5) ?
Yb1 Al2 Pd 4_664 . 5_555 62.556(6) ?
Yb1 Al2 Pd 4_664 . 6_655 62.555(5) ?
Yb1 Al2 Al1 4_664 . 1_554 62.203(9) ?
Yb1 Al2 Al1 4_664 . . 117.798(7) ?
Yb1 Al2 Al1 4_664 . 4_654 62.202(7) ?
Yb1 Al2 Al1 4_664 . 4_655 117.797(9) ?
Yb1 Al2 Ca1 4_665 . 1_544 180.0(5) ?
Yb1 Al2 Ca1 4_665 . 1_545 103.807(7) ?
Yb1 Al2 Ca1 4_665 . 4_664 76.193(7) ?
Yb1 Al2 Ca1 4_665 . 4_665 0.0(5) ?
Yb1 Al2 Pd 4_665 . 2_655 117.444(6) ?
Yb1 Al2 Pd 4_665 . 3_555 117.445(5) ?
Yb1 Al2 Pd 4_665 . 5_555 62.556(6) ?
Yb1 Al2 Pd 4_665 . 6_655 62.555(5) ?
Yb1 Al2 Al1 4_665 . 1_554 117.798(7) ?
Yb1 Al2 Al1 4_665 . . 62.203(9) ?
Yb1 Al2 Al1 4_665 . 4_654 117.797(9) ?
Yb1 Al2 Al1 4_665 . 4_655 62.202(7) ?
Ca1 Al2 Ca1 1_544 . 1_545 76.193(7) ?
Ca1 Al2 Ca1 1_544 . 4_664 103.807(7) ?
Ca1 Al2 Ca1 1_544 . 4_665 180.0(5) ?
Ca1 Al2 Pd 1_544 . 2_655 62.556(6) ?
Ca1 Al2 Pd 1_544 . 3_555 62.555(5) ?
Ca1 Al2 Pd 1_544 . 5_555 117.444(6) ?
Ca1 Al2 Pd 1_544 . 6_655 117.445(5) ?
Ca1 Al2 Al1 1_544 . 1_554 62.202(7) ?
Ca1 Al2 Al1 1_544 . . 117.797(9) ?
Ca1 Al2 Al1 1_544 . 4_654 62.203(9) ?
Ca1 Al2 Al1 1_544 . 4_655 117.798(7) ?
Ca1 Al2 Ca1 1_545 . 4_664 180.0(5) ?
Ca1 Al2 Ca1 1_545 . 4_665 103.807(7) ?
Ca1 Al2 Pd 1_545 . 2_655 62.556(6) ?
Ca1 Al2 Pd 1_545 . 3_555 62.555(5) ?
Ca1 Al2 Pd 1_545 . 5_555 117.444(6) ?
Ca1 Al2 Pd 1_545 . 6_655 117.445(5) ?
Ca1 Al2 Al1 1_545 . 1_554 117.797(9) ?
Ca1 Al2 Al1 1_545 . . 62.202(7) ?
Ca1 Al2 Al1 1_545 . 4_654 117.798(7) ?
Ca1 Al2 Al1 1_545 . 4_655 62.203(9) ?
Ca1 Al2 Ca1 4_664 . 4_665 76.193(7) ?
Ca1 Al2 Pd 4_664 . 2_655 117.444(6) ?
Ca1 Al2 Pd 4_664 . 3_555 117.445(5) ?
Ca1 Al2 Pd 4_664 . 5_555 62.556(6) ?
Ca1 Al2 Pd 4_664 . 6_655 62.555(5) ?
Ca1 Al2 Al1 4_664 . 1_554 62.203(9) ?
Ca1 Al2 Al1 4_664 . . 117.798(7) ?
Ca1 Al2 Al1 4_664 . 4_654 62.202(7) ?
Ca1 Al2 Al1 4_664 . 4_655 117.797(9) ?
Ca1 Al2 Pd 4_665 . 2_655 117.444(6) ?
Ca1 Al2 Pd 4_665 . 3_555 117.445(5) ?
Ca1 Al2 Pd 4_665 . 5_555 62.556(6) ?
Ca1 Al2 Pd 4_665 . 6_655 62.555(5) ?
Ca1 Al2 Al1 4_665 . 1_554 117.798(7) ?
Ca1 Al2 Al1 4_665 . . 62.203(9) ?
Ca1 Al2 Al1 4_665 . 4_654 117.797(9) ?
Ca1 Al2 Al1 4_665 . 4_655 62.202(7) ?
Pd Al2 Pd 2_655 . 3_555 108.303(9) ?
Pd Al2 Pd 2_655 . 5_555 180.0(5) ?
Pd Al2 Pd 2_655 . 6_655 71.697(9) ?
Pd Al2 Al1 2_655 . 1_554 122.054(11) ?
Pd Al2 Al1 2_655 . . 122.054(11) ?
Pd Al2 Al1 2_655 . 4_654 57.946(11) ?
Pd Al2 Al1 2_655 . 4_655 57.946(11) ?
Pd Al2 Pd 3_555 . 5_555 71.697(9) ?
Pd Al2 Pd 3_555 . 6_655 180.0(5) ?
Pd Al2 Al1 3_555 . 1_554 57.946(11) ?
Pd Al2 Al1 3_555 . . 57.946(11) ?
Pd Al2 Al1 3_555 . 4_654 122.054(11) ?
Pd Al2 Al1 3_555 . 4_655 122.054(11) ?
Pd Al2 Pd 5_555 . 6_655 108.303(9) ?
Pd Al2 Al1 5_555 . 1_554 57.946(11) ?
Pd Al2 Al1 5_555 . . 57.946(11) ?
Pd Al2 Al1 5_555 . 4_654 122.054(11) ?
Pd Al2 Al1 5_555 . 4_655 122.054(11) ?
Pd Al2 Al1 6_655 . 1_554 122.054(11) ?
Pd Al2 Al1 6_655 . . 122.054(11) ?
Pd Al2 Al1 6_655 . 4_654 57.946(11) ?
Pd Al2 Al1 6_655 . 4_655 57.946(11) ?
Al1 Al2 Al1 1_554 . . 98.20(2) ?
Al1 Al2 Al1 1_554 . 4_654 81.80(2) ?
Al1 Al2 Al1 1_554 . 4_655 180.0(5) ?
Al1 Al2 Al1 . . 4_654 180.0(5) ?
Al1 Al2 Al1 . . 4_655 81.80(2) ?
Al1 Al2 Al1 4_654 . 4_655 98.20(2) ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion
_geom_torsion_publ_flag
? ? ? ? ? ? ? ? ? ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_D
_geom_hbond_site_symmetry_H
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_publ_flag
? ? ? ? ? ? ? ? ? ? ?


####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_I_CCDC5
_database_code_depnum_ccdc_archive 'CCDC 1892597'
loop_
_audit_author_name
_audit_author_address
'Oliver Janka'
;WWU Muenster
Germany
;
_audit_update_record             
;
2019-04-17 deposited with the CCDC.	2019-10-14 downloaded from the CCDC.
;
#=======================================================================

# 5. CHEMICAL DATA

_chemical_name_systematic        
; ?
;
_chemical_name_common            ?
_chemical_formula_moiety         ?
_chemical_formula_structural     ?
_chemical_formula_analytical     ?
_chemical_formula_iupac          ?
_chemical_formula_sum            'Al3 Ca0.314 Pd2 Yb0.686'
_chemical_formula_weight         425
_chemical_melting_point          ?
_chemical_compound_source        ?
_chemical_absolute_configuration .

#=======================================================================

# 6. CRYSTAL DATA

_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_H-M   'P 6/m m m'
_symmetry_space_group_name_Hall  '-P 6;-2'
_symmetry_Int_Tables_number      191

loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -y,x-y,z
3 -x+y,-x,z
4 -x,-y,z
5 y,-x+y,z
6 x-y,x,z
7 y,x,-z
8 x-y,-y,-z
9 -x,-x+y,-z
10 -y,-x,-z
11 -x+y,y,-z
12 x,x-y,-z
13 -x,-y,-z
14 y,-x+y,-z
15 x-y,x,-z
16 x,y,-z
17 -y,x-y,-z
18 -x+y,-x,-z
19 -y,-x,z
20 -x+y,y,z
21 x,x-y,z
22 y,x,z
23 x-y,-y,z
24 -x,-x+y,z

_cell_length_a                   9.3121(7)
_cell_length_b                   9.3121(7)
_cell_length_c                   4.2135(3)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_volume                     316.42(4)

loop_
_twin_individual_id
_twin_individual_mass_fraction_refined
_twin_individual_twin_matrix_11
_twin_individual_twin_matrix_12
_twin_individual_twin_matrix_13
_twin_individual_twin_matrix_21
_twin_individual_twin_matrix_22
_twin_individual_twin_matrix_23
_twin_individual_twin_matrix_31
_twin_individual_twin_matrix_32
_twin_individual_twin_matrix_33
? ? ? ? ? ? ? ? ? ? ?

_cell_formula_units_Z            3

_cell_measurement_reflns_used    5276
_cell_measurement_theta_min      4.38
_cell_measurement_theta_max      33.51
_cell_measurement_temperature    293
_cell_special_details            
; ?
;

_exptl_crystal_density_diffrn    6.69
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_F_000             556

_exptl_absorpt_coefficient_mu    24.3
_exptl_crystal_description       block
_exptl_crystal_size_max          0.030
_exptl_crystal_size_mid          0.025
_exptl_crystal_size_min          0.010
_exptl_crystal_size_rad          ?
_exptl_crystal_colour            silver
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   ?
_exptl_absorpt_correction_T_min  0.5755
_exptl_absorpt_correction_T_max  0.7826
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
? ? ? ?

#=======================================================================

# 7. EXPERIMENTAL DATA

_exptl_special_details           ?

_diffrn_ambient_temperature      293
_diffrn_source                   ?
_diffrn_source_power             ?
_diffrn_source_voltage           ?
_diffrn_source_current           ?
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_source         'X-ray tube'
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'IPDS Stoe'
_diffrn_detector                 ?
_diffrn_detector_area_resol_mean ?
_diffrn_measurement_method       '??integration method??'
_diffrn_measurement_specimen_support ?

_diffrn_reflns_number            4823
_diffrn_reflns_theta_min         2.53
_diffrn_reflns_theta_max         33.34
_diffrn_reflns_theta_full        33.34
_diffrn_measured_fraction_theta_max 0.99
_diffrn_measured_fraction_theta_full 0.99
_diffrn_reflns_av_R_equivalents  0.024
_diffrn_reflns_av_unetI/netI     0.0047
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_l_min       -6
_diffrn_reflns_limit_l_max       6
_diffrn_reflns_reduction_process ?

_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
loop_
_diffrn_standard_refln_index_h
_diffrn_standard_refln_index_k
_diffrn_standard_refln_index_l
? ? ?

_diffrn_radiation_probe          X-ray

#=======================================================================

# 8. REFINEMENT DATA

_refine_special_details          
; ?
;

_reflns_number_total             284
_reflns_number_gt                264
_reflns_threshold_expression     I>3σ(I)

_refine_ls_structure_factor_coef Fsqd
_refine_ls_R_factor_gt           0.0109
_refine_ls_wR_factor_gt          0.0258
_refine_ls_R_factor_all          0.0126
_refine_ls_wR_factor_ref         0.0266
_refine_ls_goodness_of_fit_ref   1.06
_refine_ls_goodness_of_fit_gt    1.07
_refine_ls_restrained_S_gt       ?
_refine_ls_restrained_S_all      ?
_refine_ls_number_reflns         284
_refine_ls_number_parameters     19
_refine_ls_number_restraints     0
_refine_ls_number_constraints    4
_refine_ls_weighting_scheme      sigma
_refine_ls_weighting_details     w=1/(σ²(I)+0.0004I²)
_refine_ls_hydrogen_treatment    ?
_refine_ls_shift/su_max          0.0007
_refine_ls_shift/su_mean         0.0001
_refine_diff_density_max         0.47
_refine_diff_density_min         -0.60
_refine_ls_extinction_method     
'B-C type 1 Gaussian isotropic (Becker & Coppens, 1974)'
_refine_ls_extinction_coef       190(20)
_refine_ls_abs_structure_details ?
_refine_ls_abs_structure_Flack   ?
_refine_ls_abs_structure_Rogers  ?

loop_
_atom_type_symbol
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Al 0.0645 0.0514 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Ca 0.2262 0.3064 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Pd -0.9988 1.0072 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Yb -0.3850 5.5486 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    ?
_computing_structure_refinement  ?
_computing_molecular_graphics    ?
_computing_publication_material  ?

loop_
_restr_distance_atom_site_label_1
_restr_distance_site_symmetry_1
_restr_distance_atom_site_label_2
_restr_distance_site_symmetry_2
_restr_distance_target
_restr_distance_target_weight_param
? ? ? ? ? ?

loop_
_restr_angle_atom_site_label_1
_restr_angle_site_symmetry_1
_restr_angle_atom_site_label_2
_restr_angle_site_symmetry_2
_restr_angle_atom_site_label_3
_restr_angle_site_symmetry_3
_restr_angle_target
_restr_angle_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_torsion_atom_site_label_1
_restr_torsion_site_symmetry_1
_restr_torsion_atom_site_label_2
_restr_torsion_site_symmetry_2
_restr_torsion_atom_site_label_3
_restr_torsion_site_symmetry_3
_restr_torsion_atom_site_label_4
_restr_torsion_site_symmetry_4
_restr_torsion_angle_target
_restr_torsion_weight_param
? ? ? ? ? ? ? ? ? ?

loop_
_restr_equal_distance_atom_site_label_1
_restr_equal_distance_site_symmetry_1
_restr_equal_distance_atom_site_label_2
_restr_equal_distance_site_symmetry_2
_restr_equal_distance_class_class_id
_restr_equal_distance_class_target_weight_param
? ? ? ? ? ?

loop_
_restr_equal_angle_atom_site_label_1
_restr_equal_angle_site_symmetry_1
_restr_equal_angle_atom_site_label_2
_restr_equal_angle_site_symmetry_2
_restr_equal_angle_atom_site_label_3
_restr_equal_angle_site_symmetry_3
_restr_equal_angle_class_class_id
_restr_equal_angle_class_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_equal_torsion_atom_site_label_1
_restr_equal_torsion_site_symmetry_1
_restr_equal_torsion_atom_site_label_2
_restr_equal_torsion_site_symmetry_2
_restr_equal_torsion_atom_site_label_3
_restr_equal_torsion_site_symmetry_3
_restr_equal_torsion_atom_site_label_4
_restr_equal_torsion_site_symmetry_4
_restr_equal_torsion_class_class_id
_restr_equal_torsion_class_target_weight_param
? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 9. ATOMIC COORDINATES AND DISPLACEMENT PARAMETERS

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_adp_type
_atom_site_U_iso_or_equiv
_atom_site_site_symmetry_multiplicity
_atom_site_occupancy
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Yb1 Yb 0.333333 0.666667 0.5 Uani 0.00833(8) 2 0.803(3) d . . .
Ca1 Ca 0.333333 0.666667 0.5 Uani 0.00833(8) 2 0.197(3) d . . .
Yb2 Yb 0 0 0 Uani 0.01063(17) 1 0.450(3) d . . .
Ca2 Ca 0 0 0 Uani 0.01063(17) 1 0.550(3) d . . .
Pd Pd 0.185300(14) 0.37060(3) 0 Uani 0.00702(9) 6 1 d . . .
Al1 Al 0.30403(11) 0 0.5 Uani 0.0083(3) 6 1 d . . .
Al2 Al 0.5 0 0 Uani 0.0082(4) 3 1 d . . .


loop_
_jana_atom_site_ADP_C_label
_jana_atom_site_ADP_C_type_symbol
_jana_atom_site_ADP_C_111
_jana_atom_site_ADP_C_112
_jana_atom_site_ADP_C_113
_jana_atom_site_ADP_C_122
_jana_atom_site_ADP_C_123
_jana_atom_site_ADP_C_133
_jana_atom_site_ADP_C_222
_jana_atom_site_ADP_C_223
_jana_atom_site_ADP_C_233
_jana_atom_site_ADP_C_333
? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_D_label
_jana_atom_site_ADP_D_type_symbol
_jana_atom_site_ADP_D_1111
_jana_atom_site_ADP_D_1112
_jana_atom_site_ADP_D_1113
_jana_atom_site_ADP_D_1122
_jana_atom_site_ADP_D_1123
_jana_atom_site_ADP_D_1133
_jana_atom_site_ADP_D_1222
_jana_atom_site_ADP_D_1223
_jana_atom_site_ADP_D_1233
_jana_atom_site_ADP_D_1333
_jana_atom_site_ADP_D_2222
_jana_atom_site_ADP_D_2223
_jana_atom_site_ADP_D_2233
_jana_atom_site_ADP_D_2333
_jana_atom_site_ADP_D_3333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_E_label
_jana_atom_site_ADP_E_type_symbol
_jana_atom_site_ADP_E_11111
_jana_atom_site_ADP_E_11112
_jana_atom_site_ADP_E_11113
_jana_atom_site_ADP_E_11122
_jana_atom_site_ADP_E_11123
_jana_atom_site_ADP_E_11133
_jana_atom_site_ADP_E_11222
_jana_atom_site_ADP_E_11223
_jana_atom_site_ADP_E_11233
_jana_atom_site_ADP_E_11333
_jana_atom_site_ADP_E_12222
_jana_atom_site_ADP_E_12223
_jana_atom_site_ADP_E_12233
_jana_atom_site_ADP_E_12333
_jana_atom_site_ADP_E_13333
_jana_atom_site_ADP_E_22222
_jana_atom_site_ADP_E_22223
_jana_atom_site_ADP_E_22233
_jana_atom_site_ADP_E_22333
_jana_atom_site_ADP_E_23333
_jana_atom_site_ADP_E_33333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_F_label
_jana_atom_site_ADP_F_type_symbol
_jana_atom_site_ADP_F_111111
_jana_atom_site_ADP_F_111112
_jana_atom_site_ADP_F_111113
_jana_atom_site_ADP_F_111122
_jana_atom_site_ADP_F_111123
_jana_atom_site_ADP_F_111133
_jana_atom_site_ADP_F_111222
_jana_atom_site_ADP_F_111223
_jana_atom_site_ADP_F_111233
_jana_atom_site_ADP_F_111333
_jana_atom_site_ADP_F_112222
_jana_atom_site_ADP_F_112223
_jana_atom_site_ADP_F_112233
_jana_atom_site_ADP_F_112333
_jana_atom_site_ADP_F_113333
_jana_atom_site_ADP_F_122222
_jana_atom_site_ADP_F_122223
_jana_atom_site_ADP_F_122233
_jana_atom_site_ADP_F_122333
_jana_atom_site_ADP_F_123333
_jana_atom_site_ADP_F_133333
_jana_atom_site_ADP_F_222222
_jana_atom_site_ADP_F_222223
_jana_atom_site_ADP_F_222233
_jana_atom_site_ADP_F_222333
_jana_atom_site_ADP_F_223333
_jana_atom_site_ADP_F_233333
_jana_atom_site_ADP_F_333333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 10. MOLECULAR GEOMETRY


loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Yb1 Pd . . 3.1842(5) ?
Yb1 Pd . 1_556 3.1842(5) ?
Yb1 Pd . 2_665 3.1842(5) ?
Yb1 Pd . 2_666 3.1842(5) ?
Yb1 Pd . 3_565 3.1842(3) ?
Yb1 Pd . 3_566 3.1842(3) ?
Yb1 Al1 . 1_565 3.2491(7) ?
Yb1 Al1 . 2_555 3.2491(9) ?
Yb1 Al1 . 3_665 3.2491(12) ?
Yb1 Al1 . 4_665 3.2491(9) ?
Yb1 Al1 . 5_565 3.2491(7) ?
Yb1 Al1 . 6_555 3.2491(12) ?
Yb1 Al2 . 1_565 3.4154(5) ?
Yb1 Al2 . 1_566 3.4154(5) ?
Yb1 Al2 . 2_555 3.4154(5) ?
Yb1 Al2 . 2_556 3.4154(5) ?
Yb1 Al2 . 3_665 3.4154(2) ?
Yb1 Al2 . 3_666 3.4154(2) ?
Ca1 Pd . . 3.1842(5) ?
Ca1 Pd . 1_556 3.1842(5) ?
Ca1 Pd . 2_665 3.1842(5) ?
Ca1 Pd . 2_666 3.1842(5) ?
Ca1 Pd . 3_565 3.1842(3) ?
Ca1 Pd . 3_566 3.1842(3) ?
Ca1 Al1 . 1_565 3.2491(7) ?
Ca1 Al1 . 2_555 3.2491(9) ?
Ca1 Al1 . 3_665 3.2491(12) ?
Ca1 Al1 . 4_665 3.2491(9) ?
Ca1 Al1 . 5_565 3.2491(7) ?
Ca1 Al1 . 6_555 3.2491(12) ?
Ca1 Al2 . 1_565 3.4154(5) ?
Ca1 Al2 . 1_566 3.4154(5) ?
Ca1 Al2 . 2_555 3.4154(5) ?
Ca1 Al2 . 2_556 3.4154(5) ?
Ca1 Al2 . 3_665 3.4154(2) ?
Ca1 Al2 . 3_666 3.4154(2) ?
Yb2 Pd . . 2.9887(7) ?
Yb2 Pd . 2_555 2.9887(7) ?
Yb2 Pd . 3_555 2.9887(4) ?
Yb2 Pd . 4_555 2.9887(7) ?
Yb2 Pd . 5_555 2.9887(7) ?
Yb2 Pd . 6_555 2.9887(4) ?
Yb2 Al1 . 1_554 3.5290(9) ?
Yb2 Al1 . . 3.5290(9) ?
Yb2 Al1 . 2_554 3.5290(9) ?
Yb2 Al1 . 2_555 3.5290(9) ?
Yb2 Al1 . 3_554 3.5290(8) ?
Yb2 Al1 . 3_555 3.5290(8) ?
Yb2 Al1 . 4_554 3.5290(9) ?
Yb2 Al1 . 4_555 3.5290(9) ?
Yb2 Al1 . 5_554 3.5290(9) ?
Yb2 Al1 . 5_555 3.5290(9) ?
Yb2 Al1 . 6_554 3.5290(8) ?
Yb2 Al1 . 6_555 3.5290(8) ?
Ca2 Pd . . 2.9887(7) ?
Ca2 Pd . 2_555 2.9887(7) ?
Ca2 Pd . 3_555 2.9887(4) ?
Ca2 Pd . 4_555 2.9887(7) ?
Ca2 Pd . 5_555 2.9887(7) ?
Ca2 Pd . 6_555 2.9887(4) ?
Ca2 Al1 . 1_554 3.5290(9) ?
Ca2 Al1 . . 3.5290(9) ?
Ca2 Al1 . 2_554 3.5290(9) ?
Ca2 Al1 . 2_555 3.5290(9) ?
Ca2 Al1 . 3_554 3.5290(8) ?
Ca2 Al1 . 3_555 3.5290(8) ?
Ca2 Al1 . 4_554 3.5290(9) ?
Ca2 Al1 . 4_555 3.5290(9) ?
Ca2 Al1 . 5_554 3.5290(9) ?
Ca2 Al1 . 5_555 3.5290(9) ?
Ca2 Al1 . 6_554 3.5290(8) ?
Ca2 Al1 . 6_555 3.5290(8) ?
Pd Pd . 5_555 2.9887(5) ?
Pd Pd . 6_555 2.9887(7) ?
Pd Al1 . 2_554 2.5943(3) ?
Pd Al1 . 2_555 2.5943(3) ?
Pd Al1 . 6_554 2.5943(8) ?
Pd Al1 . 6_555 2.5943(8) ?
Pd Al2 . 2_555 2.5512(3) ?
Pd Al2 . 3_665 2.5512(5) ?
Al1 Al1 . 4_655 3.6499(15) ?
Al1 Al1 . 5_555 2.8311(10) ?
Al1 Al1 . 6_555 2.8311(13) ?
Al1 Al2 . . 2.7873(7) ?
Al1 Al2 . 1_556 2.7873(7) ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
Pd Yb1 Pd . . 1_556 82.847(8) ?
Pd Yb1 Pd . . 2_665 80.989(8) ?
Pd Yb1 Pd . . 2_666 135.961(8) ?
Pd Yb1 Pd . . 3_565 80.989(7) ?
Pd Yb1 Pd . . 3_566 135.962(6) ?
Pd Yb1 Al1 . . 1_565 128.344(10) ?
Pd Yb1 Al1 . . 2_555 47.551(8) ?
Pd Yb1 Al1 . . 3_665 93.127(13) ?
Pd Yb1 Al1 . . 4_665 128.344(9) ?
Pd Yb1 Al1 . . 5_565 93.127(13) ?
Pd Yb1 Al1 . . 6_555 47.551(9) ?
Pd Yb1 Al2 . . 1_565 100.490(8) ?
Pd Yb1 Al2 . . 1_566 176.663(3) ?
Pd Yb1 Al2 . . 2_555 45.315(5) ?
Pd Yb1 Al2 . . 2_556 96.490(7) ?
Pd Yb1 Al2 . . 3_665 45.315(6) ?
Pd Yb1 Al2 . . 3_666 96.490(7) ?
Pd Yb1 Pd 1_556 . 2_665 135.961(8) ?
Pd Yb1 Pd 1_556 . 2_666 80.989(8) ?
Pd Yb1 Pd 1_556 . 3_565 135.962(6) ?
Pd Yb1 Pd 1_556 . 3_566 80.989(7) ?
Pd Yb1 Al1 1_556 . 1_565 128.344(10) ?
Pd Yb1 Al1 1_556 . 2_555 47.551(8) ?
Pd Yb1 Al1 1_556 . 3_665 93.127(13) ?
Pd Yb1 Al1 1_556 . 4_665 128.344(9) ?
Pd Yb1 Al1 1_556 . 5_565 93.127(13) ?
Pd Yb1 Al1 1_556 . 6_555 47.551(9) ?
Pd Yb1 Al2 1_556 . 1_565 176.663(3) ?
Pd Yb1 Al2 1_556 . 1_566 100.490(8) ?
Pd Yb1 Al2 1_556 . 2_555 96.490(7) ?
Pd Yb1 Al2 1_556 . 2_556 45.315(5) ?
Pd Yb1 Al2 1_556 . 3_665 96.490(7) ?
Pd Yb1 Al2 1_556 . 3_666 45.315(6) ?
Pd Yb1 Pd 2_665 . 2_666 82.847(8) ?
Pd Yb1 Pd 2_665 . 3_565 80.989(8) ?
Pd Yb1 Pd 2_665 . 3_566 135.962(7) ?
Pd Yb1 Al1 2_665 . 1_565 93.127(13) ?
Pd Yb1 Al1 2_665 . 2_555 128.344(10) ?
Pd Yb1 Al1 2_665 . 3_665 47.551(10) ?
Pd Yb1 Al1 2_665 . 4_665 47.551(8) ?
Pd Yb1 Al1 2_665 . 5_565 128.344(10) ?
Pd Yb1 Al1 2_665 . 6_555 93.127(14) ?
Pd Yb1 Al2 2_665 . 1_565 45.315(7) ?
Pd Yb1 Al2 2_665 . 1_566 96.490(8) ?
Pd Yb1 Al2 2_665 . 2_555 100.490(8) ?
Pd Yb1 Al2 2_665 . 2_556 176.663(3) ?
Pd Yb1 Al2 2_665 . 3_665 45.315(7) ?
Pd Yb1 Al2 2_665 . 3_666 96.490(7) ?
Pd Yb1 Pd 2_666 . 3_565 135.962(7) ?
Pd Yb1 Pd 2_666 . 3_566 80.989(8) ?
Pd Yb1 Al1 2_666 . 1_565 93.127(13) ?
Pd Yb1 Al1 2_666 . 2_555 128.344(10) ?
Pd Yb1 Al1 2_666 . 3_665 47.551(10) ?
Pd Yb1 Al1 2_666 . 4_665 47.551(8) ?
Pd Yb1 Al1 2_666 . 5_565 128.344(10) ?
Pd Yb1 Al1 2_666 . 6_555 93.127(14) ?
Pd Yb1 Al2 2_666 . 1_565 96.490(8) ?
Pd Yb1 Al2 2_666 . 1_566 45.315(7) ?
Pd Yb1 Al2 2_666 . 2_555 176.663(3) ?
Pd Yb1 Al2 2_666 . 2_556 100.490(8) ?
Pd Yb1 Al2 2_666 . 3_665 96.490(7) ?
Pd Yb1 Al2 2_666 . 3_666 45.315(7) ?
Pd Yb1 Pd 3_565 . 3_566 82.848(7) ?
Pd Yb1 Al1 3_565 . 1_565 47.551(7) ?
Pd Yb1 Al1 3_565 . 2_555 93.127(13) ?
Pd Yb1 Al1 3_565 . 3_665 128.344(10) ?
Pd Yb1 Al1 3_565 . 4_665 93.127(13) ?
Pd Yb1 Al1 3_565 . 5_565 47.551(8) ?
Pd Yb1 Al1 3_565 . 6_555 128.344(9) ?
Pd Yb1 Al2 3_565 . 1_565 45.315(6) ?
Pd Yb1 Al2 3_565 . 1_566 96.490(6) ?
Pd Yb1 Al2 3_565 . 2_555 45.315(5) ?
Pd Yb1 Al2 3_565 . 2_556 96.490(7) ?
Pd Yb1 Al2 3_565 . 3_665 100.490(6) ?
Pd Yb1 Al2 3_565 . 3_666 176.662(3) ?
Pd Yb1 Al1 3_566 . 1_565 47.551(7) ?
Pd Yb1 Al1 3_566 . 2_555 93.127(13) ?
Pd Yb1 Al1 3_566 . 3_665 128.344(10) ?
Pd Yb1 Al1 3_566 . 4_665 93.127(13) ?
Pd Yb1 Al1 3_566 . 5_565 47.551(8) ?
Pd Yb1 Al1 3_566 . 6_555 128.344(9) ?
Pd Yb1 Al2 3_566 . 1_565 96.490(6) ?
Pd Yb1 Al2 3_566 . 1_566 45.315(6) ?
Pd Yb1 Al2 3_566 . 2_555 96.490(7) ?
Pd Yb1 Al2 3_566 . 2_556 45.315(5) ?
Pd Yb1 Al2 3_566 . 3_665 176.662(3) ?
Pd Yb1 Al2 3_566 . 3_666 100.490(6) ?
Al1 Yb1 Al1 1_565 . 2_555 120.00(2) ?
Al1 Yb1 Al1 1_565 . 3_665 120.00(2) ?
Al1 Yb1 Al1 1_565 . 4_665 68.34(2) ?
Al1 Yb1 Al1 1_565 . 5_565 51.66(2) ?
Al1 Yb1 Al1 1_565 . 6_555 171.66(2) ?
Al1 Yb1 Al2 1_565 . 1_565 49.368(10) ?
Al1 Yb1 Al2 1_565 . 1_566 49.368(10) ?
Al1 Yb1 Al2 1_565 . 2_555 86.718(13) ?
Al1 Yb1 Al2 1_565 . 2_556 86.718(13) ?
Al1 Yb1 Al2 1_565 . 3_665 135.109(8) ?
Al1 Yb1 Al2 1_565 . 3_666 135.109(8) ?
Al1 Yb1 Al1 2_555 . 3_665 120.00(2) ?
Al1 Yb1 Al1 2_555 . 4_665 171.66(2) ?
Al1 Yb1 Al1 2_555 . 5_565 68.34(2) ?
Al1 Yb1 Al1 2_555 . 6_555 51.66(2) ?
Al1 Yb1 Al2 2_555 . 1_565 135.110(8) ?
Al1 Yb1 Al2 2_555 . 1_566 135.110(8) ?
Al1 Yb1 Al2 2_555 . 2_555 49.368(10) ?
Al1 Yb1 Al2 2_555 . 2_556 49.368(10) ?
Al1 Yb1 Al2 2_555 . 3_665 86.718(13) ?
Al1 Yb1 Al2 2_555 . 3_666 86.718(13) ?
Al1 Yb1 Al1 3_665 . 4_665 51.66(2) ?
Al1 Yb1 Al1 3_665 . 5_565 171.66(2) ?
Al1 Yb1 Al1 3_665 . 6_555 68.34(2) ?
Al1 Yb1 Al2 3_665 . 1_565 86.718(14) ?
Al1 Yb1 Al2 3_665 . 1_566 86.718(14) ?
Al1 Yb1 Al2 3_665 . 2_555 135.109(9) ?
Al1 Yb1 Al2 3_665 . 2_556 135.109(9) ?
Al1 Yb1 Al2 3_665 . 3_665 49.368(10) ?
Al1 Yb1 Al2 3_665 . 3_666 49.368(10) ?
Al1 Yb1 Al1 4_665 . 5_565 120.00(2) ?
Al1 Yb1 Al1 4_665 . 6_555 120.00(2) ?
Al1 Yb1 Al2 4_665 . 1_565 49.368(10) ?
Al1 Yb1 Al2 4_665 . 1_566 49.368(10) ?
Al1 Yb1 Al2 4_665 . 2_555 135.110(8) ?
Al1 Yb1 Al2 4_665 . 2_556 135.110(8) ?
Al1 Yb1 Al2 4_665 . 3_665 86.718(13) ?
Al1 Yb1 Al2 4_665 . 3_666 86.718(13) ?
Al1 Yb1 Al1 5_565 . 6_555 120.00(2) ?
Al1 Yb1 Al2 5_565 . 1_565 86.718(13) ?
Al1 Yb1 Al2 5_565 . 1_566 86.718(13) ?
Al1 Yb1 Al2 5_565 . 2_555 49.368(10) ?
Al1 Yb1 Al2 5_565 . 2_556 49.368(10) ?
Al1 Yb1 Al2 5_565 . 3_665 135.109(8) ?
Al1 Yb1 Al2 5_565 . 3_666 135.109(8) ?
Al1 Yb1 Al2 6_555 . 1_565 135.109(9) ?
Al1 Yb1 Al2 6_555 . 1_566 135.109(9) ?
Al1 Yb1 Al2 6_555 . 2_555 86.718(14) ?
Al1 Yb1 Al2 6_555 . 2_556 86.718(14) ?
Al1 Yb1 Al2 6_555 . 3_665 49.368(10) ?
Al1 Yb1 Al2 6_555 . 3_666 49.368(10) ?
Al2 Yb1 Al2 1_565 . 1_566 76.172(7) ?
Al2 Yb1 Al2 1_565 . 2_555 85.943(7) ?
Al2 Yb1 Al2 1_565 . 2_556 133.650(3) ?
Al2 Yb1 Al2 1_565 . 3_665 85.943(5) ?
Al2 Yb1 Al2 1_565 . 3_666 133.650(5) ?
Al2 Yb1 Al2 1_566 . 2_555 133.650(3) ?
Al2 Yb1 Al2 1_566 . 2_556 85.943(7) ?
Al2 Yb1 Al2 1_566 . 3_665 133.650(5) ?
Al2 Yb1 Al2 1_566 . 3_666 85.943(5) ?
Al2 Yb1 Al2 2_555 . 2_556 76.172(7) ?
Al2 Yb1 Al2 2_555 . 3_665 85.943(5) ?
Al2 Yb1 Al2 2_555 . 3_666 133.650(5) ?
Al2 Yb1 Al2 2_556 . 3_665 133.650(5) ?
Al2 Yb1 Al2 2_556 . 3_666 85.943(5) ?
Al2 Yb1 Al2 3_665 . 3_666 76.172(4) ?
Pd Ca1 Pd . . 1_556 82.847(8) ?
Pd Ca1 Pd . . 2_665 80.989(8) ?
Pd Ca1 Pd . . 2_666 135.961(8) ?
Pd Ca1 Pd . . 3_565 80.989(7) ?
Pd Ca1 Pd . . 3_566 135.962(6) ?
Pd Ca1 Al1 . . 1_565 128.344(10) ?
Pd Ca1 Al1 . . 2_555 47.551(8) ?
Pd Ca1 Al1 . . 3_665 93.127(13) ?
Pd Ca1 Al1 . . 4_665 128.344(9) ?
Pd Ca1 Al1 . . 5_565 93.127(13) ?
Pd Ca1 Al1 . . 6_555 47.551(9) ?
Pd Ca1 Al2 . . 1_565 100.490(8) ?
Pd Ca1 Al2 . . 1_566 176.663(3) ?
Pd Ca1 Al2 . . 2_555 45.315(5) ?
Pd Ca1 Al2 . . 2_556 96.490(7) ?
Pd Ca1 Al2 . . 3_665 45.315(6) ?
Pd Ca1 Al2 . . 3_666 96.490(7) ?
Pd Ca1 Pd 1_556 . 2_665 135.961(8) ?
Pd Ca1 Pd 1_556 . 2_666 80.989(8) ?
Pd Ca1 Pd 1_556 . 3_565 135.962(6) ?
Pd Ca1 Pd 1_556 . 3_566 80.989(7) ?
Pd Ca1 Al1 1_556 . 1_565 128.344(10) ?
Pd Ca1 Al1 1_556 . 2_555 47.551(8) ?
Pd Ca1 Al1 1_556 . 3_665 93.127(13) ?
Pd Ca1 Al1 1_556 . 4_665 128.344(9) ?
Pd Ca1 Al1 1_556 . 5_565 93.127(13) ?
Pd Ca1 Al1 1_556 . 6_555 47.551(9) ?
Pd Ca1 Al2 1_556 . 1_565 176.663(3) ?
Pd Ca1 Al2 1_556 . 1_566 100.490(8) ?
Pd Ca1 Al2 1_556 . 2_555 96.490(7) ?
Pd Ca1 Al2 1_556 . 2_556 45.315(5) ?
Pd Ca1 Al2 1_556 . 3_665 96.490(7) ?
Pd Ca1 Al2 1_556 . 3_666 45.315(6) ?
Pd Ca1 Pd 2_665 . 2_666 82.847(8) ?
Pd Ca1 Pd 2_665 . 3_565 80.989(8) ?
Pd Ca1 Pd 2_665 . 3_566 135.962(7) ?
Pd Ca1 Al1 2_665 . 1_565 93.127(13) ?
Pd Ca1 Al1 2_665 . 2_555 128.344(10) ?
Pd Ca1 Al1 2_665 . 3_665 47.551(10) ?
Pd Ca1 Al1 2_665 . 4_665 47.551(8) ?
Pd Ca1 Al1 2_665 . 5_565 128.344(10) ?
Pd Ca1 Al1 2_665 . 6_555 93.127(14) ?
Pd Ca1 Al2 2_665 . 1_565 45.315(7) ?
Pd Ca1 Al2 2_665 . 1_566 96.490(8) ?
Pd Ca1 Al2 2_665 . 2_555 100.490(8) ?
Pd Ca1 Al2 2_665 . 2_556 176.663(3) ?
Pd Ca1 Al2 2_665 . 3_665 45.315(7) ?
Pd Ca1 Al2 2_665 . 3_666 96.490(7) ?
Pd Ca1 Pd 2_666 . 3_565 135.962(7) ?
Pd Ca1 Pd 2_666 . 3_566 80.989(8) ?
Pd Ca1 Al1 2_666 . 1_565 93.127(13) ?
Pd Ca1 Al1 2_666 . 2_555 128.344(10) ?
Pd Ca1 Al1 2_666 . 3_665 47.551(10) ?
Pd Ca1 Al1 2_666 . 4_665 47.551(8) ?
Pd Ca1 Al1 2_666 . 5_565 128.344(10) ?
Pd Ca1 Al1 2_666 . 6_555 93.127(14) ?
Pd Ca1 Al2 2_666 . 1_565 96.490(8) ?
Pd Ca1 Al2 2_666 . 1_566 45.315(7) ?
Pd Ca1 Al2 2_666 . 2_555 176.663(3) ?
Pd Ca1 Al2 2_666 . 2_556 100.490(8) ?
Pd Ca1 Al2 2_666 . 3_665 96.490(7) ?
Pd Ca1 Al2 2_666 . 3_666 45.315(7) ?
Pd Ca1 Pd 3_565 . 3_566 82.848(7) ?
Pd Ca1 Al1 3_565 . 1_565 47.551(7) ?
Pd Ca1 Al1 3_565 . 2_555 93.127(13) ?
Pd Ca1 Al1 3_565 . 3_665 128.344(10) ?
Pd Ca1 Al1 3_565 . 4_665 93.127(13) ?
Pd Ca1 Al1 3_565 . 5_565 47.551(8) ?
Pd Ca1 Al1 3_565 . 6_555 128.344(9) ?
Pd Ca1 Al2 3_565 . 1_565 45.315(6) ?
Pd Ca1 Al2 3_565 . 1_566 96.490(6) ?
Pd Ca1 Al2 3_565 . 2_555 45.315(5) ?
Pd Ca1 Al2 3_565 . 2_556 96.490(7) ?
Pd Ca1 Al2 3_565 . 3_665 100.490(6) ?
Pd Ca1 Al2 3_565 . 3_666 176.662(3) ?
Pd Ca1 Al1 3_566 . 1_565 47.551(7) ?
Pd Ca1 Al1 3_566 . 2_555 93.127(13) ?
Pd Ca1 Al1 3_566 . 3_665 128.344(10) ?
Pd Ca1 Al1 3_566 . 4_665 93.127(13) ?
Pd Ca1 Al1 3_566 . 5_565 47.551(8) ?
Pd Ca1 Al1 3_566 . 6_555 128.344(9) ?
Pd Ca1 Al2 3_566 . 1_565 96.490(6) ?
Pd Ca1 Al2 3_566 . 1_566 45.315(6) ?
Pd Ca1 Al2 3_566 . 2_555 96.490(7) ?
Pd Ca1 Al2 3_566 . 2_556 45.315(5) ?
Pd Ca1 Al2 3_566 . 3_665 176.662(3) ?
Pd Ca1 Al2 3_566 . 3_666 100.490(6) ?
Al1 Ca1 Al1 1_565 . 2_555 120.00(2) ?
Al1 Ca1 Al1 1_565 . 3_665 120.00(2) ?
Al1 Ca1 Al1 1_565 . 4_665 68.34(2) ?
Al1 Ca1 Al1 1_565 . 5_565 51.66(2) ?
Al1 Ca1 Al1 1_565 . 6_555 171.66(2) ?
Al1 Ca1 Al2 1_565 . 1_565 49.368(10) ?
Al1 Ca1 Al2 1_565 . 1_566 49.368(10) ?
Al1 Ca1 Al2 1_565 . 2_555 86.718(13) ?
Al1 Ca1 Al2 1_565 . 2_556 86.718(13) ?
Al1 Ca1 Al2 1_565 . 3_665 135.109(8) ?
Al1 Ca1 Al2 1_565 . 3_666 135.109(8) ?
Al1 Ca1 Al1 2_555 . 3_665 120.00(2) ?
Al1 Ca1 Al1 2_555 . 4_665 171.66(2) ?
Al1 Ca1 Al1 2_555 . 5_565 68.34(2) ?
Al1 Ca1 Al1 2_555 . 6_555 51.66(2) ?
Al1 Ca1 Al2 2_555 . 1_565 135.110(8) ?
Al1 Ca1 Al2 2_555 . 1_566 135.110(8) ?
Al1 Ca1 Al2 2_555 . 2_555 49.368(10) ?
Al1 Ca1 Al2 2_555 . 2_556 49.368(10) ?
Al1 Ca1 Al2 2_555 . 3_665 86.718(13) ?
Al1 Ca1 Al2 2_555 . 3_666 86.718(13) ?
Al1 Ca1 Al1 3_665 . 4_665 51.66(2) ?
Al1 Ca1 Al1 3_665 . 5_565 171.66(2) ?
Al1 Ca1 Al1 3_665 . 6_555 68.34(2) ?
Al1 Ca1 Al2 3_665 . 1_565 86.718(14) ?
Al1 Ca1 Al2 3_665 . 1_566 86.718(14) ?
Al1 Ca1 Al2 3_665 . 2_555 135.109(9) ?
Al1 Ca1 Al2 3_665 . 2_556 135.109(9) ?
Al1 Ca1 Al2 3_665 . 3_665 49.368(10) ?
Al1 Ca1 Al2 3_665 . 3_666 49.368(10) ?
Al1 Ca1 Al1 4_665 . 5_565 120.00(2) ?
Al1 Ca1 Al1 4_665 . 6_555 120.00(2) ?
Al1 Ca1 Al2 4_665 . 1_565 49.368(10) ?
Al1 Ca1 Al2 4_665 . 1_566 49.368(10) ?
Al1 Ca1 Al2 4_665 . 2_555 135.110(8) ?
Al1 Ca1 Al2 4_665 . 2_556 135.110(8) ?
Al1 Ca1 Al2 4_665 . 3_665 86.718(13) ?
Al1 Ca1 Al2 4_665 . 3_666 86.718(13) ?
Al1 Ca1 Al1 5_565 . 6_555 120.00(2) ?
Al1 Ca1 Al2 5_565 . 1_565 86.718(13) ?
Al1 Ca1 Al2 5_565 . 1_566 86.718(13) ?
Al1 Ca1 Al2 5_565 . 2_555 49.368(10) ?
Al1 Ca1 Al2 5_565 . 2_556 49.368(10) ?
Al1 Ca1 Al2 5_565 . 3_665 135.109(8) ?
Al1 Ca1 Al2 5_565 . 3_666 135.109(8) ?
Al1 Ca1 Al2 6_555 . 1_565 135.109(9) ?
Al1 Ca1 Al2 6_555 . 1_566 135.109(9) ?
Al1 Ca1 Al2 6_555 . 2_555 86.718(14) ?
Al1 Ca1 Al2 6_555 . 2_556 86.718(14) ?
Al1 Ca1 Al2 6_555 . 3_665 49.368(10) ?
Al1 Ca1 Al2 6_555 . 3_666 49.368(10) ?
Al2 Ca1 Al2 1_565 . 1_566 76.172(7) ?
Al2 Ca1 Al2 1_565 . 2_555 85.943(7) ?
Al2 Ca1 Al2 1_565 . 2_556 133.650(3) ?
Al2 Ca1 Al2 1_565 . 3_665 85.943(5) ?
Al2 Ca1 Al2 1_565 . 3_666 133.650(5) ?
Al2 Ca1 Al2 1_566 . 2_555 133.650(3) ?
Al2 Ca1 Al2 1_566 . 2_556 85.943(7) ?
Al2 Ca1 Al2 1_566 . 3_665 133.650(5) ?
Al2 Ca1 Al2 1_566 . 3_666 85.943(5) ?
Al2 Ca1 Al2 2_555 . 2_556 76.172(7) ?
Al2 Ca1 Al2 2_555 . 3_665 85.943(5) ?
Al2 Ca1 Al2 2_555 . 3_666 133.650(5) ?
Al2 Ca1 Al2 2_556 . 3_665 133.650(5) ?
Al2 Ca1 Al2 2_556 . 3_666 85.943(5) ?
Al2 Ca1 Al2 3_665 . 3_666 76.172(4) ?
Pd Yb2 Pd . . 2_555 120.000(9) ?
Pd Yb2 Pd . . 3_555 120.000(8) ?
Pd Yb2 Pd . . 4_555 180.0(5) ?
Pd Yb2 Pd . . 5_555 60.000(9) ?
Pd Yb2 Pd . . 6_555 60.000(8) ?
Pd Yb2 Al1 . . 1_554 90.000(6) ?
Pd Yb2 Al1 . . . 90.000(6) ?
Pd Yb2 Al1 . . 2_554 45.991(8) ?
Pd Yb2 Al1 . . 2_555 45.991(8) ?
Pd Yb2 Al1 . . 3_554 134.009(16) ?
Pd Yb2 Al1 . . 3_555 134.009(16) ?
Pd Yb2 Al1 . . 4_554 90.000(6) ?
Pd Yb2 Al1 . . 4_555 90.000(6) ?
Pd Yb2 Al1 . . 5_554 134.009(8) ?
Pd Yb2 Al1 . . 5_555 134.009(8) ?
Pd Yb2 Al1 . . 6_554 45.991(16) ?
Pd Yb2 Al1 . . 6_555 45.991(16) ?
Pd Yb2 Pd 2_555 . 3_555 120.000(9) ?
Pd Yb2 Pd 2_555 . 4_555 60.000(9) ?
Pd Yb2 Pd 2_555 . 5_555 180.0(5) ?
Pd Yb2 Pd 2_555 . 6_555 60.000(9) ?
Pd Yb2 Al1 2_555 . 1_554 134.009(9) ?
Pd Yb2 Al1 2_555 . . 134.009(9) ?
Pd Yb2 Al1 2_555 . 2_554 90.000(7) ?
Pd Yb2 Al1 2_555 . 2_555 90.000(7) ?
Pd Yb2 Al1 2_555 . 3_554 45.991(16) ?
Pd Yb2 Al1 2_555 . 3_555 45.991(16) ?
Pd Yb2 Al1 2_555 . 4_554 45.991(9) ?
Pd Yb2 Al1 2_555 . 4_555 45.991(9) ?
Pd Yb2 Al1 2_555 . 5_554 90.000(7) ?
Pd Yb2 Al1 2_555 . 5_555 90.000(7) ?
Pd Yb2 Al1 2_555 . 6_554 134.009(16) ?
Pd Yb2 Al1 2_555 . 6_555 134.009(16) ?
Pd Yb2 Pd 3_555 . 4_555 60.000(8) ?
Pd Yb2 Pd 3_555 . 5_555 60.000(9) ?
Pd Yb2 Pd 3_555 . 6_555 180.0(5) ?
Pd Yb2 Al1 3_555 . 1_554 45.991(8) ?
Pd Yb2 Al1 3_555 . . 45.991(8) ?
Pd Yb2 Al1 3_555 . 2_554 134.009(8) ?
Pd Yb2 Al1 3_555 . 2_555 134.009(8) ?
Pd Yb2 Al1 3_555 . 3_554 90.00(2) ?
Pd Yb2 Al1 3_555 . 3_555 90.00(2) ?
Pd Yb2 Al1 3_555 . 4_554 134.009(8) ?
Pd Yb2 Al1 3_555 . 4_555 134.009(8) ?
Pd Yb2 Al1 3_555 . 5_554 45.991(8) ?
Pd Yb2 Al1 3_555 . 5_555 45.991(8) ?
Pd Yb2 Al1 3_555 . 6_554 90.00(2) ?
Pd Yb2 Al1 3_555 . 6_555 90.00(2) ?
Pd Yb2 Pd 4_555 . 5_555 120.000(9) ?
Pd Yb2 Pd 4_555 . 6_555 120.000(8) ?
Pd Yb2 Al1 4_555 . 1_554 90.000(6) ?
Pd Yb2 Al1 4_555 . . 90.000(6) ?
Pd Yb2 Al1 4_555 . 2_554 134.009(8) ?
Pd Yb2 Al1 4_555 . 2_555 134.009(8) ?
Pd Yb2 Al1 4_555 . 3_554 45.991(16) ?
Pd Yb2 Al1 4_555 . 3_555 45.991(16) ?
Pd Yb2 Al1 4_555 . 4_554 90.000(6) ?
Pd Yb2 Al1 4_555 . 4_555 90.000(6) ?
Pd Yb2 Al1 4_555 . 5_554 45.991(8) ?
Pd Yb2 Al1 4_555 . 5_555 45.991(8) ?
Pd Yb2 Al1 4_555 . 6_554 134.009(16) ?
Pd Yb2 Al1 4_555 . 6_555 134.009(16) ?
Pd Yb2 Pd 5_555 . 6_555 120.000(9) ?
Pd Yb2 Al1 5_555 . 1_554 45.991(9) ?
Pd Yb2 Al1 5_555 . . 45.991(9) ?
Pd Yb2 Al1 5_555 . 2_554 90.000(7) ?
Pd Yb2 Al1 5_555 . 2_555 90.000(7) ?
Pd Yb2 Al1 5_555 . 3_554 134.009(16) ?
Pd Yb2 Al1 5_555 . 3_555 134.009(16) ?
Pd Yb2 Al1 5_555 . 4_554 134.009(9) ?
Pd Yb2 Al1 5_555 . 4_555 134.009(9) ?
Pd Yb2 Al1 5_555 . 5_554 90.000(7) ?
Pd Yb2 Al1 5_555 . 5_555 90.000(7) ?
Pd Yb2 Al1 5_555 . 6_554 45.991(16) ?
Pd Yb2 Al1 5_555 . 6_555 45.991(16) ?
Pd Yb2 Al1 6_555 . 1_554 134.009(8) ?
Pd Yb2 Al1 6_555 . . 134.009(8) ?
Pd Yb2 Al1 6_555 . 2_554 45.991(8) ?
Pd Yb2 Al1 6_555 . 2_555 45.991(8) ?
Pd Yb2 Al1 6_555 . 3_554 90.00(2) ?
Pd Yb2 Al1 6_555 . 3_555 90.00(2) ?
Pd Yb2 Al1 6_555 . 4_554 45.991(8) ?
Pd Yb2 Al1 6_555 . 4_555 45.991(8) ?
Pd Yb2 Al1 6_555 . 5_554 134.009(8) ?
Pd Yb2 Al1 6_555 . 5_555 134.009(8) ?
Pd Yb2 Al1 6_555 . 6_554 90.00(2) ?
Pd Yb2 Al1 6_555 . 6_555 90.00(2) ?
Al1 Yb2 Al1 1_554 . . 73.309(15) ?
Al1 Yb2 Al1 1_554 . 2_554 88.018(11) ?
Al1 Yb2 Al1 1_554 . 2_555 132.703(7) ?
Al1 Yb2 Al1 1_554 . 3_554 88.018(18) ?
Al1 Yb2 Al1 1_554 . 3_555 132.70(2) ?
Al1 Yb2 Al1 1_554 . 4_554 106.691(15) ?
Al1 Yb2 Al1 1_554 . 4_555 180.0(5) ?
Al1 Yb2 Al1 1_554 . 5_554 47.297(7) ?
Al1 Yb2 Al1 1_554 . 5_555 91.982(11) ?
Al1 Yb2 Al1 1_554 . 6_554 47.30(2) ?
Al1 Yb2 Al1 1_554 . 6_555 91.982(18) ?
Al1 Yb2 Al1 . . 2_554 132.703(7) ?
Al1 Yb2 Al1 . . 2_555 88.018(11) ?
Al1 Yb2 Al1 . . 3_554 132.70(2) ?
Al1 Yb2 Al1 . . 3_555 88.018(18) ?
Al1 Yb2 Al1 . . 4_554 180.0(5) ?
Al1 Yb2 Al1 . . 4_555 106.691(15) ?
Al1 Yb2 Al1 . . 5_554 91.982(11) ?
Al1 Yb2 Al1 . . 5_555 47.297(7) ?
Al1 Yb2 Al1 . . 6_554 91.982(18) ?
Al1 Yb2 Al1 . . 6_555 47.30(2) ?
Al1 Yb2 Al1 2_554 . 2_555 73.309(15) ?
Al1 Yb2 Al1 2_554 . 3_554 88.018(18) ?
Al1 Yb2 Al1 2_554 . 3_555 132.70(2) ?
Al1 Yb2 Al1 2_554 . 4_554 47.297(7) ?
Al1 Yb2 Al1 2_554 . 4_555 91.982(11) ?
Al1 Yb2 Al1 2_554 . 5_554 106.691(15) ?
Al1 Yb2 Al1 2_554 . 5_555 180.0(5) ?
Al1 Yb2 Al1 2_554 . 6_554 47.30(2) ?
Al1 Yb2 Al1 2_554 . 6_555 91.982(18) ?
Al1 Yb2 Al1 2_555 . 3_554 132.70(2) ?
Al1 Yb2 Al1 2_555 . 3_555 88.018(18) ?
Al1 Yb2 Al1 2_555 . 4_554 91.982(11) ?
Al1 Yb2 Al1 2_555 . 4_555 47.297(7) ?
Al1 Yb2 Al1 2_555 . 5_554 180.0(5) ?
Al1 Yb2 Al1 2_555 . 5_555 106.691(15) ?
Al1 Yb2 Al1 2_555 . 6_554 91.982(18) ?
Al1 Yb2 Al1 2_555 . 6_555 47.30(2) ?
Al1 Yb2 Al1 3_554 . 3_555 73.309(12) ?
Al1 Yb2 Al1 3_554 . 4_554 47.30(2) ?
Al1 Yb2 Al1 3_554 . 4_555 91.982(18) ?
Al1 Yb2 Al1 3_554 . 5_554 47.30(2) ?
Al1 Yb2 Al1 3_554 . 5_555 91.982(18) ?
Al1 Yb2 Al1 3_554 . 6_554 106.691(12) ?
Al1 Yb2 Al1 3_554 . 6_555 180.0(5) ?
Al1 Yb2 Al1 3_555 . 4_554 91.982(18) ?
Al1 Yb2 Al1 3_555 . 4_555 47.30(2) ?
Al1 Yb2 Al1 3_555 . 5_554 91.982(18) ?
Al1 Yb2 Al1 3_555 . 5_555 47.30(2) ?
Al1 Yb2 Al1 3_555 . 6_554 180.0(5) ?
Al1 Yb2 Al1 3_555 . 6_555 106.691(12) ?
Al1 Yb2 Al1 4_554 . 4_555 73.309(15) ?
Al1 Yb2 Al1 4_554 . 5_554 88.018(11) ?
Al1 Yb2 Al1 4_554 . 5_555 132.703(7) ?
Al1 Yb2 Al1 4_554 . 6_554 88.018(18) ?
Al1 Yb2 Al1 4_554 . 6_555 132.70(2) ?
Al1 Yb2 Al1 4_555 . 5_554 132.703(7) ?
Al1 Yb2 Al1 4_555 . 5_555 88.018(11) ?
Al1 Yb2 Al1 4_555 . 6_554 132.70(2) ?
Al1 Yb2 Al1 4_555 . 6_555 88.018(18) ?
Al1 Yb2 Al1 5_554 . 5_555 73.309(15) ?
Al1 Yb2 Al1 5_554 . 6_554 88.018(18) ?
Al1 Yb2 Al1 5_554 . 6_555 132.70(2) ?
Al1 Yb2 Al1 5_555 . 6_554 132.70(2) ?
Al1 Yb2 Al1 5_555 . 6_555 88.018(18) ?
Al1 Yb2 Al1 6_554 . 6_555 73.309(12) ?
Pd Ca2 Pd . . 2_555 120.000(9) ?
Pd Ca2 Pd . . 3_555 120.000(8) ?
Pd Ca2 Pd . . 4_555 180.0(5) ?
Pd Ca2 Pd . . 5_555 60.000(9) ?
Pd Ca2 Pd . . 6_555 60.000(8) ?
Pd Ca2 Al1 . . 1_554 90.000(6) ?
Pd Ca2 Al1 . . . 90.000(6) ?
Pd Ca2 Al1 . . 2_554 45.991(8) ?
Pd Ca2 Al1 . . 2_555 45.991(8) ?
Pd Ca2 Al1 . . 3_554 134.009(16) ?
Pd Ca2 Al1 . . 3_555 134.009(16) ?
Pd Ca2 Al1 . . 4_554 90.000(6) ?
Pd Ca2 Al1 . . 4_555 90.000(6) ?
Pd Ca2 Al1 . . 5_554 134.009(8) ?
Pd Ca2 Al1 . . 5_555 134.009(8) ?
Pd Ca2 Al1 . . 6_554 45.991(16) ?
Pd Ca2 Al1 . . 6_555 45.991(16) ?
Pd Ca2 Pd 2_555 . 3_555 120.000(9) ?
Pd Ca2 Pd 2_555 . 4_555 60.000(9) ?
Pd Ca2 Pd 2_555 . 5_555 180.0(5) ?
Pd Ca2 Pd 2_555 . 6_555 60.000(9) ?
Pd Ca2 Al1 2_555 . 1_554 134.009(9) ?
Pd Ca2 Al1 2_555 . . 134.009(9) ?
Pd Ca2 Al1 2_555 . 2_554 90.000(7) ?
Pd Ca2 Al1 2_555 . 2_555 90.000(7) ?
Pd Ca2 Al1 2_555 . 3_554 45.991(16) ?
Pd Ca2 Al1 2_555 . 3_555 45.991(16) ?
Pd Ca2 Al1 2_555 . 4_554 45.991(9) ?
Pd Ca2 Al1 2_555 . 4_555 45.991(9) ?
Pd Ca2 Al1 2_555 . 5_554 90.000(7) ?
Pd Ca2 Al1 2_555 . 5_555 90.000(7) ?
Pd Ca2 Al1 2_555 . 6_554 134.009(16) ?
Pd Ca2 Al1 2_555 . 6_555 134.009(16) ?
Pd Ca2 Pd 3_555 . 4_555 60.000(8) ?
Pd Ca2 Pd 3_555 . 5_555 60.000(9) ?
Pd Ca2 Pd 3_555 . 6_555 180.0(5) ?
Pd Ca2 Al1 3_555 . 1_554 45.991(8) ?
Pd Ca2 Al1 3_555 . . 45.991(8) ?
Pd Ca2 Al1 3_555 . 2_554 134.009(8) ?
Pd Ca2 Al1 3_555 . 2_555 134.009(8) ?
Pd Ca2 Al1 3_555 . 3_554 90.00(2) ?
Pd Ca2 Al1 3_555 . 3_555 90.00(2) ?
Pd Ca2 Al1 3_555 . 4_554 134.009(8) ?
Pd Ca2 Al1 3_555 . 4_555 134.009(8) ?
Pd Ca2 Al1 3_555 . 5_554 45.991(8) ?
Pd Ca2 Al1 3_555 . 5_555 45.991(8) ?
Pd Ca2 Al1 3_555 . 6_554 90.00(2) ?
Pd Ca2 Al1 3_555 . 6_555 90.00(2) ?
Pd Ca2 Pd 4_555 . 5_555 120.000(9) ?
Pd Ca2 Pd 4_555 . 6_555 120.000(8) ?
Pd Ca2 Al1 4_555 . 1_554 90.000(6) ?
Pd Ca2 Al1 4_555 . . 90.000(6) ?
Pd Ca2 Al1 4_555 . 2_554 134.009(8) ?
Pd Ca2 Al1 4_555 . 2_555 134.009(8) ?
Pd Ca2 Al1 4_555 . 3_554 45.991(16) ?
Pd Ca2 Al1 4_555 . 3_555 45.991(16) ?
Pd Ca2 Al1 4_555 . 4_554 90.000(6) ?
Pd Ca2 Al1 4_555 . 4_555 90.000(6) ?
Pd Ca2 Al1 4_555 . 5_554 45.991(8) ?
Pd Ca2 Al1 4_555 . 5_555 45.991(8) ?
Pd Ca2 Al1 4_555 . 6_554 134.009(16) ?
Pd Ca2 Al1 4_555 . 6_555 134.009(16) ?
Pd Ca2 Pd 5_555 . 6_555 120.000(9) ?
Pd Ca2 Al1 5_555 . 1_554 45.991(9) ?
Pd Ca2 Al1 5_555 . . 45.991(9) ?
Pd Ca2 Al1 5_555 . 2_554 90.000(7) ?
Pd Ca2 Al1 5_555 . 2_555 90.000(7) ?
Pd Ca2 Al1 5_555 . 3_554 134.009(16) ?
Pd Ca2 Al1 5_555 . 3_555 134.009(16) ?
Pd Ca2 Al1 5_555 . 4_554 134.009(9) ?
Pd Ca2 Al1 5_555 . 4_555 134.009(9) ?
Pd Ca2 Al1 5_555 . 5_554 90.000(7) ?
Pd Ca2 Al1 5_555 . 5_555 90.000(7) ?
Pd Ca2 Al1 5_555 . 6_554 45.991(16) ?
Pd Ca2 Al1 5_555 . 6_555 45.991(16) ?
Pd Ca2 Al1 6_555 . 1_554 134.009(8) ?
Pd Ca2 Al1 6_555 . . 134.009(8) ?
Pd Ca2 Al1 6_555 . 2_554 45.991(8) ?
Pd Ca2 Al1 6_555 . 2_555 45.991(8) ?
Pd Ca2 Al1 6_555 . 3_554 90.00(2) ?
Pd Ca2 Al1 6_555 . 3_555 90.00(2) ?
Pd Ca2 Al1 6_555 . 4_554 45.991(8) ?
Pd Ca2 Al1 6_555 . 4_555 45.991(8) ?
Pd Ca2 Al1 6_555 . 5_554 134.009(8) ?
Pd Ca2 Al1 6_555 . 5_555 134.009(8) ?
Pd Ca2 Al1 6_555 . 6_554 90.00(2) ?
Pd Ca2 Al1 6_555 . 6_555 90.00(2) ?
Al1 Ca2 Al1 1_554 . . 73.309(15) ?
Al1 Ca2 Al1 1_554 . 2_554 88.018(11) ?
Al1 Ca2 Al1 1_554 . 2_555 132.703(7) ?
Al1 Ca2 Al1 1_554 . 3_554 88.018(18) ?
Al1 Ca2 Al1 1_554 . 3_555 132.70(2) ?
Al1 Ca2 Al1 1_554 . 4_554 106.691(15) ?
Al1 Ca2 Al1 1_554 . 4_555 180.0(5) ?
Al1 Ca2 Al1 1_554 . 5_554 47.297(7) ?
Al1 Ca2 Al1 1_554 . 5_555 91.982(11) ?
Al1 Ca2 Al1 1_554 . 6_554 47.30(2) ?
Al1 Ca2 Al1 1_554 . 6_555 91.982(18) ?
Al1 Ca2 Al1 . . 2_554 132.703(7) ?
Al1 Ca2 Al1 . . 2_555 88.018(11) ?
Al1 Ca2 Al1 . . 3_554 132.70(2) ?
Al1 Ca2 Al1 . . 3_555 88.018(18) ?
Al1 Ca2 Al1 . . 4_554 180.0(5) ?
Al1 Ca2 Al1 . . 4_555 106.691(15) ?
Al1 Ca2 Al1 . . 5_554 91.982(11) ?
Al1 Ca2 Al1 . . 5_555 47.297(7) ?
Al1 Ca2 Al1 . . 6_554 91.982(18) ?
Al1 Ca2 Al1 . . 6_555 47.30(2) ?
Al1 Ca2 Al1 2_554 . 2_555 73.309(15) ?
Al1 Ca2 Al1 2_554 . 3_554 88.018(18) ?
Al1 Ca2 Al1 2_554 . 3_555 132.70(2) ?
Al1 Ca2 Al1 2_554 . 4_554 47.297(7) ?
Al1 Ca2 Al1 2_554 . 4_555 91.982(11) ?
Al1 Ca2 Al1 2_554 . 5_554 106.691(15) ?
Al1 Ca2 Al1 2_554 . 5_555 180.0(5) ?
Al1 Ca2 Al1 2_554 . 6_554 47.30(2) ?
Al1 Ca2 Al1 2_554 . 6_555 91.982(18) ?
Al1 Ca2 Al1 2_555 . 3_554 132.70(2) ?
Al1 Ca2 Al1 2_555 . 3_555 88.018(18) ?
Al1 Ca2 Al1 2_555 . 4_554 91.982(11) ?
Al1 Ca2 Al1 2_555 . 4_555 47.297(7) ?
Al1 Ca2 Al1 2_555 . 5_554 180.0(5) ?
Al1 Ca2 Al1 2_555 . 5_555 106.691(15) ?
Al1 Ca2 Al1 2_555 . 6_554 91.982(18) ?
Al1 Ca2 Al1 2_555 . 6_555 47.30(2) ?
Al1 Ca2 Al1 3_554 . 3_555 73.309(12) ?
Al1 Ca2 Al1 3_554 . 4_554 47.30(2) ?
Al1 Ca2 Al1 3_554 . 4_555 91.982(18) ?
Al1 Ca2 Al1 3_554 . 5_554 47.30(2) ?
Al1 Ca2 Al1 3_554 . 5_555 91.982(18) ?
Al1 Ca2 Al1 3_554 . 6_554 106.691(12) ?
Al1 Ca2 Al1 3_554 . 6_555 180.0(5) ?
Al1 Ca2 Al1 3_555 . 4_554 91.982(18) ?
Al1 Ca2 Al1 3_555 . 4_555 47.30(2) ?
Al1 Ca2 Al1 3_555 . 5_554 91.982(18) ?
Al1 Ca2 Al1 3_555 . 5_555 47.30(2) ?
Al1 Ca2 Al1 3_555 . 6_554 180.0(5) ?
Al1 Ca2 Al1 3_555 . 6_555 106.691(12) ?
Al1 Ca2 Al1 4_554 . 4_555 73.309(15) ?
Al1 Ca2 Al1 4_554 . 5_554 88.018(11) ?
Al1 Ca2 Al1 4_554 . 5_555 132.703(7) ?
Al1 Ca2 Al1 4_554 . 6_554 88.018(18) ?
Al1 Ca2 Al1 4_554 . 6_555 132.70(2) ?
Al1 Ca2 Al1 4_555 . 5_554 132.703(7) ?
Al1 Ca2 Al1 4_555 . 5_555 88.018(11) ?
Al1 Ca2 Al1 4_555 . 6_554 132.70(2) ?
Al1 Ca2 Al1 4_555 . 6_555 88.018(18) ?
Al1 Ca2 Al1 5_554 . 5_555 73.309(15) ?
Al1 Ca2 Al1 5_554 . 6_554 88.018(18) ?
Al1 Ca2 Al1 5_554 . 6_555 132.70(2) ?
Al1 Ca2 Al1 5_555 . 6_554 132.70(2) ?
Al1 Ca2 Al1 5_555 . 6_555 88.018(18) ?
Al1 Ca2 Al1 6_554 . 6_555 73.309(12) ?
Yb1 Pd Yb1 1_554 . . 82.847(9) ?
Yb1 Pd Ca1 1_554 . 1_554 0.0(5) ?
Yb1 Pd Ca1 1_554 . . 82.847(9) ?
Yb1 Pd Yb2 1_554 . . 138.576(5) ?
Yb1 Pd Ca2 1_554 . . 138.576(5) ?
Yb1 Pd Pd 1_554 . 5_555 112.019(6) ?
Yb1 Pd Pd 1_554 . 6_555 112.019(8) ?
Yb1 Pd Al1 1_554 . 2_554 67.536(17) ?
Yb1 Pd Al1 1_554 . 2_555 133.82(2) ?
Yb1 Pd Al1 1_554 . 6_554 67.54(2) ?
Yb1 Pd Al1 1_554 . 6_555 133.825(17) ?
Yb1 Pd Al2 1_554 . 2_555 72.139(8) ?
Yb1 Pd Al2 1_554 . 3_665 72.139(5) ?
Yb1 Pd Ca1 . . 1_554 82.847(9) ?
Yb1 Pd Ca1 . . . 0.0(5) ?
Yb1 Pd Yb2 . . . 138.576(5) ?
Yb1 Pd Ca2 . . . 138.576(5) ?
Yb1 Pd Pd . . 5_555 112.019(6) ?
Yb1 Pd Pd . . 6_555 112.019(8) ?
Yb1 Pd Al1 . . 2_554 133.82(2) ?
Yb1 Pd Al1 . . 2_555 67.536(17) ?
Yb1 Pd Al1 . . 6_554 133.825(17) ?
Yb1 Pd Al1 . . 6_555 67.54(2) ?
Yb1 Pd Al2 . . 2_555 72.139(8) ?
Yb1 Pd Al2 . . 3_665 72.139(5) ?
Ca1 Pd Ca1 1_554 . . 82.847(9) ?
Ca1 Pd Yb2 1_554 . . 138.576(5) ?
Ca1 Pd Ca2 1_554 . . 138.576(5) ?
Ca1 Pd Pd 1_554 . 5_555 112.019(6) ?
Ca1 Pd Pd 1_554 . 6_555 112.019(8) ?
Ca1 Pd Al1 1_554 . 2_554 67.536(17) ?
Ca1 Pd Al1 1_554 . 2_555 133.82(2) ?
Ca1 Pd Al1 1_554 . 6_554 67.54(2) ?
Ca1 Pd Al1 1_554 . 6_555 133.825(17) ?
Ca1 Pd Al2 1_554 . 2_555 72.139(8) ?
Ca1 Pd Al2 1_554 . 3_665 72.139(5) ?
Ca1 Pd Yb2 . . . 138.576(5) ?
Ca1 Pd Ca2 . . . 138.576(5) ?
Ca1 Pd Pd . . 5_555 112.019(6) ?
Ca1 Pd Pd . . 6_555 112.019(8) ?
Ca1 Pd Al1 . . 2_554 133.82(2) ?
Ca1 Pd Al1 . . 2_555 67.536(17) ?
Ca1 Pd Al1 . . 6_554 133.825(17) ?
Ca1 Pd Al1 . . 6_555 67.54(2) ?
Ca1 Pd Al2 . . 2_555 72.139(8) ?
Ca1 Pd Al2 . . 3_665 72.139(5) ?
Yb2 Pd Ca2 . . . 0.0(5) ?
Yb2 Pd Pd . . 5_555 60.000(9) ?
Yb2 Pd Pd . . 6_555 60.000(7) ?
Yb2 Pd Al1 . . 2_554 78.06(2) ?
Yb2 Pd Al1 . . 2_555 78.06(2) ?
Yb2 Pd Al1 . . 6_554 78.057(19) ?
Yb2 Pd Al1 . . 6_555 78.057(19) ?
Yb2 Pd Al2 . . 2_555 114.145(7) ?
Yb2 Pd Al2 . . 3_665 114.145(11) ?
Ca2 Pd Pd . . 5_555 60.000(9) ?
Ca2 Pd Pd . . 6_555 60.000(7) ?
Ca2 Pd Al1 . . 2_554 78.06(2) ?
Ca2 Pd Al1 . . 2_555 78.06(2) ?
Ca2 Pd Al1 . . 6_554 78.057(19) ?
Ca2 Pd Al1 . . 6_555 78.057(19) ?
Ca2 Pd Al2 . . 2_555 114.145(7) ?
Ca2 Pd Al2 . . 3_665 114.145(11) ?
Pd Pd Pd 5_555 . 6_555 120.000(11) ?
Pd Pd Al1 5_555 . 2_554 111.66(2) ?
Pd Pd Al1 5_555 . 2_555 111.66(2) ?
Pd Pd Al1 5_555 . 6_554 54.83(2) ?
Pd Pd Al1 5_555 . 6_555 54.83(2) ?
Pd Pd Al2 5_555 . 2_555 174.145(8) ?
Pd Pd Al2 5_555 . 3_665 54.145(8) ?
Pd Pd Al1 6_555 . 2_554 54.830(4) ?
Pd Pd Al1 6_555 . 2_555 54.830(4) ?
Pd Pd Al1 6_555 . 6_554 111.658(18) ?
Pd Pd Al1 6_555 . 6_555 111.658(18) ?
Pd Pd Al2 6_555 . 2_555 54.145(8) ?
Pd Pd Al2 6_555 . 3_665 174.145(12) ?
Al1 Pd Al1 2_554 . 2_555 108.597(9) ?
Al1 Pd Al1 2_554 . 6_554 66.14(2) ?
Al1 Pd Al1 2_554 . 6_555 156.11(3) ?
Al1 Pd Al2 2_554 . 2_555 65.59(2) ?
Al1 Pd Al2 2_554 . 3_665 125.630(4) ?
Al1 Pd Al1 2_555 . 6_554 156.11(3) ?
Al1 Pd Al1 2_555 . 6_555 66.14(2) ?
Al1 Pd Al2 2_555 . 2_555 65.59(2) ?
Al1 Pd Al2 2_555 . 3_665 125.630(4) ?
Al1 Pd Al1 6_554 . 6_555 108.60(3) ?
Al1 Pd Al2 6_554 . 2_555 125.63(2) ?
Al1 Pd Al2 6_554 . 3_665 65.590(18) ?
Al1 Pd Al2 6_555 . 2_555 125.63(2) ?
Al1 Pd Al2 6_555 . 3_665 65.590(18) ?
Al2 Pd Al2 2_555 . 3_665 131.711(11) ?
Yb1 Al1 Yb1 1_545 . 4_665 111.66(3) ?
Yb1 Al1 Ca1 1_545 . 1_545 0.0(5) ?
Yb1 Al1 Ca1 1_545 . 4_665 111.66(3) ?
Yb1 Al1 Yb2 1_545 . . 116.782(8) ?
Yb1 Al1 Yb2 1_545 . 1_556 116.782(8) ?
Yb1 Al1 Ca2 1_545 . . 116.782(8) ?
Yb1 Al1 Ca2 1_545 . 1_556 116.782(8) ?
Yb1 Al1 Pd 1_545 . 3_555 64.913(11) ?
Yb1 Al1 Pd 1_545 . 3_556 64.913(11) ?
Yb1 Al1 Pd 1_545 . 5_555 121.948(19) ?
Yb1 Al1 Pd 1_545 . 5_556 121.948(19) ?
Yb1 Al1 Al1 1_545 . 4_655 55.828(16) ?
Yb1 Al1 Al1 1_545 . 5_555 64.172(19) ?
Yb1 Al1 Al1 1_545 . 6_555 175.83(4) ?
Yb1 Al1 Al2 1_545 . . 68.423(16) ?
Yb1 Al1 Al2 1_545 . 1_556 68.423(16) ?
Yb1 Al1 Ca1 4_665 . 1_545 111.66(3) ?
Yb1 Al1 Ca1 4_665 . 4_665 0.0(5) ?
Yb1 Al1 Yb2 4_665 . . 116.782(9) ?
Yb1 Al1 Yb2 4_665 . 1_556 116.782(9) ?
Yb1 Al1 Ca2 4_665 . . 116.782(9) ?
Yb1 Al1 Ca2 4_665 . 1_556 116.782(9) ?
Yb1 Al1 Pd 4_665 . 3_555 121.947(19) ?
Yb1 Al1 Pd 4_665 . 3_556 121.947(19) ?
Yb1 Al1 Pd 4_665 . 5_555 64.913(10) ?
Yb1 Al1 Pd 4_665 . 5_556 64.913(10) ?
Yb1 Al1 Al1 4_665 . 4_655 55.828(16) ?
Yb1 Al1 Al1 4_665 . 5_555 175.83(4) ?
Yb1 Al1 Al1 4_665 . 6_555 64.172(19) ?
Yb1 Al1 Al2 4_665 . . 68.423(17) ?
Yb1 Al1 Al2 4_665 . 1_556 68.423(17) ?
Ca1 Al1 Ca1 1_545 . 4_665 111.66(3) ?
Ca1 Al1 Yb2 1_545 . . 116.782(8) ?
Ca1 Al1 Yb2 1_545 . 1_556 116.782(8) ?
Ca1 Al1 Ca2 1_545 . . 116.782(8) ?
Ca1 Al1 Ca2 1_545 . 1_556 116.782(8) ?
Ca1 Al1 Pd 1_545 . 3_555 64.913(11) ?
Ca1 Al1 Pd 1_545 . 3_556 64.913(11) ?
Ca1 Al1 Pd 1_545 . 5_555 121.948(19) ?
Ca1 Al1 Pd 1_545 . 5_556 121.948(19) ?
Ca1 Al1 Al1 1_545 . 4_655 55.828(16) ?
Ca1 Al1 Al1 1_545 . 5_555 64.172(19) ?
Ca1 Al1 Al1 1_545 . 6_555 175.83(4) ?
Ca1 Al1 Al2 1_545 . . 68.423(16) ?
Ca1 Al1 Al2 1_545 . 1_556 68.423(16) ?
Ca1 Al1 Yb2 4_665 . . 116.782(9) ?
Ca1 Al1 Yb2 4_665 . 1_556 116.782(9) ?
Ca1 Al1 Ca2 4_665 . . 116.782(9) ?
Ca1 Al1 Ca2 4_665 . 1_556 116.782(9) ?
Ca1 Al1 Pd 4_665 . 3_555 121.947(19) ?
Ca1 Al1 Pd 4_665 . 3_556 121.947(19) ?
Ca1 Al1 Pd 4_665 . 5_555 64.913(10) ?
Ca1 Al1 Pd 4_665 . 5_556 64.913(10) ?
Ca1 Al1 Al1 4_665 . 4_655 55.828(16) ?
Ca1 Al1 Al1 4_665 . 5_555 175.83(4) ?
Ca1 Al1 Al1 4_665 . 6_555 64.172(19) ?
Ca1 Al1 Al2 4_665 . . 68.423(17) ?
Ca1 Al1 Al2 4_665 . 1_556 68.423(17) ?
Yb2 Al1 Yb2 . . 1_556 73.31(2) ?
Yb2 Al1 Ca2 . . . 0.0(5) ?
Yb2 Al1 Ca2 . . 1_556 73.31(2) ?
Yb2 Al1 Pd . . 3_555 55.952(15) ?
Yb2 Al1 Pd . . 3_556 114.19(3) ?
Yb2 Al1 Pd . . 5_555 55.952(15) ?
Yb2 Al1 Pd . . 5_556 114.19(3) ?
Yb2 Al1 Al1 . . 4_655 143.346(10) ?
Yb2 Al1 Al1 . . 5_555 66.35(2) ?
Yb2 Al1 Al1 . . 6_555 66.35(2) ?
Yb2 Al1 Al2 . . . 94.246(8) ?
Yb2 Al1 Al2 . . 1_556 167.55(3) ?
Yb2 Al1 Ca2 1_556 . . 73.31(2) ?
Yb2 Al1 Ca2 1_556 . 1_556 0.0(5) ?
Yb2 Al1 Pd 1_556 . 3_555 114.19(3) ?
Yb2 Al1 Pd 1_556 . 3_556 55.952(15) ?
Yb2 Al1 Pd 1_556 . 5_555 114.19(3) ?
Yb2 Al1 Pd 1_556 . 5_556 55.952(15) ?
Yb2 Al1 Al1 1_556 . 4_655 143.346(10) ?
Yb2 Al1 Al1 1_556 . 5_555 66.35(2) ?
Yb2 Al1 Al1 1_556 . 6_555 66.35(2) ?
Yb2 Al1 Al2 1_556 . . 167.55(3) ?
Yb2 Al1 Al2 1_556 . 1_556 94.246(8) ?
Ca2 Al1 Ca2 . . 1_556 73.31(2) ?
Ca2 Al1 Pd . . 3_555 55.952(15) ?
Ca2 Al1 Pd . . 3_556 114.19(3) ?
Ca2 Al1 Pd . . 5_555 55.952(15) ?
Ca2 Al1 Pd . . 5_556 114.19(3) ?
Ca2 Al1 Al1 . . 4_655 143.346(10) ?
Ca2 Al1 Al1 . . 5_555 66.35(2) ?
Ca2 Al1 Al1 . . 6_555 66.35(2) ?
Ca2 Al1 Al2 . . . 94.246(8) ?
Ca2 Al1 Al2 . . 1_556 167.55(3) ?
Ca2 Al1 Pd 1_556 . 3_555 114.19(3) ?
Ca2 Al1 Pd 1_556 . 3_556 55.952(15) ?
Ca2 Al1 Pd 1_556 . 5_555 114.19(3) ?
Ca2 Al1 Pd 1_556 . 5_556 55.952(15) ?
Ca2 Al1 Al1 1_556 . 4_655 143.346(10) ?
Ca2 Al1 Al1 1_556 . 5_555 66.35(2) ?
Ca2 Al1 Al1 1_556 . 6_555 66.35(2) ?
Ca2 Al1 Al2 1_556 . . 167.55(3) ?
Ca2 Al1 Al2 1_556 . 1_556 94.246(8) ?
Pd Al1 Pd 3_555 . 3_556 108.597(10) ?
Pd Al1 Pd 3_555 . 5_555 70.341(9) ?
Pd Al1 Pd 3_555 . 5_556 169.26(5) ?
Pd Al1 Al1 3_555 . 4_655 95.37(2) ?
Pd Al1 Al1 3_555 . 5_555 56.932(10) ?
Pd Al1 Al1 3_555 . 6_555 116.87(2) ?
Pd Al1 Al2 3_555 . . 56.460(11) ?
Pd Al1 Al2 3_555 . 1_556 132.46(3) ?
Pd Al1 Pd 3_556 . 5_555 169.26(5) ?
Pd Al1 Pd 3_556 . 5_556 70.341(9) ?
Pd Al1 Al1 3_556 . 4_655 95.37(2) ?
Pd Al1 Al1 3_556 . 5_555 56.932(10) ?
Pd Al1 Al1 3_556 . 6_555 116.87(2) ?
Pd Al1 Al2 3_556 . . 132.46(3) ?
Pd Al1 Al2 3_556 . 1_556 56.460(11) ?
Pd Al1 Pd 5_555 . 5_556 108.596(11) ?
Pd Al1 Al1 5_555 . 4_655 95.37(2) ?
Pd Al1 Al1 5_555 . 5_555 116.87(2) ?
Pd Al1 Al1 5_555 . 6_555 56.931(11) ?
Pd Al1 Al2 5_555 . . 56.460(11) ?
Pd Al1 Al2 5_555 . 1_556 132.46(3) ?
Pd Al1 Al1 5_556 . 4_655 95.37(2) ?
Pd Al1 Al1 5_556 . 5_555 116.87(2) ?
Pd Al1 Al1 5_556 . 6_555 56.931(11) ?
Pd Al1 Al2 5_556 . . 132.46(3) ?
Pd Al1 Al2 5_556 . 1_556 56.460(11) ?
Al1 Al1 Al1 4_655 . 5_555 120.00(3) ?
Al1 Al1 Al1 4_655 . 6_555 120.00(3) ?
Al1 Al1 Al2 4_655 . . 49.100(16) ?
Al1 Al1 Al2 4_655 . 1_556 49.100(16) ?
Al1 Al1 Al1 5_555 . 6_555 120.00(4) ?
Al1 Al1 Al2 5_555 . . 109.109(12) ?
Al1 Al1 Al2 5_555 . 1_556 109.109(12) ?
Al1 Al1 Al2 6_555 . . 109.109(12) ?
Al1 Al1 Al2 6_555 . 1_556 109.109(12) ?
Al2 Al1 Al2 . . 1_556 98.20(3) ?
Yb1 Al2 Yb1 1_544 . 1_545 76.172(7) ?
Yb1 Al2 Yb1 1_544 . 4_664 103.828(7) ?
Yb1 Al2 Yb1 1_544 . 4_665 180.0(5) ?
Yb1 Al2 Ca1 1_544 . 1_544 0.0(5) ?
Yb1 Al2 Ca1 1_544 . 1_545 76.172(7) ?
Yb1 Al2 Ca1 1_544 . 4_664 103.828(7) ?
Yb1 Al2 Ca1 1_544 . 4_665 180.0(5) ?
Yb1 Al2 Pd 1_544 . 2_655 62.547(6) ?
Yb1 Al2 Pd 1_544 . 3_555 62.547(6) ?
Yb1 Al2 Pd 1_544 . 5_555 117.453(6) ?
Yb1 Al2 Pd 1_544 . 6_655 117.453(6) ?
Yb1 Al2 Al1 1_544 . 1_554 62.209(8) ?
Yb1 Al2 Al1 1_544 . . 117.791(9) ?
Yb1 Al2 Al1 1_544 . 4_654 62.209(9) ?
Yb1 Al2 Al1 1_544 . 4_655 117.791(8) ?
Yb1 Al2 Yb1 1_545 . 4_664 180.0(5) ?
Yb1 Al2 Yb1 1_545 . 4_665 103.828(7) ?
Yb1 Al2 Ca1 1_545 . 1_544 76.172(7) ?
Yb1 Al2 Ca1 1_545 . 1_545 0.0(5) ?
Yb1 Al2 Ca1 1_545 . 4_664 180.0(5) ?
Yb1 Al2 Ca1 1_545 . 4_665 103.828(7) ?
Yb1 Al2 Pd 1_545 . 2_655 62.547(6) ?
Yb1 Al2 Pd 1_545 . 3_555 62.547(6) ?
Yb1 Al2 Pd 1_545 . 5_555 117.453(6) ?
Yb1 Al2 Pd 1_545 . 6_655 117.453(6) ?
Yb1 Al2 Al1 1_545 . 1_554 117.791(9) ?
Yb1 Al2 Al1 1_545 . . 62.209(8) ?
Yb1 Al2 Al1 1_545 . 4_654 117.791(8) ?
Yb1 Al2 Al1 1_545 . 4_655 62.209(9) ?
Yb1 Al2 Yb1 4_664 . 4_665 76.172(7) ?
Yb1 Al2 Ca1 4_664 . 1_544 103.828(7) ?
Yb1 Al2 Ca1 4_664 . 1_545 180.0(5) ?
Yb1 Al2 Ca1 4_664 . 4_664 0.0(5) ?
Yb1 Al2 Ca1 4_664 . 4_665 76.172(7) ?
Yb1 Al2 Pd 4_664 . 2_655 117.453(6) ?
Yb1 Al2 Pd 4_664 . 3_555 117.453(6) ?
Yb1 Al2 Pd 4_664 . 5_555 62.547(6) ?
Yb1 Al2 Pd 4_664 . 6_655 62.547(6) ?
Yb1 Al2 Al1 4_664 . 1_554 62.209(9) ?
Yb1 Al2 Al1 4_664 . . 117.791(8) ?
Yb1 Al2 Al1 4_664 . 4_654 62.209(8) ?
Yb1 Al2 Al1 4_664 . 4_655 117.791(9) ?
Yb1 Al2 Ca1 4_665 . 1_544 180.0(5) ?
Yb1 Al2 Ca1 4_665 . 1_545 103.828(7) ?
Yb1 Al2 Ca1 4_665 . 4_664 76.172(7) ?
Yb1 Al2 Ca1 4_665 . 4_665 0.0(5) ?
Yb1 Al2 Pd 4_665 . 2_655 117.453(6) ?
Yb1 Al2 Pd 4_665 . 3_555 117.453(6) ?
Yb1 Al2 Pd 4_665 . 5_555 62.547(6) ?
Yb1 Al2 Pd 4_665 . 6_655 62.547(6) ?
Yb1 Al2 Al1 4_665 . 1_554 117.791(8) ?
Yb1 Al2 Al1 4_665 . . 62.209(9) ?
Yb1 Al2 Al1 4_665 . 4_654 117.791(9) ?
Yb1 Al2 Al1 4_665 . 4_655 62.209(8) ?
Ca1 Al2 Ca1 1_544 . 1_545 76.172(7) ?
Ca1 Al2 Ca1 1_544 . 4_664 103.828(7) ?
Ca1 Al2 Ca1 1_544 . 4_665 180.0(5) ?
Ca1 Al2 Pd 1_544 . 2_655 62.547(6) ?
Ca1 Al2 Pd 1_544 . 3_555 62.547(6) ?
Ca1 Al2 Pd 1_544 . 5_555 117.453(6) ?
Ca1 Al2 Pd 1_544 . 6_655 117.453(6) ?
Ca1 Al2 Al1 1_544 . 1_554 62.209(8) ?
Ca1 Al2 Al1 1_544 . . 117.791(9) ?
Ca1 Al2 Al1 1_544 . 4_654 62.209(9) ?
Ca1 Al2 Al1 1_544 . 4_655 117.791(8) ?
Ca1 Al2 Ca1 1_545 . 4_664 180.0(5) ?
Ca1 Al2 Ca1 1_545 . 4_665 103.828(7) ?
Ca1 Al2 Pd 1_545 . 2_655 62.547(6) ?
Ca1 Al2 Pd 1_545 . 3_555 62.547(6) ?
Ca1 Al2 Pd 1_545 . 5_555 117.453(6) ?
Ca1 Al2 Pd 1_545 . 6_655 117.453(6) ?
Ca1 Al2 Al1 1_545 . 1_554 117.791(9) ?
Ca1 Al2 Al1 1_545 . . 62.209(8) ?
Ca1 Al2 Al1 1_545 . 4_654 117.791(8) ?
Ca1 Al2 Al1 1_545 . 4_655 62.209(9) ?
Ca1 Al2 Ca1 4_664 . 4_665 76.172(7) ?
Ca1 Al2 Pd 4_664 . 2_655 117.453(6) ?
Ca1 Al2 Pd 4_664 . 3_555 117.453(6) ?
Ca1 Al2 Pd 4_664 . 5_555 62.547(6) ?
Ca1 Al2 Pd 4_664 . 6_655 62.547(6) ?
Ca1 Al2 Al1 4_664 . 1_554 62.209(9) ?
Ca1 Al2 Al1 4_664 . . 117.791(8) ?
Ca1 Al2 Al1 4_664 . 4_654 62.209(8) ?
Ca1 Al2 Al1 4_664 . 4_655 117.791(9) ?
Ca1 Al2 Pd 4_665 . 2_655 117.453(6) ?
Ca1 Al2 Pd 4_665 . 3_555 117.453(6) ?
Ca1 Al2 Pd 4_665 . 5_555 62.547(6) ?
Ca1 Al2 Pd 4_665 . 6_655 62.547(6) ?
Ca1 Al2 Al1 4_665 . 1_554 117.791(8) ?
Ca1 Al2 Al1 4_665 . . 62.209(9) ?
Ca1 Al2 Al1 4_665 . 4_654 117.791(9) ?
Ca1 Al2 Al1 4_665 . 4_655 62.209(8) ?
Pd Al2 Pd 2_655 . 3_555 108.289(9) ?
Pd Al2 Pd 2_655 . 5_555 180.0(5) ?
Pd Al2 Pd 2_655 . 6_655 71.711(9) ?
Pd Al2 Al1 2_655 . 1_554 122.051(12) ?
Pd Al2 Al1 2_655 . . 122.051(12) ?
Pd Al2 Al1 2_655 . 4_654 57.949(12) ?
Pd Al2 Al1 2_655 . 4_655 57.949(12) ?
Pd Al2 Pd 3_555 . 5_555 71.711(9) ?
Pd Al2 Pd 3_555 . 6_655 180.0(5) ?
Pd Al2 Al1 3_555 . 1_554 57.949(12) ?
Pd Al2 Al1 3_555 . . 57.949(12) ?
Pd Al2 Al1 3_555 . 4_654 122.051(12) ?
Pd Al2 Al1 3_555 . 4_655 122.051(12) ?
Pd Al2 Pd 5_555 . 6_655 108.289(9) ?
Pd Al2 Al1 5_555 . 1_554 57.949(12) ?
Pd Al2 Al1 5_555 . . 57.949(12) ?
Pd Al2 Al1 5_555 . 4_654 122.051(12) ?
Pd Al2 Al1 5_555 . 4_655 122.051(12) ?
Pd Al2 Al1 6_655 . 1_554 122.051(12) ?
Pd Al2 Al1 6_655 . . 122.051(12) ?
Pd Al2 Al1 6_655 . 4_654 57.949(12) ?
Pd Al2 Al1 6_655 . 4_655 57.949(12) ?
Al1 Al2 Al1 1_554 . . 98.20(2) ?
Al1 Al2 Al1 1_554 . 4_654 81.80(2) ?
Al1 Al2 Al1 1_554 . 4_655 180.0(5) ?
Al1 Al2 Al1 . . 4_654 180.0(5) ?
Al1 Al2 Al1 . . 4_655 81.80(2) ?
Al1 Al2 Al1 4_654 . 4_655 98.20(2) ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion
_geom_torsion_publ_flag
? ? ? ? ? ? ? ? ? ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_D
_geom_hbond_site_symmetry_H
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_publ_flag
? ? ? ? ? ? ? ? ? ? ?


####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_I_CCDC6
_database_code_depnum_ccdc_archive 'CCDC 1880784'
loop_
_audit_author_name
_audit_author_address
'Oliver Janka'
;WWU Muenster
Germany
;
_audit_update_record             
;
2019-04-17 deposited with the CCDC.	2019-10-14 downloaded from the CCDC.
;
#=======================================================================

# 5. CHEMICAL DATA

_chemical_name_systematic        
; ?
;
_chemical_name_common            ?
_chemical_formula_moiety         ?
_chemical_formula_structural     ?
_chemical_formula_analytical     ?
_chemical_formula_iupac          ?
_chemical_formula_sum            'Al3 Pd2 Yb1'
_chemical_formula_weight         466.8
_chemical_melting_point          ?
_chemical_compound_source        ?
_chemical_absolute_configuration .

#=======================================================================

# 6. CRYSTAL DATA

_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_H-M   'P 6/m m m'
_symmetry_space_group_name_Hall  '-P 6;-2'
_symmetry_Int_Tables_number      191

loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -y,x-y,z
3 -x+y,-x,z
4 -x,-y,z
5 y,-x+y,z
6 x-y,x,z
7 y,x,-z
8 x-y,-y,-z
9 -x,-x+y,-z
10 -y,-x,-z
11 -x+y,y,-z
12 x,x-y,-z
13 -x,-y,-z
14 y,-x+y,-z
15 x-y,x,-z
16 x,y,-z
17 -y,x-y,-z
18 -x+y,-x,-z
19 -y,-x,z
20 -x+y,y,z
21 x,x-y,z
22 y,x,z
23 x-y,-y,z
24 -x,-x+y,z

_cell_length_a                   9.2802(6)
_cell_length_b                   9.2802(6)
_cell_length_c                   4.2222(3)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_volume                     314.91(4)

loop_
_twin_individual_id
_twin_individual_mass_fraction_refined
_twin_individual_twin_matrix_11
_twin_individual_twin_matrix_12
_twin_individual_twin_matrix_13
_twin_individual_twin_matrix_21
_twin_individual_twin_matrix_22
_twin_individual_twin_matrix_23
_twin_individual_twin_matrix_31
_twin_individual_twin_matrix_32
_twin_individual_twin_matrix_33
? ? ? ? ? ? ? ? ? ? ?

_cell_formula_units_Z            3

_cell_measurement_reflns_used    10265
_cell_measurement_theta_min      2.54
_cell_measurement_theta_max      33.81
_cell_measurement_temperature    90
_cell_special_details            
; ?
;

_exptl_crystal_density_diffrn    7.38
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_F_000             603

_exptl_absorpt_coefficient_mu    31.0
_exptl_crystal_description       plate
_exptl_crystal_size_max          0.120
_exptl_crystal_size_mid          0.075
_exptl_crystal_size_min          0.025
_exptl_crystal_size_rad          ?
_exptl_crystal_colour            silver
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   ?
_exptl_absorpt_correction_T_min  0.1001
_exptl_absorpt_correction_T_max  0.4951
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
? ? ? ?

#=======================================================================

# 7. EXPERIMENTAL DATA

_exptl_special_details           ?

_diffrn_ambient_temperature      90
_diffrn_source                   ?
_diffrn_source_power             ?
_diffrn_source_voltage           ?
_diffrn_source_current           ?
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_source         'X-ray tube'
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'Stoe StadiVari'
_diffrn_detector                 ?
_diffrn_detector_area_resol_mean ?
_diffrn_measurement_method       '??integration method??'
_diffrn_measurement_specimen_support ?

_diffrn_reflns_number            4589
_diffrn_reflns_theta_min         2.53
_diffrn_reflns_theta_max         33.23
_diffrn_reflns_theta_full        33.23
_diffrn_measured_fraction_theta_max 1
_diffrn_measured_fraction_theta_full 1
_diffrn_reflns_av_R_equivalents  0.031
_diffrn_reflns_av_unetI/netI     0.0045
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_l_min       -6
_diffrn_reflns_limit_l_max       6
_diffrn_reflns_reduction_process ?

_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
loop_
_diffrn_standard_refln_index_h
_diffrn_standard_refln_index_k
_diffrn_standard_refln_index_l
? ? ?

_diffrn_radiation_probe          X-ray

#=======================================================================

# 8. REFINEMENT DATA

_refine_special_details          
; ?
;

_reflns_number_total             283
_reflns_number_gt                276
_reflns_threshold_expression     I>3σ(I)

_refine_ls_structure_factor_coef Fsqd
_refine_ls_R_factor_gt           0.0157
_refine_ls_wR_factor_gt          0.0360
_refine_ls_R_factor_all          0.0169
_refine_ls_wR_factor_ref         0.0366
_refine_ls_goodness_of_fit_ref   1.54
_refine_ls_goodness_of_fit_gt    1.53
_refine_ls_restrained_S_gt       ?
_refine_ls_restrained_S_all      ?
_refine_ls_number_reflns         283
_refine_ls_number_parameters     17
_refine_ls_number_restraints     0
_refine_ls_number_constraints    0
_refine_ls_weighting_scheme      sigma
_refine_ls_weighting_details     w=1/(σ²(I)+0.0004I²)
_refine_ls_hydrogen_treatment    ?
_refine_ls_shift/su_max          0.0007
_refine_ls_shift/su_mean         0.0001
_refine_diff_density_max         1.28
_refine_diff_density_min         -1.50
_refine_ls_extinction_method     
'B-C type 1 Lorentzian isotropic (Becker & Coppens, 1974)'
_refine_ls_extinction_coef       700(30)
_refine_ls_abs_structure_details ?
_refine_ls_abs_structure_Flack   ?
_refine_ls_abs_structure_Rogers  ?

loop_
_atom_type_symbol
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Al 0.0645 0.0514 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Pd -0.9988 1.0072 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Yb -0.3850 5.5486 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    ?
_computing_structure_refinement  ?
_computing_molecular_graphics    ?
_computing_publication_material  ?

loop_
_restr_distance_atom_site_label_1
_restr_distance_site_symmetry_1
_restr_distance_atom_site_label_2
_restr_distance_site_symmetry_2
_restr_distance_target
_restr_distance_target_weight_param
? ? ? ? ? ?

loop_
_restr_angle_atom_site_label_1
_restr_angle_site_symmetry_1
_restr_angle_atom_site_label_2
_restr_angle_site_symmetry_2
_restr_angle_atom_site_label_3
_restr_angle_site_symmetry_3
_restr_angle_target
_restr_angle_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_torsion_atom_site_label_1
_restr_torsion_site_symmetry_1
_restr_torsion_atom_site_label_2
_restr_torsion_site_symmetry_2
_restr_torsion_atom_site_label_3
_restr_torsion_site_symmetry_3
_restr_torsion_atom_site_label_4
_restr_torsion_site_symmetry_4
_restr_torsion_angle_target
_restr_torsion_weight_param
? ? ? ? ? ? ? ? ? ?

loop_
_restr_equal_distance_atom_site_label_1
_restr_equal_distance_site_symmetry_1
_restr_equal_distance_atom_site_label_2
_restr_equal_distance_site_symmetry_2
_restr_equal_distance_class_class_id
_restr_equal_distance_class_target_weight_param
? ? ? ? ? ?

loop_
_restr_equal_angle_atom_site_label_1
_restr_equal_angle_site_symmetry_1
_restr_equal_angle_atom_site_label_2
_restr_equal_angle_site_symmetry_2
_restr_equal_angle_atom_site_label_3
_restr_equal_angle_site_symmetry_3
_restr_equal_angle_class_class_id
_restr_equal_angle_class_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_equal_torsion_atom_site_label_1
_restr_equal_torsion_site_symmetry_1
_restr_equal_torsion_atom_site_label_2
_restr_equal_torsion_site_symmetry_2
_restr_equal_torsion_atom_site_label_3
_restr_equal_torsion_site_symmetry_3
_restr_equal_torsion_atom_site_label_4
_restr_equal_torsion_site_symmetry_4
_restr_equal_torsion_class_class_id
_restr_equal_torsion_class_target_weight_param
? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 9. ATOMIC COORDINATES AND DISPLACEMENT PARAMETERS

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_adp_type
_atom_site_U_iso_or_equiv
_atom_site_site_symmetry_multiplicity
_atom_site_occupancy
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Yb1 Yb 0.333333 0.666667 0.5 Uani 0.01121(10) 2 1 d . . .
Yb2 Yb 0 0 0 Uani 0.01228(12) 1 1 d . . .
Pd Pd 0.18485(2) 0.36970(4) 0 Uani 0.01092(11) 6 1 d . . .
Al1 Al 0.30365(15) 0 0.5 Uani 0.0121(4) 6 1 d . . .
Al2 Al 0.5 0 0 Uani 0.0124(5) 3 1 d . . .


loop_
_jana_atom_site_ADP_C_label
_jana_atom_site_ADP_C_type_symbol
_jana_atom_site_ADP_C_111
_jana_atom_site_ADP_C_112
_jana_atom_site_ADP_C_113
_jana_atom_site_ADP_C_122
_jana_atom_site_ADP_C_123
_jana_atom_site_ADP_C_133
_jana_atom_site_ADP_C_222
_jana_atom_site_ADP_C_223
_jana_atom_site_ADP_C_233
_jana_atom_site_ADP_C_333
? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_D_label
_jana_atom_site_ADP_D_type_symbol
_jana_atom_site_ADP_D_1111
_jana_atom_site_ADP_D_1112
_jana_atom_site_ADP_D_1113
_jana_atom_site_ADP_D_1122
_jana_atom_site_ADP_D_1123
_jana_atom_site_ADP_D_1133
_jana_atom_site_ADP_D_1222
_jana_atom_site_ADP_D_1223
_jana_atom_site_ADP_D_1233
_jana_atom_site_ADP_D_1333
_jana_atom_site_ADP_D_2222
_jana_atom_site_ADP_D_2223
_jana_atom_site_ADP_D_2233
_jana_atom_site_ADP_D_2333
_jana_atom_site_ADP_D_3333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_E_label
_jana_atom_site_ADP_E_type_symbol
_jana_atom_site_ADP_E_11111
_jana_atom_site_ADP_E_11112
_jana_atom_site_ADP_E_11113
_jana_atom_site_ADP_E_11122
_jana_atom_site_ADP_E_11123
_jana_atom_site_ADP_E_11133
_jana_atom_site_ADP_E_11222
_jana_atom_site_ADP_E_11223
_jana_atom_site_ADP_E_11233
_jana_atom_site_ADP_E_11333
_jana_atom_site_ADP_E_12222
_jana_atom_site_ADP_E_12223
_jana_atom_site_ADP_E_12233
_jana_atom_site_ADP_E_12333
_jana_atom_site_ADP_E_13333
_jana_atom_site_ADP_E_22222
_jana_atom_site_ADP_E_22223
_jana_atom_site_ADP_E_22233
_jana_atom_site_ADP_E_22333
_jana_atom_site_ADP_E_23333
_jana_atom_site_ADP_E_33333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_F_label
_jana_atom_site_ADP_F_type_symbol
_jana_atom_site_ADP_F_111111
_jana_atom_site_ADP_F_111112
_jana_atom_site_ADP_F_111113
_jana_atom_site_ADP_F_111122
_jana_atom_site_ADP_F_111123
_jana_atom_site_ADP_F_111133
_jana_atom_site_ADP_F_111222
_jana_atom_site_ADP_F_111223
_jana_atom_site_ADP_F_111233
_jana_atom_site_ADP_F_111333
_jana_atom_site_ADP_F_112222
_jana_atom_site_ADP_F_112223
_jana_atom_site_ADP_F_112233
_jana_atom_site_ADP_F_112333
_jana_atom_site_ADP_F_113333
_jana_atom_site_ADP_F_122222
_jana_atom_site_ADP_F_122223
_jana_atom_site_ADP_F_122233
_jana_atom_site_ADP_F_122333
_jana_atom_site_ADP_F_123333
_jana_atom_site_ADP_F_133333
_jana_atom_site_ADP_F_222222
_jana_atom_site_ADP_F_222223
_jana_atom_site_ADP_F_222233
_jana_atom_site_ADP_F_222333
_jana_atom_site_ADP_F_223333
_jana_atom_site_ADP_F_233333
_jana_atom_site_ADP_F_333333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 10. MOLECULAR GEOMETRY


loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Yb1 Pd . . 3.1864(5) ?
Yb1 Pd . 1_556 3.1864(5) ?
Yb1 Pd . 2_665 3.1864(5) ?
Yb1 Pd . 2_666 3.1864(5) ?
Yb1 Pd . 3_565 3.1864(4) ?
Yb1 Pd . 3_566 3.1864(4) ?
Yb1 Al1 . 1_565 3.2399(9) ?
Yb1 Al1 . 2_555 3.2399(10) ?
Yb1 Al1 . 3_665 3.2399(16) ?
Yb1 Al1 . 4_665 3.2399(10) ?
Yb1 Al1 . 5_565 3.2399(9) ?
Yb1 Al1 . 6_555 3.2399(16) ?
Yb1 Al2 . 1_565 3.4108(4) ?
Yb1 Al2 . 1_566 3.4108(4) ?
Yb1 Al2 . 2_555 3.4108(4) ?
Yb1 Al2 . 2_556 3.4108(4) ?
Yb1 Al2 . 3_665 3.4108(2) ?
Yb1 Al2 . 3_666 3.4108(2) ?
Yb2 Pd . . 2.9712(6) ?
Yb2 Pd . 2_555 2.9712(6) ?
Yb2 Pd . 3_555 2.9712(5) ?
Yb2 Pd . 4_555 2.9712(6) ?
Yb2 Pd . 5_555 2.9712(6) ?
Yb2 Pd . 6_555 2.9712(5) ?
Yb2 Al1 . 1_554 3.5210(12) ?
Yb2 Al1 . . 3.5210(12) ?
Yb2 Al1 . 2_554 3.5210(12) ?
Yb2 Al1 . 2_555 3.5210(12) ?
Yb2 Al1 . 3_554 3.5210(9) ?
Yb2 Al1 . 3_555 3.5210(9) ?
Yb2 Al1 . 4_554 3.5210(12) ?
Yb2 Al1 . 4_555 3.5210(12) ?
Yb2 Al1 . 5_554 3.5210(12) ?
Yb2 Al1 . 5_555 3.5210(12) ?
Yb2 Al1 . 6_554 3.5210(9) ?
Yb2 Al1 . 6_555 3.5210(9) ?
Pd Pd . 5_555 2.9712(7) ?
Pd Pd . 6_555 2.9712(7) ?
Pd Al1 . 2_554 2.5930(3) ?
Pd Al1 . 2_555 2.5930(3) ?
Pd Al1 . 6_554 2.5930(11) ?
Pd Al1 . 6_555 2.5930(11) ?
Pd Al2 . 2_555 2.5454(4) ?
Pd Al2 . 3_665 2.5454(5) ?
Al1 Al1 . 4_655 3.644(2) ?
Al1 Al1 . 5_555 2.8179(11) ?
Al1 Al1 . 6_555 2.8179(18) ?
Al1 Al2 . . 2.7888(10) ?
Al1 Al2 . 1_556 2.7888(10) ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
Pd Yb1 Pd . . 1_556 82.988(9) ?
Pd Yb1 Pd . . 2_665 80.884(8) ?
Pd Yb1 Pd . . 2_666 136.011(11) ?
Pd Yb1 Pd . . 3_565 80.884(8) ?
Pd Yb1 Pd . . 3_566 136.012(8) ?
Pd Yb1 Al1 . . 1_565 128.268(13) ?
Pd Yb1 Al1 . . 2_555 47.585(10) ?
Pd Yb1 Al1 . . 3_665 93.162(18) ?
Pd Yb1 Al1 . . 4_665 128.268(12) ?
Pd Yb1 Al1 . . 5_565 93.162(17) ?
Pd Yb1 Al1 . . 6_555 47.585(12) ?
Pd Yb1 Al2 . . 1_565 100.267(8) ?
Pd Yb1 Al2 . . 1_566 176.745(4) ?
Pd Yb1 Al2 . . 2_555 45.233(6) ?
Pd Yb1 Al2 . . 2_556 96.657(7) ?
Pd Yb1 Al2 . . 3_665 45.232(6) ?
Pd Yb1 Al2 . . 3_666 96.657(8) ?
Pd Yb1 Pd 1_556 . 2_665 136.011(11) ?
Pd Yb1 Pd 1_556 . 2_666 80.884(8) ?
Pd Yb1 Pd 1_556 . 3_565 136.012(8) ?
Pd Yb1 Pd 1_556 . 3_566 80.884(8) ?
Pd Yb1 Al1 1_556 . 1_565 128.268(13) ?
Pd Yb1 Al1 1_556 . 2_555 47.585(10) ?
Pd Yb1 Al1 1_556 . 3_665 93.162(18) ?
Pd Yb1 Al1 1_556 . 4_665 128.268(12) ?
Pd Yb1 Al1 1_556 . 5_565 93.162(17) ?
Pd Yb1 Al1 1_556 . 6_555 47.585(12) ?
Pd Yb1 Al2 1_556 . 1_565 176.745(4) ?
Pd Yb1 Al2 1_556 . 1_566 100.267(8) ?
Pd Yb1 Al2 1_556 . 2_555 96.657(7) ?
Pd Yb1 Al2 1_556 . 2_556 45.233(6) ?
Pd Yb1 Al2 1_556 . 3_665 96.657(8) ?
Pd Yb1 Al2 1_556 . 3_666 45.232(6) ?
Pd Yb1 Pd 2_665 . 2_666 82.988(9) ?
Pd Yb1 Pd 2_665 . 3_565 80.884(11) ?
Pd Yb1 Pd 2_665 . 3_566 136.012(9) ?
Pd Yb1 Al1 2_665 . 1_565 93.162(18) ?
Pd Yb1 Al1 2_665 . 2_555 128.268(13) ?
Pd Yb1 Al1 2_665 . 3_665 47.585(13) ?
Pd Yb1 Al1 2_665 . 4_665 47.585(11) ?
Pd Yb1 Al1 2_665 . 5_565 128.268(14) ?
Pd Yb1 Al1 2_665 . 6_555 93.162(19) ?
Pd Yb1 Al2 2_665 . 1_565 45.232(9) ?
Pd Yb1 Al2 2_665 . 1_566 96.657(8) ?
Pd Yb1 Al2 2_665 . 2_555 100.267(8) ?
Pd Yb1 Al2 2_665 . 2_556 176.745(4) ?
Pd Yb1 Al2 2_665 . 3_665 45.233(9) ?
Pd Yb1 Al2 2_665 . 3_666 96.657(9) ?
Pd Yb1 Pd 2_666 . 3_565 136.012(9) ?
Pd Yb1 Pd 2_666 . 3_566 80.884(11) ?
Pd Yb1 Al1 2_666 . 1_565 93.162(18) ?
Pd Yb1 Al1 2_666 . 2_555 128.268(13) ?
Pd Yb1 Al1 2_666 . 3_665 47.585(13) ?
Pd Yb1 Al1 2_666 . 4_665 47.585(11) ?
Pd Yb1 Al1 2_666 . 5_565 128.268(14) ?
Pd Yb1 Al1 2_666 . 6_555 93.162(19) ?
Pd Yb1 Al2 2_666 . 1_565 96.657(8) ?
Pd Yb1 Al2 2_666 . 1_566 45.232(9) ?
Pd Yb1 Al2 2_666 . 2_555 176.745(4) ?
Pd Yb1 Al2 2_666 . 2_556 100.267(8) ?
Pd Yb1 Al2 2_666 . 3_665 96.657(9) ?
Pd Yb1 Al2 2_666 . 3_666 45.233(9) ?
Pd Yb1 Pd 3_565 . 3_566 82.988(8) ?
Pd Yb1 Al1 3_565 . 1_565 47.585(10) ?
Pd Yb1 Al1 3_565 . 2_555 93.162(17) ?
Pd Yb1 Al1 3_565 . 3_665 128.268(14) ?
Pd Yb1 Al1 3_565 . 4_665 93.162(17) ?
Pd Yb1 Al1 3_565 . 5_565 47.585(11) ?
Pd Yb1 Al1 3_565 . 6_555 128.268(13) ?
Pd Yb1 Al2 3_565 . 1_565 45.233(7) ?
Pd Yb1 Al2 3_565 . 1_566 96.657(6) ?
Pd Yb1 Al2 3_565 . 2_555 45.232(5) ?
Pd Yb1 Al2 3_565 . 2_556 96.657(8) ?
Pd Yb1 Al2 3_565 . 3_665 100.267(7) ?
Pd Yb1 Al2 3_565 . 3_666 176.745(5) ?
Pd Yb1 Al1 3_566 . 1_565 47.585(10) ?
Pd Yb1 Al1 3_566 . 2_555 93.162(17) ?
Pd Yb1 Al1 3_566 . 3_665 128.268(14) ?
Pd Yb1 Al1 3_566 . 4_665 93.162(17) ?
Pd Yb1 Al1 3_566 . 5_565 47.585(11) ?
Pd Yb1 Al1 3_566 . 6_555 128.268(13) ?
Pd Yb1 Al2 3_566 . 1_565 96.657(6) ?
Pd Yb1 Al2 3_566 . 1_566 45.233(7) ?
Pd Yb1 Al2 3_566 . 2_555 96.657(8) ?
Pd Yb1 Al2 3_566 . 2_556 45.232(5) ?
Pd Yb1 Al2 3_566 . 3_665 176.745(5) ?
Pd Yb1 Al2 3_566 . 3_666 100.267(7) ?
Al1 Yb1 Al1 1_565 . 2_555 120.00(3) ?
Al1 Yb1 Al1 1_565 . 3_665 120.00(3) ?
Al1 Yb1 Al1 1_565 . 4_665 68.45(3) ?
Al1 Yb1 Al1 1_565 . 5_565 51.55(3) ?
Al1 Yb1 Al1 1_565 . 6_555 171.55(3) ?
Al1 Yb1 Al2 1_565 . 1_565 49.501(13) ?
Al1 Yb1 Al2 1_565 . 1_566 49.501(13) ?
Al1 Yb1 Al2 1_565 . 2_555 86.684(17) ?
Al1 Yb1 Al2 1_565 . 2_556 86.684(17) ?
Al1 Yb1 Al2 1_565 . 3_665 135.014(10) ?
Al1 Yb1 Al2 1_565 . 3_666 135.014(10) ?
Al1 Yb1 Al1 2_555 . 3_665 120.00(3) ?
Al1 Yb1 Al1 2_555 . 4_665 171.55(3) ?
Al1 Yb1 Al1 2_555 . 5_565 68.45(3) ?
Al1 Yb1 Al1 2_555 . 6_555 51.55(3) ?
Al1 Yb1 Al2 2_555 . 1_565 135.014(11) ?
Al1 Yb1 Al2 2_555 . 1_566 135.014(11) ?
Al1 Yb1 Al2 2_555 . 2_555 49.501(13) ?
Al1 Yb1 Al2 2_555 . 2_556 49.501(13) ?
Al1 Yb1 Al2 2_555 . 3_665 86.684(17) ?
Al1 Yb1 Al2 2_555 . 3_666 86.684(17) ?
Al1 Yb1 Al1 3_665 . 4_665 51.55(3) ?
Al1 Yb1 Al1 3_665 . 5_565 171.55(3) ?
Al1 Yb1 Al1 3_665 . 6_555 68.45(3) ?
Al1 Yb1 Al2 3_665 . 1_565 86.684(18) ?
Al1 Yb1 Al2 3_665 . 1_566 86.684(18) ?
Al1 Yb1 Al2 3_665 . 2_555 135.014(11) ?
Al1 Yb1 Al2 3_665 . 2_556 135.014(11) ?
Al1 Yb1 Al2 3_665 . 3_665 49.501(13) ?
Al1 Yb1 Al2 3_665 . 3_666 49.501(13) ?
Al1 Yb1 Al1 4_665 . 5_565 120.00(3) ?
Al1 Yb1 Al1 4_665 . 6_555 120.00(3) ?
Al1 Yb1 Al2 4_665 . 1_565 49.501(13) ?
Al1 Yb1 Al2 4_665 . 1_566 49.501(13) ?
Al1 Yb1 Al2 4_665 . 2_555 135.014(11) ?
Al1 Yb1 Al2 4_665 . 2_556 135.014(11) ?
Al1 Yb1 Al2 4_665 . 3_665 86.684(17) ?
Al1 Yb1 Al2 4_665 . 3_666 86.684(17) ?
Al1 Yb1 Al1 5_565 . 6_555 120.00(3) ?
Al1 Yb1 Al2 5_565 . 1_565 86.684(17) ?
Al1 Yb1 Al2 5_565 . 1_566 86.684(17) ?
Al1 Yb1 Al2 5_565 . 2_555 49.501(13) ?
Al1 Yb1 Al2 5_565 . 2_556 49.501(13) ?
Al1 Yb1 Al2 5_565 . 3_665 135.014(10) ?
Al1 Yb1 Al2 5_565 . 3_666 135.014(10) ?
Al1 Yb1 Al2 6_555 . 1_565 135.014(11) ?
Al1 Yb1 Al2 6_555 . 1_566 135.014(11) ?
Al1 Yb1 Al2 6_555 . 2_555 86.684(18) ?
Al1 Yb1 Al2 6_555 . 2_556 86.684(18) ?
Al1 Yb1 Al2 6_555 . 3_665 49.501(13) ?
Al1 Yb1 Al2 6_555 . 3_666 49.501(13) ?
Al2 Yb1 Al2 1_565 . 1_566 76.478(6) ?
Al2 Yb1 Al2 1_565 . 2_555 85.720(6) ?
Al2 Yb1 Al2 1_565 . 2_556 133.753(3) ?
Al2 Yb1 Al2 1_565 . 3_665 85.719(5) ?
Al2 Yb1 Al2 1_565 . 3_666 133.753(4) ?
Al2 Yb1 Al2 1_566 . 2_555 133.753(3) ?
Al2 Yb1 Al2 1_566 . 2_556 85.720(6) ?
Al2 Yb1 Al2 1_566 . 3_665 133.753(4) ?
Al2 Yb1 Al2 1_566 . 3_666 85.719(5) ?
Al2 Yb1 Al2 2_555 . 2_556 76.478(6) ?
Al2 Yb1 Al2 2_555 . 3_665 85.719(5) ?
Al2 Yb1 Al2 2_555 . 3_666 133.753(4) ?
Al2 Yb1 Al2 2_556 . 3_665 133.753(4) ?
Al2 Yb1 Al2 2_556 . 3_666 85.719(5) ?
Al2 Yb1 Al2 3_665 . 3_666 76.478(4) ?
Pd Yb2 Pd . . 2_555 120.000(11) ?
Pd Yb2 Pd . . 3_555 120.000(9) ?
Pd Yb2 Pd . . 4_555 180.0(5) ?
Pd Yb2 Pd . . 5_555 60.000(11) ?
Pd Yb2 Pd . . 6_555 60.000(9) ?
Pd Yb2 Al1 . . 1_554 90.000(6) ?
Pd Yb2 Al1 . . . 90.000(6) ?
Pd Yb2 Al1 . . 2_554 46.124(11) ?
Pd Yb2 Al1 . . 2_555 46.124(11) ?
Pd Yb2 Al1 . . 3_554 133.88(2) ?
Pd Yb2 Al1 . . 3_555 133.88(2) ?
Pd Yb2 Al1 . . 4_554 90.000(6) ?
Pd Yb2 Al1 . . 4_555 90.000(6) ?
Pd Yb2 Al1 . . 5_554 133.876(11) ?
Pd Yb2 Al1 . . 5_555 133.876(11) ?
Pd Yb2 Al1 . . 6_554 46.12(2) ?
Pd Yb2 Al1 . . 6_555 46.12(2) ?
Pd Yb2 Pd 2_555 . 3_555 120.000(12) ?
Pd Yb2 Pd 2_555 . 4_555 60.000(11) ?
Pd Yb2 Pd 2_555 . 5_555 180.0(5) ?
Pd Yb2 Pd 2_555 . 6_555 60.000(12) ?
Pd Yb2 Al1 2_555 . 1_554 133.876(12) ?
Pd Yb2 Al1 2_555 . . 133.876(12) ?
Pd Yb2 Al1 2_555 . 2_554 90.000(8) ?
Pd Yb2 Al1 2_555 . 2_555 90.000(8) ?
Pd Yb2 Al1 2_555 . 3_554 46.12(2) ?
Pd Yb2 Al1 2_555 . 3_555 46.12(2) ?
Pd Yb2 Al1 2_555 . 4_554 46.124(12) ?
Pd Yb2 Al1 2_555 . 4_555 46.124(12) ?
Pd Yb2 Al1 2_555 . 5_554 90.000(8) ?
Pd Yb2 Al1 2_555 . 5_555 90.000(8) ?
Pd Yb2 Al1 2_555 . 6_554 133.88(2) ?
Pd Yb2 Al1 2_555 . 6_555 133.88(2) ?
Pd Yb2 Pd 3_555 . 4_555 60.000(9) ?
Pd Yb2 Pd 3_555 . 5_555 60.000(12) ?
Pd Yb2 Pd 3_555 . 6_555 180.0(5) ?
Pd Yb2 Al1 3_555 . 1_554 46.124(11) ?
Pd Yb2 Al1 3_555 . . 46.124(11) ?
Pd Yb2 Al1 3_555 . 2_554 133.876(11) ?
Pd Yb2 Al1 3_555 . 2_555 133.876(11) ?
Pd Yb2 Al1 3_555 . 3_554 90.00(3) ?
Pd Yb2 Al1 3_555 . 3_555 90.00(3) ?
Pd Yb2 Al1 3_555 . 4_554 133.876(11) ?
Pd Yb2 Al1 3_555 . 4_555 133.876(11) ?
Pd Yb2 Al1 3_555 . 5_554 46.124(11) ?
Pd Yb2 Al1 3_555 . 5_555 46.124(11) ?
Pd Yb2 Al1 3_555 . 6_554 90.00(3) ?
Pd Yb2 Al1 3_555 . 6_555 90.00(3) ?
Pd Yb2 Pd 4_555 . 5_555 120.000(11) ?
Pd Yb2 Pd 4_555 . 6_555 120.000(9) ?
Pd Yb2 Al1 4_555 . 1_554 90.000(6) ?
Pd Yb2 Al1 4_555 . . 90.000(6) ?
Pd Yb2 Al1 4_555 . 2_554 133.876(11) ?
Pd Yb2 Al1 4_555 . 2_555 133.876(11) ?
Pd Yb2 Al1 4_555 . 3_554 46.12(2) ?
Pd Yb2 Al1 4_555 . 3_555 46.12(2) ?
Pd Yb2 Al1 4_555 . 4_554 90.000(6) ?
Pd Yb2 Al1 4_555 . 4_555 90.000(6) ?
Pd Yb2 Al1 4_555 . 5_554 46.124(11) ?
Pd Yb2 Al1 4_555 . 5_555 46.124(11) ?
Pd Yb2 Al1 4_555 . 6_554 133.88(2) ?
Pd Yb2 Al1 4_555 . 6_555 133.88(2) ?
Pd Yb2 Pd 5_555 . 6_555 120.000(12) ?
Pd Yb2 Al1 5_555 . 1_554 46.124(12) ?
Pd Yb2 Al1 5_555 . . 46.124(12) ?
Pd Yb2 Al1 5_555 . 2_554 90.000(8) ?
Pd Yb2 Al1 5_555 . 2_555 90.000(8) ?
Pd Yb2 Al1 5_555 . 3_554 133.88(2) ?
Pd Yb2 Al1 5_555 . 3_555 133.88(2) ?
Pd Yb2 Al1 5_555 . 4_554 133.876(12) ?
Pd Yb2 Al1 5_555 . 4_555 133.876(12) ?
Pd Yb2 Al1 5_555 . 5_554 90.000(8) ?
Pd Yb2 Al1 5_555 . 5_555 90.000(8) ?
Pd Yb2 Al1 5_555 . 6_554 46.12(2) ?
Pd Yb2 Al1 5_555 . 6_555 46.12(2) ?
Pd Yb2 Al1 6_555 . 1_554 133.876(11) ?
Pd Yb2 Al1 6_555 . . 133.876(11) ?
Pd Yb2 Al1 6_555 . 2_554 46.124(11) ?
Pd Yb2 Al1 6_555 . 2_555 46.124(11) ?
Pd Yb2 Al1 6_555 . 3_554 90.00(3) ?
Pd Yb2 Al1 6_555 . 3_555 90.00(3) ?
Pd Yb2 Al1 6_555 . 4_554 46.124(11) ?
Pd Yb2 Al1 6_555 . 4_555 46.124(11) ?
Pd Yb2 Al1 6_555 . 5_554 133.876(11) ?
Pd Yb2 Al1 6_555 . 5_555 133.876(11) ?
Pd Yb2 Al1 6_555 . 6_554 90.00(3) ?
Pd Yb2 Al1 6_555 . 6_555 90.00(3) ?
Al1 Yb2 Al1 1_554 . . 73.68(2) ?
Al1 Yb2 Al1 1_554 . 2_554 87.751(14) ?
Al1 Yb2 Al1 1_554 . 2_555 132.824(8) ?
Al1 Yb2 Al1 1_554 . 3_554 87.75(2) ?
Al1 Yb2 Al1 1_554 . 3_555 132.82(3) ?
Al1 Yb2 Al1 1_554 . 4_554 106.32(2) ?
Al1 Yb2 Al1 1_554 . 4_555 180.0(5) ?
Al1 Yb2 Al1 1_554 . 5_554 47.176(8) ?
Al1 Yb2 Al1 1_554 . 5_555 92.249(14) ?
Al1 Yb2 Al1 1_554 . 6_554 47.18(3) ?
Al1 Yb2 Al1 1_554 . 6_555 92.25(2) ?
Al1 Yb2 Al1 . . 2_554 132.824(8) ?
Al1 Yb2 Al1 . . 2_555 87.751(14) ?
Al1 Yb2 Al1 . . 3_554 132.82(3) ?
Al1 Yb2 Al1 . . 3_555 87.75(2) ?
Al1 Yb2 Al1 . . 4_554 180.0(5) ?
Al1 Yb2 Al1 . . 4_555 106.32(2) ?
Al1 Yb2 Al1 . . 5_554 92.249(14) ?
Al1 Yb2 Al1 . . 5_555 47.176(8) ?
Al1 Yb2 Al1 . . 6_554 92.25(2) ?
Al1 Yb2 Al1 . . 6_555 47.18(3) ?
Al1 Yb2 Al1 2_554 . 2_555 73.68(2) ?
Al1 Yb2 Al1 2_554 . 3_554 87.75(2) ?
Al1 Yb2 Al1 2_554 . 3_555 132.82(3) ?
Al1 Yb2 Al1 2_554 . 4_554 47.176(8) ?
Al1 Yb2 Al1 2_554 . 4_555 92.249(14) ?
Al1 Yb2 Al1 2_554 . 5_554 106.32(2) ?
Al1 Yb2 Al1 2_554 . 5_555 180.0(5) ?
Al1 Yb2 Al1 2_554 . 6_554 47.18(3) ?
Al1 Yb2 Al1 2_554 . 6_555 92.25(2) ?
Al1 Yb2 Al1 2_555 . 3_554 132.82(3) ?
Al1 Yb2 Al1 2_555 . 3_555 87.75(2) ?
Al1 Yb2 Al1 2_555 . 4_554 92.249(14) ?
Al1 Yb2 Al1 2_555 . 4_555 47.176(8) ?
Al1 Yb2 Al1 2_555 . 5_554 180.0(5) ?
Al1 Yb2 Al1 2_555 . 5_555 106.32(2) ?
Al1 Yb2 Al1 2_555 . 6_554 92.25(2) ?
Al1 Yb2 Al1 2_555 . 6_555 47.18(3) ?
Al1 Yb2 Al1 3_554 . 3_555 73.679(15) ?
Al1 Yb2 Al1 3_554 . 4_554 47.18(3) ?
Al1 Yb2 Al1 3_554 . 4_555 92.25(2) ?
Al1 Yb2 Al1 3_554 . 5_554 47.18(3) ?
Al1 Yb2 Al1 3_554 . 5_555 92.25(2) ?
Al1 Yb2 Al1 3_554 . 6_554 106.321(15) ?
Al1 Yb2 Al1 3_554 . 6_555 180.0(5) ?
Al1 Yb2 Al1 3_555 . 4_554 92.25(2) ?
Al1 Yb2 Al1 3_555 . 4_555 47.18(3) ?
Al1 Yb2 Al1 3_555 . 5_554 92.25(2) ?
Al1 Yb2 Al1 3_555 . 5_555 47.18(3) ?
Al1 Yb2 Al1 3_555 . 6_554 180.0(5) ?
Al1 Yb2 Al1 3_555 . 6_555 106.321(15) ?
Al1 Yb2 Al1 4_554 . 4_555 73.68(2) ?
Al1 Yb2 Al1 4_554 . 5_554 87.751(14) ?
Al1 Yb2 Al1 4_554 . 5_555 132.824(8) ?
Al1 Yb2 Al1 4_554 . 6_554 87.75(2) ?
Al1 Yb2 Al1 4_554 . 6_555 132.82(3) ?
Al1 Yb2 Al1 4_555 . 5_554 132.824(8) ?
Al1 Yb2 Al1 4_555 . 5_555 87.751(14) ?
Al1 Yb2 Al1 4_555 . 6_554 132.82(3) ?
Al1 Yb2 Al1 4_555 . 6_555 87.75(2) ?
Al1 Yb2 Al1 5_554 . 5_555 73.68(2) ?
Al1 Yb2 Al1 5_554 . 6_554 87.75(2) ?
Al1 Yb2 Al1 5_554 . 6_555 132.82(3) ?
Al1 Yb2 Al1 5_555 . 6_554 132.82(3) ?
Al1 Yb2 Al1 5_555 . 6_555 87.75(2) ?
Al1 Yb2 Al1 6_554 . 6_555 73.679(15) ?
Yb1 Pd Yb1 1_554 . . 82.988(10) ?
Yb1 Pd Yb2 1_554 . . 138.506(5) ?
Yb1 Pd Pd 1_554 . 5_555 111.994(8) ?
Yb1 Pd Pd 1_554 . 6_555 111.994(10) ?
Yb1 Pd Al1 1_554 . 2_554 67.29(2) ?
Yb1 Pd Al1 1_554 . 2_555 133.85(3) ?
Yb1 Pd Al1 1_554 . 6_554 67.29(3) ?
Yb1 Pd Al1 1_554 . 6_555 133.85(2) ?
Yb1 Pd Al2 1_554 . 2_555 72.052(9) ?
Yb1 Pd Al2 1_554 . 3_665 72.052(6) ?
Yb1 Pd Yb2 . . . 138.506(5) ?
Yb1 Pd Pd . . 5_555 111.994(8) ?
Yb1 Pd Pd . . 6_555 111.994(10) ?
Yb1 Pd Al1 . . 2_554 133.85(3) ?
Yb1 Pd Al1 . . 2_555 67.29(2) ?
Yb1 Pd Al1 . . 6_554 133.85(2) ?
Yb1 Pd Al1 . . 6_555 67.29(3) ?
Yb1 Pd Al2 . . 2_555 72.052(9) ?
Yb1 Pd Al2 . . 3_665 72.052(6) ?
Yb2 Pd Pd . . 5_555 60.000(11) ?
Yb2 Pd Pd . . 6_555 60.000(8) ?
Yb2 Pd Al1 . . 2_554 78.19(3) ?
Yb2 Pd Al1 . . 2_555 78.19(3) ?
Yb2 Pd Al1 . . 6_554 78.19(3) ?
Yb2 Pd Al1 . . 6_555 78.19(3) ?
Yb2 Pd Al2 . . 2_555 114.293(8) ?
Yb2 Pd Al2 . . 3_665 114.293(14) ?
Pd Pd Pd 5_555 . 6_555 120.000(15) ?
Pd Pd Al1 5_555 . 2_554 111.60(3) ?
Pd Pd Al1 5_555 . 2_555 111.60(3) ?
Pd Pd Al1 5_555 . 6_554 55.05(3) ?
Pd Pd Al1 5_555 . 6_555 55.05(3) ?
Pd Pd Al2 5_555 . 2_555 174.293(11) ?
Pd Pd Al2 5_555 . 3_665 54.293(10) ?
Pd Pd Al1 6_555 . 2_554 55.045(5) ?
Pd Pd Al1 6_555 . 2_555 55.045(5) ?
Pd Pd Al1 6_555 . 6_554 111.60(2) ?
Pd Pd Al1 6_555 . 6_555 111.60(2) ?
Pd Pd Al2 6_555 . 2_555 54.293(9) ?
Pd Pd Al2 6_555 . 3_665 174.293(18) ?
Al1 Pd Al1 2_554 . 2_555 109.007(11) ?
Al1 Pd Al1 2_554 . 6_554 65.83(3) ?
Al1 Pd Al1 2_554 . 6_555 156.37(4) ?
Al1 Pd Al2 2_554 . 2_555 65.73(3) ?
Al1 Pd Al2 2_554 . 3_665 125.414(5) ?
Al1 Pd Al1 2_555 . 6_554 156.37(4) ?
Al1 Pd Al1 2_555 . 6_555 65.83(3) ?
Al1 Pd Al2 2_555 . 2_555 65.73(3) ?
Al1 Pd Al2 2_555 . 3_665 125.414(5) ?
Al1 Pd Al1 6_554 . 6_555 109.01(5) ?
Al1 Pd Al2 6_554 . 2_555 125.41(3) ?
Al1 Pd Al2 6_554 . 3_665 65.73(2) ?
Al1 Pd Al2 6_555 . 2_555 125.41(3) ?
Al1 Pd Al2 6_555 . 3_665 65.73(2) ?
Al2 Pd Al2 2_555 . 3_665 131.414(15) ?
Yb1 Al1 Yb1 1_545 . 4_665 111.55(4) ?
Yb1 Al1 Yb2 1_545 . . 116.751(11) ?
Yb1 Al1 Yb2 1_545 . 1_556 116.751(11) ?
Yb1 Al1 Pd 1_545 . 3_555 65.124(14) ?
Yb1 Al1 Pd 1_545 . 3_556 65.124(14) ?
Yb1 Al1 Pd 1_545 . 5_555 121.79(3) ?
Yb1 Al1 Pd 1_545 . 5_556 121.79(3) ?
Yb1 Al1 Al1 1_545 . 4_655 55.78(2) ?
Yb1 Al1 Al1 1_545 . 5_555 64.22(3) ?
Yb1 Al1 Al1 1_545 . 6_555 175.78(5) ?
Yb1 Al1 Al2 1_545 . . 68.44(2) ?
Yb1 Al1 Al2 1_545 . 1_556 68.44(2) ?
Yb1 Al1 Yb2 4_665 . . 116.751(11) ?
Yb1 Al1 Yb2 4_665 . 1_556 116.751(11) ?
Yb1 Al1 Pd 4_665 . 3_555 121.79(3) ?
Yb1 Al1 Pd 4_665 . 3_556 121.79(3) ?
Yb1 Al1 Pd 4_665 . 5_555 65.124(14) ?
Yb1 Al1 Pd 4_665 . 5_556 65.124(14) ?
Yb1 Al1 Al1 4_665 . 4_655 55.78(2) ?
Yb1 Al1 Al1 4_665 . 5_555 175.78(5) ?
Yb1 Al1 Al1 4_665 . 6_555 64.22(3) ?
Yb1 Al1 Al2 4_665 . . 68.44(2) ?
Yb1 Al1 Al2 4_665 . 1_556 68.44(2) ?
Yb2 Al1 Yb2 . . 1_556 73.68(3) ?
Yb2 Al1 Pd . . 3_555 55.69(2) ?
Yb2 Al1 Pd . . 3_556 114.37(4) ?
Yb2 Al1 Pd . . 5_555 55.69(2) ?
Yb2 Al1 Pd . . 5_556 114.37(4) ?
Yb2 Al1 Al1 . . 4_655 143.160(14) ?
Yb2 Al1 Al1 . . 5_555 66.41(3) ?
Yb2 Al1 Al1 . . 6_555 66.41(3) ?
Yb2 Al1 Al2 . . . 93.960(10) ?
Yb2 Al1 Al2 . . 1_556 167.64(4) ?
Yb2 Al1 Pd 1_556 . 3_555 114.37(4) ?
Yb2 Al1 Pd 1_556 . 3_556 55.69(2) ?
Yb2 Al1 Pd 1_556 . 5_555 114.37(4) ?
Yb2 Al1 Pd 1_556 . 5_556 55.69(2) ?
Yb2 Al1 Al1 1_556 . 4_655 143.160(14) ?
Yb2 Al1 Al1 1_556 . 5_555 66.41(3) ?
Yb2 Al1 Al1 1_556 . 6_555 66.41(3) ?
Yb2 Al1 Al2 1_556 . . 167.64(4) ?
Yb2 Al1 Al2 1_556 . 1_556 93.960(10) ?
Pd Al1 Pd 3_555 . 3_556 109.007(11) ?
Pd Al1 Pd 3_555 . 5_555 69.910(10) ?
Pd Al1 Pd 3_555 . 5_556 169.17(6) ?
Pd Al1 Al1 3_555 . 4_655 95.42(3) ?
Pd Al1 Al1 3_555 . 5_555 57.087(14) ?
Pd Al1 Al1 3_555 . 6_555 116.68(3) ?
Pd Al1 Al2 3_555 . . 56.314(14) ?
Pd Al1 Al2 3_555 . 1_556 132.69(4) ?
Pd Al1 Pd 3_556 . 5_555 169.17(6) ?
Pd Al1 Pd 3_556 . 5_556 69.910(10) ?
Pd Al1 Al1 3_556 . 4_655 95.42(3) ?
Pd Al1 Al1 3_556 . 5_555 57.087(14) ?
Pd Al1 Al1 3_556 . 6_555 116.68(3) ?
Pd Al1 Al2 3_556 . . 132.69(4) ?
Pd Al1 Al2 3_556 . 1_556 56.314(14) ?
Pd Al1 Pd 5_555 . 5_556 109.007(15) ?
Pd Al1 Al1 5_555 . 4_655 95.42(3) ?
Pd Al1 Al1 5_555 . 5_555 116.68(3) ?
Pd Al1 Al1 5_555 . 6_555 57.087(16) ?
Pd Al1 Al2 5_555 . . 56.314(15) ?
Pd Al1 Al2 5_555 . 1_556 132.69(4) ?
Pd Al1 Al1 5_556 . 4_655 95.42(3) ?
Pd Al1 Al1 5_556 . 5_555 116.68(3) ?
Pd Al1 Al1 5_556 . 6_555 57.087(16) ?
Pd Al1 Al2 5_556 . . 132.69(4) ?
Pd Al1 Al2 5_556 . 1_556 56.314(15) ?
Al1 Al1 Al1 4_655 . 5_555 120.00(4) ?
Al1 Al1 Al1 4_655 . 6_555 120.00(4) ?
Al1 Al1 Al2 4_655 . . 49.20(2) ?
Al1 Al1 Al2 4_655 . 1_556 49.20(2) ?
Al1 Al1 Al1 5_555 . 6_555 120.00(6) ?
Al1 Al1 Al2 5_555 . . 109.069(17) ?
Al1 Al1 Al2 5_555 . 1_556 109.069(17) ?
Al1 Al1 Al2 6_555 . . 109.069(16) ?
Al1 Al1 Al2 6_555 . 1_556 109.069(16) ?
Al2 Al1 Al2 . . 1_556 98.40(4) ?
Yb1 Al2 Yb1 1_544 . 1_545 76.478(6) ?
Yb1 Al2 Yb1 1_544 . 4_664 103.522(6) ?
Yb1 Al2 Yb1 1_544 . 4_665 180.0(5) ?
Yb1 Al2 Pd 1_544 . 2_655 62.715(6) ?
Yb1 Al2 Pd 1_544 . 3_555 62.715(6) ?
Yb1 Al2 Pd 1_544 . 5_555 117.285(6) ?
Yb1 Al2 Pd 1_544 . 6_655 117.285(6) ?
Yb1 Al2 Al1 1_544 . 1_554 62.060(11) ?
Yb1 Al2 Al1 1_544 . . 117.940(11) ?
Yb1 Al2 Al1 1_544 . 4_654 62.060(11) ?
Yb1 Al2 Al1 1_544 . 4_655 117.940(11) ?
Yb1 Al2 Yb1 1_545 . 4_664 180.0(5) ?
Yb1 Al2 Yb1 1_545 . 4_665 103.522(6) ?
Yb1 Al2 Pd 1_545 . 2_655 62.715(6) ?
Yb1 Al2 Pd 1_545 . 3_555 62.715(6) ?
Yb1 Al2 Pd 1_545 . 5_555 117.285(6) ?
Yb1 Al2 Pd 1_545 . 6_655 117.285(6) ?
Yb1 Al2 Al1 1_545 . 1_554 117.940(11) ?
Yb1 Al2 Al1 1_545 . . 62.060(11) ?
Yb1 Al2 Al1 1_545 . 4_654 117.940(11) ?
Yb1 Al2 Al1 1_545 . 4_655 62.060(11) ?
Yb1 Al2 Yb1 4_664 . 4_665 76.478(6) ?
Yb1 Al2 Pd 4_664 . 2_655 117.285(6) ?
Yb1 Al2 Pd 4_664 . 3_555 117.285(6) ?
Yb1 Al2 Pd 4_664 . 5_555 62.715(6) ?
Yb1 Al2 Pd 4_664 . 6_655 62.715(6) ?
Yb1 Al2 Al1 4_664 . 1_554 62.060(11) ?
Yb1 Al2 Al1 4_664 . . 117.940(11) ?
Yb1 Al2 Al1 4_664 . 4_654 62.060(11) ?
Yb1 Al2 Al1 4_664 . 4_655 117.940(11) ?
Yb1 Al2 Pd 4_665 . 2_655 117.285(6) ?
Yb1 Al2 Pd 4_665 . 3_555 117.285(6) ?
Yb1 Al2 Pd 4_665 . 5_555 62.715(6) ?
Yb1 Al2 Pd 4_665 . 6_655 62.715(6) ?
Yb1 Al2 Al1 4_665 . 1_554 117.940(11) ?
Yb1 Al2 Al1 4_665 . . 62.060(11) ?
Yb1 Al2 Al1 4_665 . 4_654 117.940(11) ?
Yb1 Al2 Al1 4_665 . 4_655 62.060(11) ?
Pd Al2 Pd 2_655 . 3_555 108.586(11) ?
Pd Al2 Pd 2_655 . 5_555 180.0(5) ?
Pd Al2 Pd 2_655 . 6_655 71.414(11) ?
Pd Al2 Al1 2_655 . 1_554 122.044(16) ?
Pd Al2 Al1 2_655 . . 122.044(16) ?
Pd Al2 Al1 2_655 . 4_654 57.956(16) ?
Pd Al2 Al1 2_655 . 4_655 57.956(16) ?
Pd Al2 Pd 3_555 . 5_555 71.414(11) ?
Pd Al2 Pd 3_555 . 6_655 180.0(5) ?
Pd Al2 Al1 3_555 . 1_554 57.956(17) ?
Pd Al2 Al1 3_555 . . 57.956(17) ?
Pd Al2 Al1 3_555 . 4_654 122.044(17) ?
Pd Al2 Al1 3_555 . 4_655 122.044(17) ?
Pd Al2 Pd 5_555 . 6_655 108.586(11) ?
Pd Al2 Al1 5_555 . 1_554 57.956(16) ?
Pd Al2 Al1 5_555 . . 57.956(16) ?
Pd Al2 Al1 5_555 . 4_654 122.044(16) ?
Pd Al2 Al1 5_555 . 4_655 122.044(16) ?
Pd Al2 Al1 6_655 . 1_554 122.044(17) ?
Pd Al2 Al1 6_655 . . 122.044(17) ?
Pd Al2 Al1 6_655 . 4_654 57.956(17) ?
Pd Al2 Al1 6_655 . 4_655 57.956(17) ?
Al1 Al2 Al1 1_554 . . 98.40(3) ?
Al1 Al2 Al1 1_554 . 4_654 81.60(3) ?
Al1 Al2 Al1 1_554 . 4_655 180.0(5) ?
Al1 Al2 Al1 . . 4_654 180.0(5) ?
Al1 Al2 Al1 . . 4_655 81.60(3) ?
Al1 Al2 Al1 4_654 . 4_655 98.40(3) ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion
_geom_torsion_publ_flag
? ? ? ? ? ? ? ? ? ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_D
_geom_hbond_site_symmetry_H
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_publ_flag
? ? ? ? ? ? ? ? ? ? ?


####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_I_CCDC7
_database_code_depnum_ccdc_archive 'CCDC 1895369'
loop_
_audit_author_name
_audit_author_address
'Oliver Janka'
;WWU Muenster
Germany
;
_audit_update_record             
;
2019-04-17 deposited with the CCDC.	2019-10-14 downloaded from the CCDC.
;
#=======================================================================

# 5. CHEMICAL DATA

_chemical_name_systematic        
; ?
;
_chemical_name_common            ?
_chemical_formula_moiety         ?
_chemical_formula_structural     ?
_chemical_formula_analytical     ?
_chemical_formula_iupac          ?
_chemical_formula_sum            'Al3 Ca0.656 Pd2 Yb0.344'
_chemical_formula_weight         379.6
_chemical_melting_point          ?
_chemical_compound_source        ?
_chemical_absolute_configuration .

#=======================================================================

# 6. CRYSTAL DATA

_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_H-M   'P 6/m m m'
_symmetry_space_group_name_Hall  '-P 6;-2'
_symmetry_Int_Tables_number      191

loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -y,x-y,z
3 -x+y,-x,z
4 -x,-y,z
5 y,-x+y,z
6 x-y,x,z
7 y,x,-z
8 x-y,-y,-z
9 -x,-x+y,-z
10 -y,-x,-z
11 -x+y,y,-z
12 x,x-y,-z
13 -x,-y,-z
14 y,-x+y,-z
15 x-y,x,-z
16 x,y,-z
17 -y,x-y,-z
18 -x+y,-x,-z
19 -y,-x,z
20 -x+y,y,z
21 x,x-y,z
22 y,x,z
23 x-y,-y,z
24 -x,-x+y,z

_cell_length_a                   9.3321(7)
_cell_length_b                   9.3321(7)
_cell_length_c                   4.2276(3)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_volume                     318.85(4)

loop_
_twin_individual_id
_twin_individual_mass_fraction_refined
_twin_individual_twin_matrix_11
_twin_individual_twin_matrix_12
_twin_individual_twin_matrix_13
_twin_individual_twin_matrix_21
_twin_individual_twin_matrix_22
_twin_individual_twin_matrix_23
_twin_individual_twin_matrix_31
_twin_individual_twin_matrix_32
_twin_individual_twin_matrix_33
? ? ? ? ? ? ? ? ? ? ?

_cell_formula_units_Z            3

_cell_measurement_reflns_used    5049
_cell_measurement_theta_min      4.37
_cell_measurement_theta_max      33.66
_cell_measurement_temperature    293
_cell_special_details            
; ?
;

_exptl_crystal_density_diffrn    5.93
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_F_000             499

_exptl_absorpt_coefficient_mu    17.1
_exptl_crystal_description       block
_exptl_crystal_size_max          0.105
_exptl_crystal_size_mid          0.060
_exptl_crystal_size_min          0.035
_exptl_crystal_size_rad          ?
_exptl_crystal_colour            silver
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   ?
_exptl_absorpt_correction_T_min  0.3842
_exptl_absorpt_correction_T_max  0.6379
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
? ? ? ?

#=======================================================================

# 7. EXPERIMENTAL DATA

_exptl_special_details           ?

_diffrn_ambient_temperature      293
_diffrn_source                   ?
_diffrn_source_power             ?
_diffrn_source_voltage           ?
_diffrn_source_current           ?
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_source         'X-ray tube'
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'IPDS Stoe'
_diffrn_detector                 ?
_diffrn_detector_area_resol_mean ?
_diffrn_measurement_method       '??integration method??'
_diffrn_measurement_specimen_support ?

_diffrn_reflns_number            5168
_diffrn_reflns_theta_min         2.52
_diffrn_reflns_theta_max         33.25
_diffrn_reflns_theta_full        33.25
_diffrn_measured_fraction_theta_max 1
_diffrn_measured_fraction_theta_full 1
_diffrn_reflns_av_R_equivalents  0.0242
_diffrn_reflns_av_unetI/netI     0.0052
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_l_min       -6
_diffrn_reflns_limit_l_max       6
_diffrn_reflns_reduction_process ?

_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
loop_
_diffrn_standard_refln_index_h
_diffrn_standard_refln_index_k
_diffrn_standard_refln_index_l
? ? ?

_diffrn_radiation_probe          X-ray

#=======================================================================

# 8. REFINEMENT DATA

_refine_special_details          
; ?
;

_reflns_number_total             286
_reflns_number_gt                255
_reflns_threshold_expression     I>3σ(I)

_refine_ls_structure_factor_coef Fsqd
_refine_ls_R_factor_gt           0.0096
_refine_ls_wR_factor_gt          0.0221
_refine_ls_R_factor_all          0.0127
_refine_ls_wR_factor_ref         0.0234
_refine_ls_goodness_of_fit_ref   0.90
_refine_ls_goodness_of_fit_gt    0.91
_refine_ls_restrained_S_gt       ?
_refine_ls_restrained_S_all      ?
_refine_ls_number_reflns         286
_refine_ls_number_parameters     19
_refine_ls_number_restraints     0
_refine_ls_number_constraints    4
_refine_ls_weighting_scheme      sigma
_refine_ls_weighting_details     w=1/(σ²(I)+0.0004I²)
_refine_ls_hydrogen_treatment    ?
_refine_ls_shift/su_max          0.0008
_refine_ls_shift/su_mean         0.0002
_refine_diff_density_max         0.47
_refine_diff_density_min         -0.43
_refine_ls_extinction_method     
'B-C type 1 Lorentzian isotropic (Becker & Coppens, 1974)'
_refine_ls_extinction_coef       460(20)
_refine_ls_abs_structure_details ?
_refine_ls_abs_structure_Flack   ?
_refine_ls_abs_structure_Rogers  ?

loop_
_atom_type_symbol
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Al 0.0645 0.0514 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Ca 0.2262 0.3064 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Pd -0.9988 1.0072 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Yb -0.3850 5.5486 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    ?
_computing_structure_refinement  ?
_computing_molecular_graphics    ?
_computing_publication_material  ?

loop_
_restr_distance_atom_site_label_1
_restr_distance_site_symmetry_1
_restr_distance_atom_site_label_2
_restr_distance_site_symmetry_2
_restr_distance_target
_restr_distance_target_weight_param
? ? ? ? ? ?

loop_
_restr_angle_atom_site_label_1
_restr_angle_site_symmetry_1
_restr_angle_atom_site_label_2
_restr_angle_site_symmetry_2
_restr_angle_atom_site_label_3
_restr_angle_site_symmetry_3
_restr_angle_target
_restr_angle_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_torsion_atom_site_label_1
_restr_torsion_site_symmetry_1
_restr_torsion_atom_site_label_2
_restr_torsion_site_symmetry_2
_restr_torsion_atom_site_label_3
_restr_torsion_site_symmetry_3
_restr_torsion_atom_site_label_4
_restr_torsion_site_symmetry_4
_restr_torsion_angle_target
_restr_torsion_weight_param
? ? ? ? ? ? ? ? ? ?

loop_
_restr_equal_distance_atom_site_label_1
_restr_equal_distance_site_symmetry_1
_restr_equal_distance_atom_site_label_2
_restr_equal_distance_site_symmetry_2
_restr_equal_distance_class_class_id
_restr_equal_distance_class_target_weight_param
? ? ? ? ? ?

loop_
_restr_equal_angle_atom_site_label_1
_restr_equal_angle_site_symmetry_1
_restr_equal_angle_atom_site_label_2
_restr_equal_angle_site_symmetry_2
_restr_equal_angle_atom_site_label_3
_restr_equal_angle_site_symmetry_3
_restr_equal_angle_class_class_id
_restr_equal_angle_class_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_equal_torsion_atom_site_label_1
_restr_equal_torsion_site_symmetry_1
_restr_equal_torsion_atom_site_label_2
_restr_equal_torsion_site_symmetry_2
_restr_equal_torsion_atom_site_label_3
_restr_equal_torsion_site_symmetry_3
_restr_equal_torsion_atom_site_label_4
_restr_equal_torsion_site_symmetry_4
_restr_equal_torsion_class_class_id
_restr_equal_torsion_class_target_weight_param
? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 9. ATOMIC COORDINATES AND DISPLACEMENT PARAMETERS

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_adp_type
_atom_site_U_iso_or_equiv
_atom_site_site_symmetry_multiplicity
_atom_site_occupancy
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Yb1 Yb 0.333333 0.666667 0.5 Uani 0.00897(10) 2 0.437(2) d . . .
Ca1 Ca 0.333333 0.666667 0.5 Uani 0.00897(10) 2 0.563(2) d . . .
Yb2 Yb 0 0 0 Uani 0.0118(2) 1 0.157(3) d . . .
Ca2 Ca 0 0 0 Uani 0.0118(2) 1 0.843(3) d . . .
Pd1 Pd 0.184331(11) 0.36866(2) 0 Uani 0.00752(7) 6 1 d . . .
Al1 Al 0.30323(9) 0 0.5 Uani 0.0089(2) 6 1 d . . .
Al2 Al 0.5 0 0 Uani 0.0086(3) 3 1 d . . .


loop_
_jana_atom_site_ADP_C_label
_jana_atom_site_ADP_C_type_symbol
_jana_atom_site_ADP_C_111
_jana_atom_site_ADP_C_112
_jana_atom_site_ADP_C_113
_jana_atom_site_ADP_C_122
_jana_atom_site_ADP_C_123
_jana_atom_site_ADP_C_133
_jana_atom_site_ADP_C_222
_jana_atom_site_ADP_C_223
_jana_atom_site_ADP_C_233
_jana_atom_site_ADP_C_333
? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_D_label
_jana_atom_site_ADP_D_type_symbol
_jana_atom_site_ADP_D_1111
_jana_atom_site_ADP_D_1112
_jana_atom_site_ADP_D_1113
_jana_atom_site_ADP_D_1122
_jana_atom_site_ADP_D_1123
_jana_atom_site_ADP_D_1133
_jana_atom_site_ADP_D_1222
_jana_atom_site_ADP_D_1223
_jana_atom_site_ADP_D_1233
_jana_atom_site_ADP_D_1333
_jana_atom_site_ADP_D_2222
_jana_atom_site_ADP_D_2223
_jana_atom_site_ADP_D_2233
_jana_atom_site_ADP_D_2333
_jana_atom_site_ADP_D_3333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_E_label
_jana_atom_site_ADP_E_type_symbol
_jana_atom_site_ADP_E_11111
_jana_atom_site_ADP_E_11112
_jana_atom_site_ADP_E_11113
_jana_atom_site_ADP_E_11122
_jana_atom_site_ADP_E_11123
_jana_atom_site_ADP_E_11133
_jana_atom_site_ADP_E_11222
_jana_atom_site_ADP_E_11223
_jana_atom_site_ADP_E_11233
_jana_atom_site_ADP_E_11333
_jana_atom_site_ADP_E_12222
_jana_atom_site_ADP_E_12223
_jana_atom_site_ADP_E_12233
_jana_atom_site_ADP_E_12333
_jana_atom_site_ADP_E_13333
_jana_atom_site_ADP_E_22222
_jana_atom_site_ADP_E_22223
_jana_atom_site_ADP_E_22233
_jana_atom_site_ADP_E_22333
_jana_atom_site_ADP_E_23333
_jana_atom_site_ADP_E_33333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_F_label
_jana_atom_site_ADP_F_type_symbol
_jana_atom_site_ADP_F_111111
_jana_atom_site_ADP_F_111112
_jana_atom_site_ADP_F_111113
_jana_atom_site_ADP_F_111122
_jana_atom_site_ADP_F_111123
_jana_atom_site_ADP_F_111133
_jana_atom_site_ADP_F_111222
_jana_atom_site_ADP_F_111223
_jana_atom_site_ADP_F_111233
_jana_atom_site_ADP_F_111333
_jana_atom_site_ADP_F_112222
_jana_atom_site_ADP_F_112223
_jana_atom_site_ADP_F_112233
_jana_atom_site_ADP_F_112333
_jana_atom_site_ADP_F_113333
_jana_atom_site_ADP_F_122222
_jana_atom_site_ADP_F_122223
_jana_atom_site_ADP_F_122233
_jana_atom_site_ADP_F_122333
_jana_atom_site_ADP_F_123333
_jana_atom_site_ADP_F_133333
_jana_atom_site_ADP_F_222222
_jana_atom_site_ADP_F_222223
_jana_atom_site_ADP_F_222233
_jana_atom_site_ADP_F_222333
_jana_atom_site_ADP_F_223333
_jana_atom_site_ADP_F_233333
_jana_atom_site_ADP_F_333333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 10. MOLECULAR GEOMETRY


loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Yb1 Pd1 . . 3.2045(5) ?
Yb1 Pd1 . 1_556 3.2045(5) ?
Yb1 Pd1 . 2_665 3.2045(5) ?
Yb1 Pd1 . 2_666 3.2045(5) ?
Yb1 Pd1 . 3_565 3.2045(3) ?
Yb1 Pd1 . 3_566 3.2045(3) ?
Yb1 Al1 . 1_565 3.2603(6) ?
Yb1 Al1 . 2_555 3.2603(9) ?
Yb1 Al1 . 3_665 3.2603(10) ?
Yb1 Al1 . 4_665 3.2603(9) ?
Yb1 Al1 . 5_565 3.2603(6) ?
Yb1 Al1 . 6_555 3.2603(10) ?
Yb1 Al2 . 1_565 3.4242(5) ?
Yb1 Al2 . 1_566 3.4242(5) ?
Yb1 Al2 . 2_555 3.4242(5) ?
Yb1 Al2 . 2_556 3.4242(5) ?
Yb1 Al2 . 3_665 3.4243(2) ?
Yb1 Al2 . 3_666 3.4243(2) ?
Ca1 Pd1 . . 3.2045(5) ?
Ca1 Pd1 . 1_556 3.2045(5) ?
Ca1 Pd1 . 2_665 3.2045(5) ?
Ca1 Pd1 . 2_666 3.2045(5) ?
Ca1 Pd1 . 3_565 3.2045(3) ?
Ca1 Pd1 . 3_566 3.2045(3) ?
Ca1 Al1 . 1_565 3.2603(6) ?
Ca1 Al1 . 2_555 3.2603(9) ?
Ca1 Al1 . 3_665 3.2603(10) ?
Ca1 Al1 . 4_665 3.2603(9) ?
Ca1 Al1 . 5_565 3.2603(6) ?
Ca1 Al1 . 6_555 3.2603(10) ?
Ca1 Al2 . 1_565 3.4242(5) ?
Ca1 Al2 . 1_566 3.4242(5) ?
Ca1 Al2 . 2_555 3.4242(5) ?
Ca1 Al2 . 2_556 3.4242(5) ?
Ca1 Al2 . 3_665 3.4243(2) ?
Ca1 Al2 . 3_666 3.4243(2) ?
Yb2 Pd1 . . 2.9795(7) ?
Yb2 Pd1 . 2_555 2.9795(7) ?
Yb2 Pd1 . 3_555 2.9795(3) ?
Yb2 Pd1 . 4_555 2.9795(7) ?
Yb2 Pd1 . 5_555 2.9795(7) ?
Yb2 Pd1 . 6_555 2.9795(3) ?
Yb2 Al1 . 1_554 3.5321(8) ?
Yb2 Al1 . . 3.5321(8) ?
Yb2 Al1 . 2_554 3.5321(8) ?
Yb2 Al1 . 2_555 3.5321(8) ?
Yb2 Al1 . 3_554 3.5321(7) ?
Yb2 Al1 . 3_555 3.5321(7) ?
Yb2 Al1 . 4_554 3.5321(8) ?
Yb2 Al1 . 4_555 3.5321(8) ?
Yb2 Al1 . 5_554 3.5321(8) ?
Yb2 Al1 . 5_555 3.5321(8) ?
Yb2 Al1 . 6_554 3.5321(7) ?
Yb2 Al1 . 6_555 3.5321(7) ?
Ca2 Pd1 . . 2.9795(7) ?
Ca2 Pd1 . 2_555 2.9795(7) ?
Ca2 Pd1 . 3_555 2.9795(3) ?
Ca2 Pd1 . 4_555 2.9795(7) ?
Ca2 Pd1 . 5_555 2.9795(7) ?
Ca2 Pd1 . 6_555 2.9795(3) ?
Ca2 Al1 . 1_554 3.5321(8) ?
Ca2 Al1 . . 3.5321(8) ?
Ca2 Al1 . 2_554 3.5321(8) ?
Ca2 Al1 . 2_555 3.5321(8) ?
Ca2 Al1 . 3_554 3.5321(7) ?
Ca2 Al1 . 3_555 3.5321(7) ?
Ca2 Al1 . 4_554 3.5321(8) ?
Ca2 Al1 . 4_555 3.5321(8) ?
Ca2 Al1 . 5_554 3.5321(8) ?
Ca2 Al1 . 5_555 3.5321(8) ?
Ca2 Al1 . 6_554 3.5321(7) ?
Ca2 Al1 . 6_555 3.5321(7) ?
Pd1 Pd1 . 5_555 2.9795(4) ?
Pd1 Pd1 . 6_555 2.9795(7) ?
Pd1 Al1 . 2_554 2.5980(3) ?
Pd1 Al1 . 2_555 2.5980(3) ?
Pd1 Al1 . 6_554 2.5980(6) ?
Pd1 Al1 . 6_555 2.5980(6) ?
Pd1 Al2 . 2_555 2.5631(3) ?
Pd1 Al2 . 3_665 2.5631(5) ?
Al1 Al1 . 4_655 3.6726(13) ?
Al1 Al1 . 5_555 2.8297(9) ?
Al1 Al1 . 6_555 2.8297(11) ?
Al1 Al2 . . 2.8000(6) ?
Al1 Al2 . 1_556 2.8000(6) ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
Pd1 Yb1 Pd1 . . 1_556 82.545(8) ?
Pd1 Yb1 Pd1 . . 2_665 81.217(7) ?
Pd1 Yb1 Pd1 . . 2_666 135.853(6) ?
Pd1 Yb1 Pd1 . . 3_565 81.217(6) ?
Pd1 Yb1 Pd1 . . 3_566 135.854(6) ?
Pd1 Yb1 Al1 . . 1_565 128.391(8) ?
Pd1 Yb1 Al1 . . 2_555 47.381(7) ?
Pd1 Yb1 Al1 . . 3_665 93.216(11) ?
Pd1 Yb1 Al1 . . 4_665 128.391(8) ?
Pd1 Yb1 Al1 . . 5_565 93.216(10) ?
Pd1 Yb1 Al1 . . 6_555 47.381(8) ?
Pd1 Yb1 Al2 . . 1_565 100.608(7) ?
Pd1 Yb1 Al2 . . 1_566 176.847(2) ?
Pd1 Yb1 Al2 . . 2_555 45.345(4) ?
Pd1 Yb1 Al2 . . 2_556 96.405(7) ?
Pd1 Yb1 Al2 . . 3_665 45.344(5) ?
Pd1 Yb1 Al2 . . 3_666 96.405(6) ?
Pd1 Yb1 Pd1 1_556 . 2_665 135.853(6) ?
Pd1 Yb1 Pd1 1_556 . 2_666 81.217(7) ?
Pd1 Yb1 Pd1 1_556 . 3_565 135.854(6) ?
Pd1 Yb1 Pd1 1_556 . 3_566 81.217(6) ?
Pd1 Yb1 Al1 1_556 . 1_565 128.391(8) ?
Pd1 Yb1 Al1 1_556 . 2_555 47.381(7) ?
Pd1 Yb1 Al1 1_556 . 3_665 93.216(11) ?
Pd1 Yb1 Al1 1_556 . 4_665 128.391(8) ?
Pd1 Yb1 Al1 1_556 . 5_565 93.216(10) ?
Pd1 Yb1 Al1 1_556 . 6_555 47.381(8) ?
Pd1 Yb1 Al2 1_556 . 1_565 176.847(2) ?
Pd1 Yb1 Al2 1_556 . 1_566 100.608(7) ?
Pd1 Yb1 Al2 1_556 . 2_555 96.405(7) ?
Pd1 Yb1 Al2 1_556 . 2_556 45.345(4) ?
Pd1 Yb1 Al2 1_556 . 3_665 96.405(6) ?
Pd1 Yb1 Al2 1_556 . 3_666 45.344(5) ?
Pd1 Yb1 Pd1 2_665 . 2_666 82.545(8) ?
Pd1 Yb1 Pd1 2_665 . 3_565 81.217(7) ?
Pd1 Yb1 Pd1 2_665 . 3_566 135.854(6) ?
Pd1 Yb1 Al1 2_665 . 1_565 93.216(11) ?
Pd1 Yb1 Al1 2_665 . 2_555 128.391(8) ?
Pd1 Yb1 Al1 2_665 . 3_665 47.381(8) ?
Pd1 Yb1 Al1 2_665 . 4_665 47.381(7) ?
Pd1 Yb1 Al1 2_665 . 5_565 128.391(9) ?
Pd1 Yb1 Al1 2_665 . 6_555 93.216(12) ?
Pd1 Yb1 Al2 2_665 . 1_565 45.345(5) ?
Pd1 Yb1 Al2 2_665 . 1_566 96.405(7) ?
Pd1 Yb1 Al2 2_665 . 2_555 100.608(7) ?
Pd1 Yb1 Al2 2_665 . 2_556 176.847(2) ?
Pd1 Yb1 Al2 2_665 . 3_665 45.344(6) ?
Pd1 Yb1 Al2 2_665 . 3_666 96.405(7) ?
Pd1 Yb1 Pd1 2_666 . 3_565 135.854(6) ?
Pd1 Yb1 Pd1 2_666 . 3_566 81.217(7) ?
Pd1 Yb1 Al1 2_666 . 1_565 93.216(11) ?
Pd1 Yb1 Al1 2_666 . 2_555 128.391(8) ?
Pd1 Yb1 Al1 2_666 . 3_665 47.381(8) ?
Pd1 Yb1 Al1 2_666 . 4_665 47.381(7) ?
Pd1 Yb1 Al1 2_666 . 5_565 128.391(9) ?
Pd1 Yb1 Al1 2_666 . 6_555 93.216(12) ?
Pd1 Yb1 Al2 2_666 . 1_565 96.405(7) ?
Pd1 Yb1 Al2 2_666 . 1_566 45.345(5) ?
Pd1 Yb1 Al2 2_666 . 2_555 176.847(2) ?
Pd1 Yb1 Al2 2_666 . 2_556 100.608(7) ?
Pd1 Yb1 Al2 2_666 . 3_665 96.405(7) ?
Pd1 Yb1 Al2 2_666 . 3_666 45.344(6) ?
Pd1 Yb1 Pd1 3_565 . 3_566 82.545(6) ?
Pd1 Yb1 Al1 3_565 . 1_565 47.381(6) ?
Pd1 Yb1 Al1 3_565 . 2_555 93.216(11) ?
Pd1 Yb1 Al1 3_565 . 3_665 128.391(8) ?
Pd1 Yb1 Al1 3_565 . 4_665 93.216(11) ?
Pd1 Yb1 Al1 3_565 . 5_565 47.381(7) ?
Pd1 Yb1 Al1 3_565 . 6_555 128.391(8) ?
Pd1 Yb1 Al2 3_565 . 1_565 45.345(5) ?
Pd1 Yb1 Al2 3_565 . 1_566 96.405(5) ?
Pd1 Yb1 Al2 3_565 . 2_555 45.345(5) ?
Pd1 Yb1 Al2 3_565 . 2_556 96.405(6) ?
Pd1 Yb1 Al2 3_565 . 3_665 100.608(5) ?
Pd1 Yb1 Al2 3_565 . 3_666 176.847(2) ?
Pd1 Yb1 Al1 3_566 . 1_565 47.381(6) ?
Pd1 Yb1 Al1 3_566 . 2_555 93.216(11) ?
Pd1 Yb1 Al1 3_566 . 3_665 128.391(8) ?
Pd1 Yb1 Al1 3_566 . 4_665 93.216(11) ?
Pd1 Yb1 Al1 3_566 . 5_565 47.381(7) ?
Pd1 Yb1 Al1 3_566 . 6_555 128.391(8) ?
Pd1 Yb1 Al2 3_566 . 1_565 96.405(5) ?
Pd1 Yb1 Al2 3_566 . 1_566 45.345(5) ?
Pd1 Yb1 Al2 3_566 . 2_555 96.405(6) ?
Pd1 Yb1 Al2 3_566 . 2_556 45.345(5) ?
Pd1 Yb1 Al2 3_566 . 3_665 176.847(2) ?
Pd1 Yb1 Al2 3_566 . 3_666 100.608(5) ?
Al1 Yb1 Al1 1_565 . 2_555 120.000(18) ?
Al1 Yb1 Al1 1_565 . 3_665 120.000(19) ?
Al1 Yb1 Al1 1_565 . 4_665 68.561(18) ?
Al1 Yb1 Al1 1_565 . 5_565 51.440(18) ?
Al1 Yb1 Al1 1_565 . 6_555 171.440(18) ?
Al1 Yb1 Al2 1_565 . 1_565 49.454(8) ?
Al1 Yb1 Al2 1_565 . 1_566 49.454(8) ?
Al1 Yb1 Al2 1_565 . 2_555 86.634(11) ?
Al1 Yb1 Al2 1_565 . 2_556 86.634(11) ?
Al1 Yb1 Al2 1_565 . 3_665 135.136(6) ?
Al1 Yb1 Al2 1_565 . 3_666 135.136(6) ?
Al1 Yb1 Al1 2_555 . 3_665 120.000(19) ?
Al1 Yb1 Al1 2_555 . 4_665 171.439(17) ?
Al1 Yb1 Al1 2_555 . 5_565 68.561(18) ?
Al1 Yb1 Al1 2_555 . 6_555 51.439(19) ?
Al1 Yb1 Al2 2_555 . 1_565 135.136(7) ?
Al1 Yb1 Al2 2_555 . 1_566 135.136(7) ?
Al1 Yb1 Al2 2_555 . 2_555 49.453(8) ?
Al1 Yb1 Al2 2_555 . 2_556 49.453(8) ?
Al1 Yb1 Al2 2_555 . 3_665 86.634(11) ?
Al1 Yb1 Al2 2_555 . 3_666 86.634(11) ?
Al1 Yb1 Al1 3_665 . 4_665 51.439(19) ?
Al1 Yb1 Al1 3_665 . 5_565 171.440(18) ?
Al1 Yb1 Al1 3_665 . 6_555 68.560(19) ?
Al1 Yb1 Al2 3_665 . 1_565 86.634(11) ?
Al1 Yb1 Al2 3_665 . 1_566 86.634(11) ?
Al1 Yb1 Al2 3_665 . 2_555 135.136(7) ?
Al1 Yb1 Al2 3_665 . 2_556 135.136(7) ?
Al1 Yb1 Al2 3_665 . 3_665 49.453(8) ?
Al1 Yb1 Al2 3_665 . 3_666 49.453(8) ?
Al1 Yb1 Al1 4_665 . 5_565 120.000(18) ?
Al1 Yb1 Al1 4_665 . 6_555 120.000(19) ?
Al1 Yb1 Al2 4_665 . 1_565 49.453(8) ?
Al1 Yb1 Al2 4_665 . 1_566 49.453(8) ?
Al1 Yb1 Al2 4_665 . 2_555 135.136(7) ?
Al1 Yb1 Al2 4_665 . 2_556 135.136(7) ?
Al1 Yb1 Al2 4_665 . 3_665 86.634(11) ?
Al1 Yb1 Al2 4_665 . 3_666 86.634(11) ?
Al1 Yb1 Al1 5_565 . 6_555 120.000(19) ?
Al1 Yb1 Al2 5_565 . 1_565 86.634(11) ?
Al1 Yb1 Al2 5_565 . 1_566 86.634(11) ?
Al1 Yb1 Al2 5_565 . 2_555 49.454(8) ?
Al1 Yb1 Al2 5_565 . 2_556 49.454(8) ?
Al1 Yb1 Al2 5_565 . 3_665 135.136(6) ?
Al1 Yb1 Al2 5_565 . 3_666 135.136(6) ?
Al1 Yb1 Al2 6_555 . 1_565 135.136(7) ?
Al1 Yb1 Al2 6_555 . 1_566 135.136(7) ?
Al1 Yb1 Al2 6_555 . 2_555 86.634(11) ?
Al1 Yb1 Al2 6_555 . 2_556 86.634(11) ?
Al1 Yb1 Al2 6_555 . 3_665 49.453(8) ?
Al1 Yb1 Al2 6_555 . 3_666 49.453(8) ?
Al2 Yb1 Al2 1_565 . 1_566 76.239(7) ?
Al2 Yb1 Al2 1_565 . 2_555 85.894(7) ?
Al2 Yb1 Al2 1_565 . 2_556 133.672(3) ?
Al2 Yb1 Al2 1_565 . 3_665 85.894(5) ?
Al2 Yb1 Al2 1_565 . 3_666 133.672(5) ?
Al2 Yb1 Al2 1_566 . 2_555 133.672(3) ?
Al2 Yb1 Al2 1_566 . 2_556 85.894(7) ?
Al2 Yb1 Al2 1_566 . 3_665 133.672(5) ?
Al2 Yb1 Al2 1_566 . 3_666 85.894(5) ?
Al2 Yb1 Al2 2_555 . 2_556 76.239(7) ?
Al2 Yb1 Al2 2_555 . 3_665 85.894(5) ?
Al2 Yb1 Al2 2_555 . 3_666 133.672(5) ?
Al2 Yb1 Al2 2_556 . 3_665 133.672(5) ?
Al2 Yb1 Al2 2_556 . 3_666 85.894(5) ?
Al2 Yb1 Al2 3_665 . 3_666 76.239(4) ?
Pd1 Ca1 Pd1 . . 1_556 82.545(8) ?
Pd1 Ca1 Pd1 . . 2_665 81.217(7) ?
Pd1 Ca1 Pd1 . . 2_666 135.853(6) ?
Pd1 Ca1 Pd1 . . 3_565 81.217(6) ?
Pd1 Ca1 Pd1 . . 3_566 135.854(6) ?
Pd1 Ca1 Al1 . . 1_565 128.391(8) ?
Pd1 Ca1 Al1 . . 2_555 47.381(7) ?
Pd1 Ca1 Al1 . . 3_665 93.216(11) ?
Pd1 Ca1 Al1 . . 4_665 128.391(8) ?
Pd1 Ca1 Al1 . . 5_565 93.216(10) ?
Pd1 Ca1 Al1 . . 6_555 47.381(8) ?
Pd1 Ca1 Al2 . . 1_565 100.608(7) ?
Pd1 Ca1 Al2 . . 1_566 176.847(2) ?
Pd1 Ca1 Al2 . . 2_555 45.345(4) ?
Pd1 Ca1 Al2 . . 2_556 96.405(7) ?
Pd1 Ca1 Al2 . . 3_665 45.344(5) ?
Pd1 Ca1 Al2 . . 3_666 96.405(6) ?
Pd1 Ca1 Pd1 1_556 . 2_665 135.853(6) ?
Pd1 Ca1 Pd1 1_556 . 2_666 81.217(7) ?
Pd1 Ca1 Pd1 1_556 . 3_565 135.854(6) ?
Pd1 Ca1 Pd1 1_556 . 3_566 81.217(6) ?
Pd1 Ca1 Al1 1_556 . 1_565 128.391(8) ?
Pd1 Ca1 Al1 1_556 . 2_555 47.381(7) ?
Pd1 Ca1 Al1 1_556 . 3_665 93.216(11) ?
Pd1 Ca1 Al1 1_556 . 4_665 128.391(8) ?
Pd1 Ca1 Al1 1_556 . 5_565 93.216(10) ?
Pd1 Ca1 Al1 1_556 . 6_555 47.381(8) ?
Pd1 Ca1 Al2 1_556 . 1_565 176.847(2) ?
Pd1 Ca1 Al2 1_556 . 1_566 100.608(7) ?
Pd1 Ca1 Al2 1_556 . 2_555 96.405(7) ?
Pd1 Ca1 Al2 1_556 . 2_556 45.345(4) ?
Pd1 Ca1 Al2 1_556 . 3_665 96.405(6) ?
Pd1 Ca1 Al2 1_556 . 3_666 45.344(5) ?
Pd1 Ca1 Pd1 2_665 . 2_666 82.545(8) ?
Pd1 Ca1 Pd1 2_665 . 3_565 81.217(7) ?
Pd1 Ca1 Pd1 2_665 . 3_566 135.854(6) ?
Pd1 Ca1 Al1 2_665 . 1_565 93.216(11) ?
Pd1 Ca1 Al1 2_665 . 2_555 128.391(8) ?
Pd1 Ca1 Al1 2_665 . 3_665 47.381(8) ?
Pd1 Ca1 Al1 2_665 . 4_665 47.381(7) ?
Pd1 Ca1 Al1 2_665 . 5_565 128.391(9) ?
Pd1 Ca1 Al1 2_665 . 6_555 93.216(12) ?
Pd1 Ca1 Al2 2_665 . 1_565 45.345(5) ?
Pd1 Ca1 Al2 2_665 . 1_566 96.405(7) ?
Pd1 Ca1 Al2 2_665 . 2_555 100.608(7) ?
Pd1 Ca1 Al2 2_665 . 2_556 176.847(2) ?
Pd1 Ca1 Al2 2_665 . 3_665 45.344(6) ?
Pd1 Ca1 Al2 2_665 . 3_666 96.405(7) ?
Pd1 Ca1 Pd1 2_666 . 3_565 135.854(6) ?
Pd1 Ca1 Pd1 2_666 . 3_566 81.217(7) ?
Pd1 Ca1 Al1 2_666 . 1_565 93.216(11) ?
Pd1 Ca1 Al1 2_666 . 2_555 128.391(8) ?
Pd1 Ca1 Al1 2_666 . 3_665 47.381(8) ?
Pd1 Ca1 Al1 2_666 . 4_665 47.381(7) ?
Pd1 Ca1 Al1 2_666 . 5_565 128.391(9) ?
Pd1 Ca1 Al1 2_666 . 6_555 93.216(12) ?
Pd1 Ca1 Al2 2_666 . 1_565 96.405(7) ?
Pd1 Ca1 Al2 2_666 . 1_566 45.345(5) ?
Pd1 Ca1 Al2 2_666 . 2_555 176.847(2) ?
Pd1 Ca1 Al2 2_666 . 2_556 100.608(7) ?
Pd1 Ca1 Al2 2_666 . 3_665 96.405(7) ?
Pd1 Ca1 Al2 2_666 . 3_666 45.344(6) ?
Pd1 Ca1 Pd1 3_565 . 3_566 82.545(6) ?
Pd1 Ca1 Al1 3_565 . 1_565 47.381(6) ?
Pd1 Ca1 Al1 3_565 . 2_555 93.216(11) ?
Pd1 Ca1 Al1 3_565 . 3_665 128.391(8) ?
Pd1 Ca1 Al1 3_565 . 4_665 93.216(11) ?
Pd1 Ca1 Al1 3_565 . 5_565 47.381(7) ?
Pd1 Ca1 Al1 3_565 . 6_555 128.391(8) ?
Pd1 Ca1 Al2 3_565 . 1_565 45.345(5) ?
Pd1 Ca1 Al2 3_565 . 1_566 96.405(5) ?
Pd1 Ca1 Al2 3_565 . 2_555 45.345(5) ?
Pd1 Ca1 Al2 3_565 . 2_556 96.405(6) ?
Pd1 Ca1 Al2 3_565 . 3_665 100.608(5) ?
Pd1 Ca1 Al2 3_565 . 3_666 176.847(2) ?
Pd1 Ca1 Al1 3_566 . 1_565 47.381(6) ?
Pd1 Ca1 Al1 3_566 . 2_555 93.216(11) ?
Pd1 Ca1 Al1 3_566 . 3_665 128.391(8) ?
Pd1 Ca1 Al1 3_566 . 4_665 93.216(11) ?
Pd1 Ca1 Al1 3_566 . 5_565 47.381(7) ?
Pd1 Ca1 Al1 3_566 . 6_555 128.391(8) ?
Pd1 Ca1 Al2 3_566 . 1_565 96.405(5) ?
Pd1 Ca1 Al2 3_566 . 1_566 45.345(5) ?
Pd1 Ca1 Al2 3_566 . 2_555 96.405(6) ?
Pd1 Ca1 Al2 3_566 . 2_556 45.345(5) ?
Pd1 Ca1 Al2 3_566 . 3_665 176.847(2) ?
Pd1 Ca1 Al2 3_566 . 3_666 100.608(5) ?
Al1 Ca1 Al1 1_565 . 2_555 120.000(18) ?
Al1 Ca1 Al1 1_565 . 3_665 120.000(19) ?
Al1 Ca1 Al1 1_565 . 4_665 68.561(18) ?
Al1 Ca1 Al1 1_565 . 5_565 51.440(18) ?
Al1 Ca1 Al1 1_565 . 6_555 171.440(18) ?
Al1 Ca1 Al2 1_565 . 1_565 49.454(8) ?
Al1 Ca1 Al2 1_565 . 1_566 49.454(8) ?
Al1 Ca1 Al2 1_565 . 2_555 86.634(11) ?
Al1 Ca1 Al2 1_565 . 2_556 86.634(11) ?
Al1 Ca1 Al2 1_565 . 3_665 135.136(6) ?
Al1 Ca1 Al2 1_565 . 3_666 135.136(6) ?
Al1 Ca1 Al1 2_555 . 3_665 120.000(19) ?
Al1 Ca1 Al1 2_555 . 4_665 171.439(17) ?
Al1 Ca1 Al1 2_555 . 5_565 68.561(18) ?
Al1 Ca1 Al1 2_555 . 6_555 51.439(19) ?
Al1 Ca1 Al2 2_555 . 1_565 135.136(7) ?
Al1 Ca1 Al2 2_555 . 1_566 135.136(7) ?
Al1 Ca1 Al2 2_555 . 2_555 49.453(8) ?
Al1 Ca1 Al2 2_555 . 2_556 49.453(8) ?
Al1 Ca1 Al2 2_555 . 3_665 86.634(11) ?
Al1 Ca1 Al2 2_555 . 3_666 86.634(11) ?
Al1 Ca1 Al1 3_665 . 4_665 51.439(19) ?
Al1 Ca1 Al1 3_665 . 5_565 171.440(18) ?
Al1 Ca1 Al1 3_665 . 6_555 68.560(19) ?
Al1 Ca1 Al2 3_665 . 1_565 86.634(11) ?
Al1 Ca1 Al2 3_665 . 1_566 86.634(11) ?
Al1 Ca1 Al2 3_665 . 2_555 135.136(7) ?
Al1 Ca1 Al2 3_665 . 2_556 135.136(7) ?
Al1 Ca1 Al2 3_665 . 3_665 49.453(8) ?
Al1 Ca1 Al2 3_665 . 3_666 49.453(8) ?
Al1 Ca1 Al1 4_665 . 5_565 120.000(18) ?
Al1 Ca1 Al1 4_665 . 6_555 120.000(19) ?
Al1 Ca1 Al2 4_665 . 1_565 49.453(8) ?
Al1 Ca1 Al2 4_665 . 1_566 49.453(8) ?
Al1 Ca1 Al2 4_665 . 2_555 135.136(7) ?
Al1 Ca1 Al2 4_665 . 2_556 135.136(7) ?
Al1 Ca1 Al2 4_665 . 3_665 86.634(11) ?
Al1 Ca1 Al2 4_665 . 3_666 86.634(11) ?
Al1 Ca1 Al1 5_565 . 6_555 120.000(19) ?
Al1 Ca1 Al2 5_565 . 1_565 86.634(11) ?
Al1 Ca1 Al2 5_565 . 1_566 86.634(11) ?
Al1 Ca1 Al2 5_565 . 2_555 49.454(8) ?
Al1 Ca1 Al2 5_565 . 2_556 49.454(8) ?
Al1 Ca1 Al2 5_565 . 3_665 135.136(6) ?
Al1 Ca1 Al2 5_565 . 3_666 135.136(6) ?
Al1 Ca1 Al2 6_555 . 1_565 135.136(7) ?
Al1 Ca1 Al2 6_555 . 1_566 135.136(7) ?
Al1 Ca1 Al2 6_555 . 2_555 86.634(11) ?
Al1 Ca1 Al2 6_555 . 2_556 86.634(11) ?
Al1 Ca1 Al2 6_555 . 3_665 49.453(8) ?
Al1 Ca1 Al2 6_555 . 3_666 49.453(8) ?
Al2 Ca1 Al2 1_565 . 1_566 76.239(7) ?
Al2 Ca1 Al2 1_565 . 2_555 85.894(7) ?
Al2 Ca1 Al2 1_565 . 2_556 133.672(3) ?
Al2 Ca1 Al2 1_565 . 3_665 85.894(5) ?
Al2 Ca1 Al2 1_565 . 3_666 133.672(5) ?
Al2 Ca1 Al2 1_566 . 2_555 133.672(3) ?
Al2 Ca1 Al2 1_566 . 2_556 85.894(7) ?
Al2 Ca1 Al2 1_566 . 3_665 133.672(5) ?
Al2 Ca1 Al2 1_566 . 3_666 85.894(5) ?
Al2 Ca1 Al2 2_555 . 2_556 76.239(7) ?
Al2 Ca1 Al2 2_555 . 3_665 85.894(5) ?
Al2 Ca1 Al2 2_555 . 3_666 133.672(5) ?
Al2 Ca1 Al2 2_556 . 3_665 133.672(5) ?
Al2 Ca1 Al2 2_556 . 3_666 85.894(5) ?
Al2 Ca1 Al2 3_665 . 3_666 76.239(4) ?
Pd1 Yb2 Pd1 . . 2_555 120.000(7) ?
Pd1 Yb2 Pd1 . . 3_555 120.000(7) ?
Pd1 Yb2 Pd1 . . 4_555 180.0(5) ?
Pd1 Yb2 Pd1 . . 5_555 60.000(7) ?
Pd1 Yb2 Pd1 . . 6_555 60.000(7) ?
Pd1 Yb2 Al1 . . 1_554 90.000(5) ?
Pd1 Yb2 Al1 . . . 90.000(5) ?
Pd1 Yb2 Al1 . . 2_554 46.067(7) ?
Pd1 Yb2 Al1 . . 2_555 46.067(7) ?
Pd1 Yb2 Al1 . . 3_554 133.933(13) ?
Pd1 Yb2 Al1 . . 3_555 133.933(13) ?
Pd1 Yb2 Al1 . . 4_554 90.000(5) ?
Pd1 Yb2 Al1 . . 4_555 90.000(5) ?
Pd1 Yb2 Al1 . . 5_554 133.933(7) ?
Pd1 Yb2 Al1 . . 5_555 133.933(7) ?
Pd1 Yb2 Al1 . . 6_554 46.067(13) ?
Pd1 Yb2 Al1 . . 6_555 46.067(13) ?
Pd1 Yb2 Pd1 2_555 . 3_555 120.000(8) ?
Pd1 Yb2 Pd1 2_555 . 4_555 60.000(7) ?
Pd1 Yb2 Pd1 2_555 . 5_555 180.0(5) ?
Pd1 Yb2 Pd1 2_555 . 6_555 60.000(8) ?
Pd1 Yb2 Al1 2_555 . 1_554 133.933(7) ?
Pd1 Yb2 Al1 2_555 . . 133.933(7) ?
Pd1 Yb2 Al1 2_555 . 2_554 90.000(6) ?
Pd1 Yb2 Al1 2_555 . 2_555 90.000(6) ?
Pd1 Yb2 Al1 2_555 . 3_554 46.067(13) ?
Pd1 Yb2 Al1 2_555 . 3_555 46.067(13) ?
Pd1 Yb2 Al1 2_555 . 4_554 46.067(7) ?
Pd1 Yb2 Al1 2_555 . 4_555 46.067(7) ?
Pd1 Yb2 Al1 2_555 . 5_554 90.000(6) ?
Pd1 Yb2 Al1 2_555 . 5_555 90.000(6) ?
Pd1 Yb2 Al1 2_555 . 6_554 133.933(13) ?
Pd1 Yb2 Al1 2_555 . 6_555 133.933(13) ?
Pd1 Yb2 Pd1 3_555 . 4_555 60.000(7) ?
Pd1 Yb2 Pd1 3_555 . 5_555 60.000(8) ?
Pd1 Yb2 Pd1 3_555 . 6_555 180.0(5) ?
Pd1 Yb2 Al1 3_555 . 1_554 46.067(7) ?
Pd1 Yb2 Al1 3_555 . . 46.067(7) ?
Pd1 Yb2 Al1 3_555 . 2_554 133.933(7) ?
Pd1 Yb2 Al1 3_555 . 2_555 133.933(7) ?
Pd1 Yb2 Al1 3_555 . 3_554 90.000(18) ?
Pd1 Yb2 Al1 3_555 . 3_555 90.000(18) ?
Pd1 Yb2 Al1 3_555 . 4_554 133.933(7) ?
Pd1 Yb2 Al1 3_555 . 4_555 133.933(7) ?
Pd1 Yb2 Al1 3_555 . 5_554 46.067(7) ?
Pd1 Yb2 Al1 3_555 . 5_555 46.067(7) ?
Pd1 Yb2 Al1 3_555 . 6_554 90.000(18) ?
Pd1 Yb2 Al1 3_555 . 6_555 90.000(18) ?
Pd1 Yb2 Pd1 4_555 . 5_555 120.000(7) ?
Pd1 Yb2 Pd1 4_555 . 6_555 120.000(7) ?
Pd1 Yb2 Al1 4_555 . 1_554 90.000(5) ?
Pd1 Yb2 Al1 4_555 . . 90.000(5) ?
Pd1 Yb2 Al1 4_555 . 2_554 133.933(7) ?
Pd1 Yb2 Al1 4_555 . 2_555 133.933(7) ?
Pd1 Yb2 Al1 4_555 . 3_554 46.067(13) ?
Pd1 Yb2 Al1 4_555 . 3_555 46.067(13) ?
Pd1 Yb2 Al1 4_555 . 4_554 90.000(5) ?
Pd1 Yb2 Al1 4_555 . 4_555 90.000(5) ?
Pd1 Yb2 Al1 4_555 . 5_554 46.067(7) ?
Pd1 Yb2 Al1 4_555 . 5_555 46.067(7) ?
Pd1 Yb2 Al1 4_555 . 6_554 133.933(13) ?
Pd1 Yb2 Al1 4_555 . 6_555 133.933(13) ?
Pd1 Yb2 Pd1 5_555 . 6_555 120.000(8) ?
Pd1 Yb2 Al1 5_555 . 1_554 46.067(7) ?
Pd1 Yb2 Al1 5_555 . . 46.067(7) ?
Pd1 Yb2 Al1 5_555 . 2_554 90.000(6) ?
Pd1 Yb2 Al1 5_555 . 2_555 90.000(6) ?
Pd1 Yb2 Al1 5_555 . 3_554 133.933(13) ?
Pd1 Yb2 Al1 5_555 . 3_555 133.933(13) ?
Pd1 Yb2 Al1 5_555 . 4_554 133.933(7) ?
Pd1 Yb2 Al1 5_555 . 4_555 133.933(7) ?
Pd1 Yb2 Al1 5_555 . 5_554 90.000(6) ?
Pd1 Yb2 Al1 5_555 . 5_555 90.000(6) ?
Pd1 Yb2 Al1 5_555 . 6_554 46.067(13) ?
Pd1 Yb2 Al1 5_555 . 6_555 46.067(13) ?
Pd1 Yb2 Al1 6_555 . 1_554 133.933(7) ?
Pd1 Yb2 Al1 6_555 . . 133.933(7) ?
Pd1 Yb2 Al1 6_555 . 2_554 46.067(7) ?
Pd1 Yb2 Al1 6_555 . 2_555 46.067(7) ?
Pd1 Yb2 Al1 6_555 . 3_554 90.000(18) ?
Pd1 Yb2 Al1 6_555 . 3_555 90.000(18) ?
Pd1 Yb2 Al1 6_555 . 4_554 46.067(7) ?
Pd1 Yb2 Al1 6_555 . 4_555 46.067(7) ?
Pd1 Yb2 Al1 6_555 . 5_554 133.933(7) ?
Pd1 Yb2 Al1 6_555 . 5_555 133.933(7) ?
Pd1 Yb2 Al1 6_555 . 6_554 90.000(18) ?
Pd1 Yb2 Al1 6_555 . 6_555 90.000(18) ?
Al1 Yb2 Al1 1_554 . . 73.519(13) ?
Al1 Yb2 Al1 1_554 . 2_554 87.866(9) ?
Al1 Yb2 Al1 1_554 . 2_555 132.772(6) ?
Al1 Yb2 Al1 1_554 . 3_554 87.866(15) ?
Al1 Yb2 Al1 1_554 . 3_555 132.772(16) ?
Al1 Yb2 Al1 1_554 . 4_554 106.481(13) ?
Al1 Yb2 Al1 1_554 . 4_555 180.0(5) ?
Al1 Yb2 Al1 1_554 . 5_554 47.228(6) ?
Al1 Yb2 Al1 1_554 . 5_555 92.134(9) ?
Al1 Yb2 Al1 1_554 . 6_554 47.228(16) ?
Al1 Yb2 Al1 1_554 . 6_555 92.134(15) ?
Al1 Yb2 Al1 . . 2_554 132.772(6) ?
Al1 Yb2 Al1 . . 2_555 87.866(9) ?
Al1 Yb2 Al1 . . 3_554 132.772(16) ?
Al1 Yb2 Al1 . . 3_555 87.866(15) ?
Al1 Yb2 Al1 . . 4_554 180.0(5) ?
Al1 Yb2 Al1 . . 4_555 106.481(13) ?
Al1 Yb2 Al1 . . 5_554 92.134(9) ?
Al1 Yb2 Al1 . . 5_555 47.228(6) ?
Al1 Yb2 Al1 . . 6_554 92.134(15) ?
Al1 Yb2 Al1 . . 6_555 47.228(16) ?
Al1 Yb2 Al1 2_554 . 2_555 73.519(13) ?
Al1 Yb2 Al1 2_554 . 3_554 87.866(15) ?
Al1 Yb2 Al1 2_554 . 3_555 132.772(16) ?
Al1 Yb2 Al1 2_554 . 4_554 47.228(6) ?
Al1 Yb2 Al1 2_554 . 4_555 92.134(9) ?
Al1 Yb2 Al1 2_554 . 5_554 106.481(13) ?
Al1 Yb2 Al1 2_554 . 5_555 180.0(5) ?
Al1 Yb2 Al1 2_554 . 6_554 47.228(16) ?
Al1 Yb2 Al1 2_554 . 6_555 92.134(15) ?
Al1 Yb2 Al1 2_555 . 3_554 132.772(16) ?
Al1 Yb2 Al1 2_555 . 3_555 87.866(15) ?
Al1 Yb2 Al1 2_555 . 4_554 92.134(9) ?
Al1 Yb2 Al1 2_555 . 4_555 47.228(6) ?
Al1 Yb2 Al1 2_555 . 5_554 180.0(5) ?
Al1 Yb2 Al1 2_555 . 5_555 106.481(13) ?
Al1 Yb2 Al1 2_555 . 6_554 92.134(15) ?
Al1 Yb2 Al1 2_555 . 6_555 47.228(16) ?
Al1 Yb2 Al1 3_554 . 3_555 73.519(11) ?
Al1 Yb2 Al1 3_554 . 4_554 47.228(16) ?
Al1 Yb2 Al1 3_554 . 4_555 92.134(15) ?
Al1 Yb2 Al1 3_554 . 5_554 47.228(16) ?
Al1 Yb2 Al1 3_554 . 5_555 92.134(15) ?
Al1 Yb2 Al1 3_554 . 6_554 106.481(11) ?
Al1 Yb2 Al1 3_554 . 6_555 180.0(5) ?
Al1 Yb2 Al1 3_555 . 4_554 92.134(15) ?
Al1 Yb2 Al1 3_555 . 4_555 47.228(16) ?
Al1 Yb2 Al1 3_555 . 5_554 92.134(15) ?
Al1 Yb2 Al1 3_555 . 5_555 47.228(16) ?
Al1 Yb2 Al1 3_555 . 6_554 180.0(5) ?
Al1 Yb2 Al1 3_555 . 6_555 106.481(11) ?
Al1 Yb2 Al1 4_554 . 4_555 73.519(13) ?
Al1 Yb2 Al1 4_554 . 5_554 87.866(9) ?
Al1 Yb2 Al1 4_554 . 5_555 132.772(6) ?
Al1 Yb2 Al1 4_554 . 6_554 87.866(15) ?
Al1 Yb2 Al1 4_554 . 6_555 132.772(16) ?
Al1 Yb2 Al1 4_555 . 5_554 132.772(6) ?
Al1 Yb2 Al1 4_555 . 5_555 87.866(9) ?
Al1 Yb2 Al1 4_555 . 6_554 132.772(16) ?
Al1 Yb2 Al1 4_555 . 6_555 87.866(15) ?
Al1 Yb2 Al1 5_554 . 5_555 73.519(13) ?
Al1 Yb2 Al1 5_554 . 6_554 87.866(15) ?
Al1 Yb2 Al1 5_554 . 6_555 132.772(16) ?
Al1 Yb2 Al1 5_555 . 6_554 132.772(16) ?
Al1 Yb2 Al1 5_555 . 6_555 87.866(15) ?
Al1 Yb2 Al1 6_554 . 6_555 73.519(11) ?
Pd1 Ca2 Pd1 . . 2_555 120.000(7) ?
Pd1 Ca2 Pd1 . . 3_555 120.000(7) ?
Pd1 Ca2 Pd1 . . 4_555 180.0(5) ?
Pd1 Ca2 Pd1 . . 5_555 60.000(7) ?
Pd1 Ca2 Pd1 . . 6_555 60.000(7) ?
Pd1 Ca2 Al1 . . 1_554 90.000(5) ?
Pd1 Ca2 Al1 . . . 90.000(5) ?
Pd1 Ca2 Al1 . . 2_554 46.067(7) ?
Pd1 Ca2 Al1 . . 2_555 46.067(7) ?
Pd1 Ca2 Al1 . . 3_554 133.933(13) ?
Pd1 Ca2 Al1 . . 3_555 133.933(13) ?
Pd1 Ca2 Al1 . . 4_554 90.000(5) ?
Pd1 Ca2 Al1 . . 4_555 90.000(5) ?
Pd1 Ca2 Al1 . . 5_554 133.933(7) ?
Pd1 Ca2 Al1 . . 5_555 133.933(7) ?
Pd1 Ca2 Al1 . . 6_554 46.067(13) ?
Pd1 Ca2 Al1 . . 6_555 46.067(13) ?
Pd1 Ca2 Pd1 2_555 . 3_555 120.000(8) ?
Pd1 Ca2 Pd1 2_555 . 4_555 60.000(7) ?
Pd1 Ca2 Pd1 2_555 . 5_555 180.0(5) ?
Pd1 Ca2 Pd1 2_555 . 6_555 60.000(8) ?
Pd1 Ca2 Al1 2_555 . 1_554 133.933(7) ?
Pd1 Ca2 Al1 2_555 . . 133.933(7) ?
Pd1 Ca2 Al1 2_555 . 2_554 90.000(6) ?
Pd1 Ca2 Al1 2_555 . 2_555 90.000(6) ?
Pd1 Ca2 Al1 2_555 . 3_554 46.067(13) ?
Pd1 Ca2 Al1 2_555 . 3_555 46.067(13) ?
Pd1 Ca2 Al1 2_555 . 4_554 46.067(7) ?
Pd1 Ca2 Al1 2_555 . 4_555 46.067(7) ?
Pd1 Ca2 Al1 2_555 . 5_554 90.000(6) ?
Pd1 Ca2 Al1 2_555 . 5_555 90.000(6) ?
Pd1 Ca2 Al1 2_555 . 6_554 133.933(13) ?
Pd1 Ca2 Al1 2_555 . 6_555 133.933(13) ?
Pd1 Ca2 Pd1 3_555 . 4_555 60.000(7) ?
Pd1 Ca2 Pd1 3_555 . 5_555 60.000(8) ?
Pd1 Ca2 Pd1 3_555 . 6_555 180.0(5) ?
Pd1 Ca2 Al1 3_555 . 1_554 46.067(7) ?
Pd1 Ca2 Al1 3_555 . . 46.067(7) ?
Pd1 Ca2 Al1 3_555 . 2_554 133.933(7) ?
Pd1 Ca2 Al1 3_555 . 2_555 133.933(7) ?
Pd1 Ca2 Al1 3_555 . 3_554 90.000(18) ?
Pd1 Ca2 Al1 3_555 . 3_555 90.000(18) ?
Pd1 Ca2 Al1 3_555 . 4_554 133.933(7) ?
Pd1 Ca2 Al1 3_555 . 4_555 133.933(7) ?
Pd1 Ca2 Al1 3_555 . 5_554 46.067(7) ?
Pd1 Ca2 Al1 3_555 . 5_555 46.067(7) ?
Pd1 Ca2 Al1 3_555 . 6_554 90.000(18) ?
Pd1 Ca2 Al1 3_555 . 6_555 90.000(18) ?
Pd1 Ca2 Pd1 4_555 . 5_555 120.000(7) ?
Pd1 Ca2 Pd1 4_555 . 6_555 120.000(7) ?
Pd1 Ca2 Al1 4_555 . 1_554 90.000(5) ?
Pd1 Ca2 Al1 4_555 . . 90.000(5) ?
Pd1 Ca2 Al1 4_555 . 2_554 133.933(7) ?
Pd1 Ca2 Al1 4_555 . 2_555 133.933(7) ?
Pd1 Ca2 Al1 4_555 . 3_554 46.067(13) ?
Pd1 Ca2 Al1 4_555 . 3_555 46.067(13) ?
Pd1 Ca2 Al1 4_555 . 4_554 90.000(5) ?
Pd1 Ca2 Al1 4_555 . 4_555 90.000(5) ?
Pd1 Ca2 Al1 4_555 . 5_554 46.067(7) ?
Pd1 Ca2 Al1 4_555 . 5_555 46.067(7) ?
Pd1 Ca2 Al1 4_555 . 6_554 133.933(13) ?
Pd1 Ca2 Al1 4_555 . 6_555 133.933(13) ?
Pd1 Ca2 Pd1 5_555 . 6_555 120.000(8) ?
Pd1 Ca2 Al1 5_555 . 1_554 46.067(7) ?
Pd1 Ca2 Al1 5_555 . . 46.067(7) ?
Pd1 Ca2 Al1 5_555 . 2_554 90.000(6) ?
Pd1 Ca2 Al1 5_555 . 2_555 90.000(6) ?
Pd1 Ca2 Al1 5_555 . 3_554 133.933(13) ?
Pd1 Ca2 Al1 5_555 . 3_555 133.933(13) ?
Pd1 Ca2 Al1 5_555 . 4_554 133.933(7) ?
Pd1 Ca2 Al1 5_555 . 4_555 133.933(7) ?
Pd1 Ca2 Al1 5_555 . 5_554 90.000(6) ?
Pd1 Ca2 Al1 5_555 . 5_555 90.000(6) ?
Pd1 Ca2 Al1 5_555 . 6_554 46.067(13) ?
Pd1 Ca2 Al1 5_555 . 6_555 46.067(13) ?
Pd1 Ca2 Al1 6_555 . 1_554 133.933(7) ?
Pd1 Ca2 Al1 6_555 . . 133.933(7) ?
Pd1 Ca2 Al1 6_555 . 2_554 46.067(7) ?
Pd1 Ca2 Al1 6_555 . 2_555 46.067(7) ?
Pd1 Ca2 Al1 6_555 . 3_554 90.000(18) ?
Pd1 Ca2 Al1 6_555 . 3_555 90.000(18) ?
Pd1 Ca2 Al1 6_555 . 4_554 46.067(7) ?
Pd1 Ca2 Al1 6_555 . 4_555 46.067(7) ?
Pd1 Ca2 Al1 6_555 . 5_554 133.933(7) ?
Pd1 Ca2 Al1 6_555 . 5_555 133.933(7) ?
Pd1 Ca2 Al1 6_555 . 6_554 90.000(18) ?
Pd1 Ca2 Al1 6_555 . 6_555 90.000(18) ?
Al1 Ca2 Al1 1_554 . . 73.519(13) ?
Al1 Ca2 Al1 1_554 . 2_554 87.866(9) ?
Al1 Ca2 Al1 1_554 . 2_555 132.772(6) ?
Al1 Ca2 Al1 1_554 . 3_554 87.866(15) ?
Al1 Ca2 Al1 1_554 . 3_555 132.772(16) ?
Al1 Ca2 Al1 1_554 . 4_554 106.481(13) ?
Al1 Ca2 Al1 1_554 . 4_555 180.0(5) ?
Al1 Ca2 Al1 1_554 . 5_554 47.228(6) ?
Al1 Ca2 Al1 1_554 . 5_555 92.134(9) ?
Al1 Ca2 Al1 1_554 . 6_554 47.228(16) ?
Al1 Ca2 Al1 1_554 . 6_555 92.134(15) ?
Al1 Ca2 Al1 . . 2_554 132.772(6) ?
Al1 Ca2 Al1 . . 2_555 87.866(9) ?
Al1 Ca2 Al1 . . 3_554 132.772(16) ?
Al1 Ca2 Al1 . . 3_555 87.866(15) ?
Al1 Ca2 Al1 . . 4_554 180.0(5) ?
Al1 Ca2 Al1 . . 4_555 106.481(13) ?
Al1 Ca2 Al1 . . 5_554 92.134(9) ?
Al1 Ca2 Al1 . . 5_555 47.228(6) ?
Al1 Ca2 Al1 . . 6_554 92.134(15) ?
Al1 Ca2 Al1 . . 6_555 47.228(16) ?
Al1 Ca2 Al1 2_554 . 2_555 73.519(13) ?
Al1 Ca2 Al1 2_554 . 3_554 87.866(15) ?
Al1 Ca2 Al1 2_554 . 3_555 132.772(16) ?
Al1 Ca2 Al1 2_554 . 4_554 47.228(6) ?
Al1 Ca2 Al1 2_554 . 4_555 92.134(9) ?
Al1 Ca2 Al1 2_554 . 5_554 106.481(13) ?
Al1 Ca2 Al1 2_554 . 5_555 180.0(5) ?
Al1 Ca2 Al1 2_554 . 6_554 47.228(16) ?
Al1 Ca2 Al1 2_554 . 6_555 92.134(15) ?
Al1 Ca2 Al1 2_555 . 3_554 132.772(16) ?
Al1 Ca2 Al1 2_555 . 3_555 87.866(15) ?
Al1 Ca2 Al1 2_555 . 4_554 92.134(9) ?
Al1 Ca2 Al1 2_555 . 4_555 47.228(6) ?
Al1 Ca2 Al1 2_555 . 5_554 180.0(5) ?
Al1 Ca2 Al1 2_555 . 5_555 106.481(13) ?
Al1 Ca2 Al1 2_555 . 6_554 92.134(15) ?
Al1 Ca2 Al1 2_555 . 6_555 47.228(16) ?
Al1 Ca2 Al1 3_554 . 3_555 73.519(11) ?
Al1 Ca2 Al1 3_554 . 4_554 47.228(16) ?
Al1 Ca2 Al1 3_554 . 4_555 92.134(15) ?
Al1 Ca2 Al1 3_554 . 5_554 47.228(16) ?
Al1 Ca2 Al1 3_554 . 5_555 92.134(15) ?
Al1 Ca2 Al1 3_554 . 6_554 106.481(11) ?
Al1 Ca2 Al1 3_554 . 6_555 180.0(5) ?
Al1 Ca2 Al1 3_555 . 4_554 92.134(15) ?
Al1 Ca2 Al1 3_555 . 4_555 47.228(16) ?
Al1 Ca2 Al1 3_555 . 5_554 92.134(15) ?
Al1 Ca2 Al1 3_555 . 5_555 47.228(16) ?
Al1 Ca2 Al1 3_555 . 6_554 180.0(5) ?
Al1 Ca2 Al1 3_555 . 6_555 106.481(11) ?
Al1 Ca2 Al1 4_554 . 4_555 73.519(13) ?
Al1 Ca2 Al1 4_554 . 5_554 87.866(9) ?
Al1 Ca2 Al1 4_554 . 5_555 132.772(6) ?
Al1 Ca2 Al1 4_554 . 6_554 87.866(15) ?
Al1 Ca2 Al1 4_554 . 6_555 132.772(16) ?
Al1 Ca2 Al1 4_555 . 5_554 132.772(6) ?
Al1 Ca2 Al1 4_555 . 5_555 87.866(9) ?
Al1 Ca2 Al1 4_555 . 6_554 132.772(16) ?
Al1 Ca2 Al1 4_555 . 6_555 87.866(15) ?
Al1 Ca2 Al1 5_554 . 5_555 73.519(13) ?
Al1 Ca2 Al1 5_554 . 6_554 87.866(15) ?
Al1 Ca2 Al1 5_554 . 6_555 132.772(16) ?
Al1 Ca2 Al1 5_555 . 6_554 132.772(16) ?
Al1 Ca2 Al1 5_555 . 6_555 87.866(15) ?
Al1 Ca2 Al1 6_554 . 6_555 73.519(11) ?
Yb1 Pd1 Yb1 1_554 . . 82.545(8) ?
Yb1 Pd1 Ca1 1_554 . 1_554 0.0(5) ?
Yb1 Pd1 Ca1 1_554 . . 82.545(8) ?
Yb1 Pd1 Yb2 1_554 . . 138.728(4) ?
Yb1 Pd1 Ca2 1_554 . . 138.728(4) ?
Yb1 Pd1 Pd1 1_554 . 5_555 112.073(6) ?
Yb1 Pd1 Pd1 1_554 . 6_555 112.073(6) ?
Yb1 Pd1 Al1 1_554 . 2_554 67.437(14) ?
Yb1 Pd1 Al1 1_554 . 2_555 133.61(2) ?
Yb1 Pd1 Al1 1_554 . 6_554 67.437(18) ?
Yb1 Pd1 Al1 1_554 . 6_555 133.606(14) ?
Yb1 Pd1 Al2 1_554 . 2_555 71.866(6) ?
Yb1 Pd1 Al2 1_554 . 3_665 71.866(5) ?
Yb1 Pd1 Ca1 . . 1_554 82.545(8) ?
Yb1 Pd1 Ca1 . . . 0.0(5) ?
Yb1 Pd1 Yb2 . . . 138.728(4) ?
Yb1 Pd1 Ca2 . . . 138.728(4) ?
Yb1 Pd1 Pd1 . . 5_555 112.073(6) ?
Yb1 Pd1 Pd1 . . 6_555 112.073(6) ?
Yb1 Pd1 Al1 . . 2_554 133.61(2) ?
Yb1 Pd1 Al1 . . 2_555 67.437(14) ?
Yb1 Pd1 Al1 . . 6_554 133.606(14) ?
Yb1 Pd1 Al1 . . 6_555 67.437(18) ?
Yb1 Pd1 Al2 . . 2_555 71.866(6) ?
Yb1 Pd1 Al2 . . 3_665 71.866(5) ?
Ca1 Pd1 Ca1 1_554 . . 82.545(8) ?
Ca1 Pd1 Yb2 1_554 . . 138.728(4) ?
Ca1 Pd1 Ca2 1_554 . . 138.728(4) ?
Ca1 Pd1 Pd1 1_554 . 5_555 112.073(6) ?
Ca1 Pd1 Pd1 1_554 . 6_555 112.073(6) ?
Ca1 Pd1 Al1 1_554 . 2_554 67.437(14) ?
Ca1 Pd1 Al1 1_554 . 2_555 133.61(2) ?
Ca1 Pd1 Al1 1_554 . 6_554 67.437(18) ?
Ca1 Pd1 Al1 1_554 . 6_555 133.606(14) ?
Ca1 Pd1 Al2 1_554 . 2_555 71.866(6) ?
Ca1 Pd1 Al2 1_554 . 3_665 71.866(5) ?
Ca1 Pd1 Yb2 . . . 138.728(4) ?
Ca1 Pd1 Ca2 . . . 138.728(4) ?
Ca1 Pd1 Pd1 . . 5_555 112.073(6) ?
Ca1 Pd1 Pd1 . . 6_555 112.073(6) ?
Ca1 Pd1 Al1 . . 2_554 133.61(2) ?
Ca1 Pd1 Al1 . . 2_555 67.437(14) ?
Ca1 Pd1 Al1 . . 6_554 133.606(14) ?
Ca1 Pd1 Al1 . . 6_555 67.437(18) ?
Ca1 Pd1 Al2 . . 2_555 71.866(6) ?
Ca1 Pd1 Al2 . . 3_665 71.866(5) ?
Yb2 Pd1 Ca2 . . . 0.0(5) ?
Yb2 Pd1 Pd1 . . 5_555 60.000(8) ?
Yb2 Pd1 Pd1 . . 6_555 60.000(6) ?
Yb2 Pd1 Al1 . . 2_554 78.255(17) ?
Yb2 Pd1 Al1 . . 2_555 78.255(17) ?
Yb2 Pd1 Al1 . . 6_554 78.255(16) ?
Yb2 Pd1 Al1 . . 6_555 78.255(16) ?
Yb2 Pd1 Al2 . . 2_555 114.464(7) ?
Yb2 Pd1 Al2 . . 3_665 114.464(9) ?
Ca2 Pd1 Pd1 . . 5_555 60.000(8) ?
Ca2 Pd1 Pd1 . . 6_555 60.000(6) ?
Ca2 Pd1 Al1 . . 2_554 78.255(17) ?
Ca2 Pd1 Al1 . . 2_555 78.255(17) ?
Ca2 Pd1 Al1 . . 6_554 78.255(16) ?
Ca2 Pd1 Al1 . . 6_555 78.255(16) ?
Ca2 Pd1 Al2 . . 2_555 114.464(7) ?
Ca2 Pd1 Al2 . . 3_665 114.464(9) ?
Pd1 Pd1 Pd1 5_555 . 6_555 120.000(9) ?
Pd1 Pd1 Al1 5_555 . 2_554 111.707(17) ?
Pd1 Pd1 Al1 5_555 . 2_555 111.707(17) ?
Pd1 Pd1 Al1 5_555 . 6_554 55.011(19) ?
Pd1 Pd1 Al1 5_555 . 6_555 55.011(19) ?
Pd1 Pd1 Al2 5_555 . 2_555 174.464(6) ?
Pd1 Pd1 Al2 5_555 . 3_665 54.464(7) ?
Pd1 Pd1 Al1 6_555 . 2_554 55.011(4) ?
Pd1 Pd1 Al1 6_555 . 2_555 55.011(4) ?
Pd1 Pd1 Al1 6_555 . 6_554 111.707(14) ?
Pd1 Pd1 Al1 6_555 . 6_555 111.707(14) ?
Pd1 Pd1 Al2 6_555 . 2_555 54.464(7) ?
Pd1 Pd1 Al2 6_555 . 3_665 174.464(9) ?
Al1 Pd1 Al1 2_554 . 2_555 108.903(8) ?
Al1 Pd1 Al1 2_554 . 6_554 65.99(2) ?
Al1 Pd1 Al1 2_554 . 6_555 156.51(2) ?
Al1 Pd1 Al2 2_554 . 2_555 65.707(16) ?
Al1 Pd1 Al2 2_554 . 3_665 125.451(4) ?
Al1 Pd1 Al1 2_555 . 6_554 156.51(2) ?
Al1 Pd1 Al1 2_555 . 6_555 65.99(2) ?
Al1 Pd1 Al2 2_555 . 2_555 65.707(16) ?
Al1 Pd1 Al2 2_555 . 3_665 125.451(4) ?
Al1 Pd1 Al1 6_554 . 6_555 108.90(3) ?
Al1 Pd1 Al2 6_554 . 2_555 125.451(19) ?
Al1 Pd1 Al2 6_554 . 3_665 65.707(14) ?
Al1 Pd1 Al2 6_555 . 2_555 125.451(19) ?
Al1 Pd1 Al2 6_555 . 3_665 65.707(14) ?
Al2 Pd1 Al2 2_555 . 3_665 131.072(9) ?
Yb1 Al1 Yb1 1_545 . 4_665 111.44(3) ?
Yb1 Al1 Ca1 1_545 . 1_545 0.0(5) ?
Yb1 Al1 Ca1 1_545 . 4_665 111.44(3) ?
Yb1 Al1 Yb2 1_545 . . 116.823(7) ?
Yb1 Al1 Yb2 1_545 . 1_556 116.823(7) ?
Yb1 Al1 Ca2 1_545 . . 116.823(7) ?
Yb1 Al1 Ca2 1_545 . 1_556 116.823(7) ?
Yb1 Al1 Pd1 1_545 . 3_555 65.182(9) ?
Yb1 Al1 Pd1 1_545 . 3_556 65.182(9) ?
Yb1 Al1 Pd1 1_545 . 5_555 121.863(16) ?
Yb1 Al1 Pd1 1_545 . 5_556 121.863(16) ?
Yb1 Al1 Al1 1_545 . 4_655 55.720(13) ?
Yb1 Al1 Al1 1_545 . 5_555 64.280(16) ?
Yb1 Al1 Al1 1_545 . 6_555 175.72(3) ?
Yb1 Al1 Al2 1_545 . . 68.322(13) ?
Yb1 Al1 Al2 1_545 . 1_556 68.322(13) ?
Yb1 Al1 Ca1 4_665 . 1_545 111.44(3) ?
Yb1 Al1 Ca1 4_665 . 4_665 0.0(5) ?
Yb1 Al1 Yb2 4_665 . . 116.823(8) ?
Yb1 Al1 Yb2 4_665 . 1_556 116.823(8) ?
Yb1 Al1 Ca2 4_665 . . 116.823(8) ?
Yb1 Al1 Ca2 4_665 . 1_556 116.823(8) ?
Yb1 Al1 Pd1 4_665 . 3_555 121.862(15) ?
Yb1 Al1 Pd1 4_665 . 3_556 121.862(15) ?
Yb1 Al1 Pd1 4_665 . 5_555 65.182(8) ?
Yb1 Al1 Pd1 4_665 . 5_556 65.182(8) ?
Yb1 Al1 Al1 4_665 . 4_655 55.720(13) ?
Yb1 Al1 Al1 4_665 . 5_555 175.72(3) ?
Yb1 Al1 Al1 4_665 . 6_555 64.280(16) ?
Yb1 Al1 Al2 4_665 . . 68.322(14) ?
Yb1 Al1 Al2 4_665 . 1_556 68.322(14) ?
Ca1 Al1 Ca1 1_545 . 4_665 111.44(3) ?
Ca1 Al1 Yb2 1_545 . . 116.823(7) ?
Ca1 Al1 Yb2 1_545 . 1_556 116.823(7) ?
Ca1 Al1 Ca2 1_545 . . 116.823(7) ?
Ca1 Al1 Ca2 1_545 . 1_556 116.823(7) ?
Ca1 Al1 Pd1 1_545 . 3_555 65.182(9) ?
Ca1 Al1 Pd1 1_545 . 3_556 65.182(9) ?
Ca1 Al1 Pd1 1_545 . 5_555 121.863(16) ?
Ca1 Al1 Pd1 1_545 . 5_556 121.863(16) ?
Ca1 Al1 Al1 1_545 . 4_655 55.720(13) ?
Ca1 Al1 Al1 1_545 . 5_555 64.280(16) ?
Ca1 Al1 Al1 1_545 . 6_555 175.72(3) ?
Ca1 Al1 Al2 1_545 . . 68.322(13) ?
Ca1 Al1 Al2 1_545 . 1_556 68.322(13) ?
Ca1 Al1 Yb2 4_665 . . 116.823(8) ?
Ca1 Al1 Yb2 4_665 . 1_556 116.823(8) ?
Ca1 Al1 Ca2 4_665 . . 116.823(8) ?
Ca1 Al1 Ca2 4_665 . 1_556 116.823(8) ?
Ca1 Al1 Pd1 4_665 . 3_555 121.862(15) ?
Ca1 Al1 Pd1 4_665 . 3_556 121.862(15) ?
Ca1 Al1 Pd1 4_665 . 5_555 65.182(8) ?
Ca1 Al1 Pd1 4_665 . 5_556 65.182(8) ?
Ca1 Al1 Al1 4_665 . 4_655 55.720(13) ?
Ca1 Al1 Al1 4_665 . 5_555 175.72(3) ?
Ca1 Al1 Al1 4_665 . 6_555 64.280(16) ?
Ca1 Al1 Al2 4_665 . . 68.322(14) ?
Ca1 Al1 Al2 4_665 . 1_556 68.322(14) ?
Yb2 Al1 Yb2 . . 1_556 73.519(17) ?
Yb2 Al1 Ca2 . . . 0.0(5) ?
Yb2 Al1 Ca2 . . 1_556 73.519(17) ?
Yb2 Al1 Pd1 . . 3_555 55.678(12) ?
Yb2 Al1 Pd1 . . 3_556 114.20(2) ?
Yb2 Al1 Pd1 . . 5_555 55.678(13) ?
Yb2 Al1 Pd1 . . 5_556 114.20(2) ?
Yb2 Al1 Al1 . . 4_655 143.240(9) ?
Yb2 Al1 Al1 . . 5_555 66.386(18) ?
Yb2 Al1 Al1 . . 6_555 66.386(18) ?
Yb2 Al1 Al2 . . . 94.222(7) ?
Yb2 Al1 Al2 . . 1_556 167.74(2) ?
Yb2 Al1 Ca2 1_556 . . 73.519(17) ?
Yb2 Al1 Ca2 1_556 . 1_556 0.0(5) ?
Yb2 Al1 Pd1 1_556 . 3_555 114.20(2) ?
Yb2 Al1 Pd1 1_556 . 3_556 55.678(12) ?
Yb2 Al1 Pd1 1_556 . 5_555 114.20(2) ?
Yb2 Al1 Pd1 1_556 . 5_556 55.678(13) ?
Yb2 Al1 Al1 1_556 . 4_655 143.240(9) ?
Yb2 Al1 Al1 1_556 . 5_555 66.386(18) ?
Yb2 Al1 Al1 1_556 . 6_555 66.386(18) ?
Yb2 Al1 Al2 1_556 . . 167.74(2) ?
Yb2 Al1 Al2 1_556 . 1_556 94.222(7) ?
Ca2 Al1 Ca2 . . 1_556 73.519(17) ?
Ca2 Al1 Pd1 . . 3_555 55.678(12) ?
Ca2 Al1 Pd1 . . 3_556 114.20(2) ?
Ca2 Al1 Pd1 . . 5_555 55.678(13) ?
Ca2 Al1 Pd1 . . 5_556 114.20(2) ?
Ca2 Al1 Al1 . . 4_655 143.240(9) ?
Ca2 Al1 Al1 . . 5_555 66.386(18) ?
Ca2 Al1 Al1 . . 6_555 66.386(18) ?
Ca2 Al1 Al2 . . . 94.222(7) ?
Ca2 Al1 Al2 . . 1_556 167.74(2) ?
Ca2 Al1 Pd1 1_556 . 3_555 114.20(2) ?
Ca2 Al1 Pd1 1_556 . 3_556 55.678(12) ?
Ca2 Al1 Pd1 1_556 . 5_555 114.20(2) ?
Ca2 Al1 Pd1 1_556 . 5_556 55.678(13) ?
Ca2 Al1 Al1 1_556 . 4_655 143.240(9) ?
Ca2 Al1 Al1 1_556 . 5_555 66.386(18) ?
Ca2 Al1 Al1 1_556 . 6_555 66.386(18) ?
Ca2 Al1 Al2 1_556 . . 167.74(2) ?
Ca2 Al1 Al2 1_556 . 1_556 94.222(7) ?
Pd1 Al1 Pd1 3_555 . 3_556 108.903(9) ?
Pd1 Al1 Pd1 3_555 . 5_555 69.977(8) ?
Pd1 Al1 Pd1 3_555 . 5_556 168.98(4) ?
Pd1 Al1 Al1 3_555 . 4_655 95.509(19) ?
Pd1 Al1 Al1 3_555 . 5_555 57.003(8) ?
Pd1 Al1 Al1 3_555 . 6_555 116.653(19) ?
Pd1 Al1 Al2 3_555 . . 56.547(9) ?
Pd1 Al1 Al2 3_555 . 1_556 132.62(2) ?
Pd1 Al1 Pd1 3_556 . 5_555 168.98(4) ?
Pd1 Al1 Pd1 3_556 . 5_556 69.977(8) ?
Pd1 Al1 Al1 3_556 . 4_655 95.509(19) ?
Pd1 Al1 Al1 3_556 . 5_555 57.003(8) ?
Pd1 Al1 Al1 3_556 . 6_555 116.653(19) ?
Pd1 Al1 Al2 3_556 . . 132.62(2) ?
Pd1 Al1 Al2 3_556 . 1_556 56.547(9) ?
Pd1 Al1 Pd1 5_555 . 5_556 108.903(10) ?
Pd1 Al1 Al1 5_555 . 4_655 95.509(19) ?
Pd1 Al1 Al1 5_555 . 5_555 116.653(19) ?
Pd1 Al1 Al1 5_555 . 6_555 57.003(9) ?
Pd1 Al1 Al2 5_555 . . 56.547(9) ?
Pd1 Al1 Al2 5_555 . 1_556 132.62(2) ?
Pd1 Al1 Al1 5_556 . 4_655 95.509(19) ?
Pd1 Al1 Al1 5_556 . 5_555 116.653(19) ?
Pd1 Al1 Al1 5_556 . 6_555 57.003(9) ?
Pd1 Al1 Al2 5_556 . . 132.62(2) ?
Pd1 Al1 Al2 5_556 . 1_556 56.547(9) ?
Al1 Al1 Al1 4_655 . 5_555 120.00(2) ?
Al1 Al1 Al1 4_655 . 6_555 120.00(2) ?
Al1 Al1 Al2 4_655 . . 49.018(13) ?
Al1 Al1 Al2 4_655 . 1_556 49.018(13) ?
Al1 Al1 Al1 5_555 . 6_555 120.00(4) ?
Al1 Al1 Al2 5_555 . . 109.142(10) ?
Al1 Al1 Al2 5_555 . 1_556 109.142(10) ?
Al1 Al1 Al2 6_555 . . 109.142(10) ?
Al1 Al1 Al2 6_555 . 1_556 109.142(10) ?
Al2 Al1 Al2 . . 1_556 98.04(3) ?
Yb1 Al2 Yb1 1_544 . 1_545 76.239(7) ?
Yb1 Al2 Yb1 1_544 . 4_664 103.761(7) ?
Yb1 Al2 Yb1 1_544 . 4_665 180.0(5) ?
Yb1 Al2 Ca1 1_544 . 1_544 0.0(5) ?
Yb1 Al2 Ca1 1_544 . 1_545 76.239(7) ?
Yb1 Al2 Ca1 1_544 . 4_664 103.761(7) ?
Yb1 Al2 Ca1 1_544 . 4_665 180.0(5) ?
Yb1 Al2 Pd1 1_544 . 2_655 62.790(5) ?
Yb1 Al2 Pd1 1_544 . 3_555 62.790(5) ?
Yb1 Al2 Pd1 1_544 . 5_555 117.210(5) ?
Yb1 Al2 Pd1 1_544 . 6_655 117.210(5) ?
Yb1 Al2 Al1 1_544 . 1_554 62.224(7) ?
Yb1 Al2 Al1 1_544 . . 117.776(8) ?
Yb1 Al2 Al1 1_544 . 4_654 62.224(8) ?
Yb1 Al2 Al1 1_544 . 4_655 117.776(7) ?
Yb1 Al2 Yb1 1_545 . 4_664 180.0(5) ?
Yb1 Al2 Yb1 1_545 . 4_665 103.761(7) ?
Yb1 Al2 Ca1 1_545 . 1_544 76.239(7) ?
Yb1 Al2 Ca1 1_545 . 1_545 0.0(5) ?
Yb1 Al2 Ca1 1_545 . 4_664 180.0(5) ?
Yb1 Al2 Ca1 1_545 . 4_665 103.761(7) ?
Yb1 Al2 Pd1 1_545 . 2_655 62.790(5) ?
Yb1 Al2 Pd1 1_545 . 3_555 62.790(5) ?
Yb1 Al2 Pd1 1_545 . 5_555 117.210(5) ?
Yb1 Al2 Pd1 1_545 . 6_655 117.210(5) ?
Yb1 Al2 Al1 1_545 . 1_554 117.776(8) ?
Yb1 Al2 Al1 1_545 . . 62.224(7) ?
Yb1 Al2 Al1 1_545 . 4_654 117.776(7) ?
Yb1 Al2 Al1 1_545 . 4_655 62.224(8) ?
Yb1 Al2 Yb1 4_664 . 4_665 76.239(7) ?
Yb1 Al2 Ca1 4_664 . 1_544 103.761(7) ?
Yb1 Al2 Ca1 4_664 . 1_545 180.0(5) ?
Yb1 Al2 Ca1 4_664 . 4_664 0.0(5) ?
Yb1 Al2 Ca1 4_664 . 4_665 76.239(7) ?
Yb1 Al2 Pd1 4_664 . 2_655 117.210(5) ?
Yb1 Al2 Pd1 4_664 . 3_555 117.210(5) ?
Yb1 Al2 Pd1 4_664 . 5_555 62.790(5) ?
Yb1 Al2 Pd1 4_664 . 6_655 62.790(5) ?
Yb1 Al2 Al1 4_664 . 1_554 62.224(8) ?
Yb1 Al2 Al1 4_664 . . 117.776(7) ?
Yb1 Al2 Al1 4_664 . 4_654 62.224(7) ?
Yb1 Al2 Al1 4_664 . 4_655 117.776(8) ?
Yb1 Al2 Ca1 4_665 . 1_544 180.0(5) ?
Yb1 Al2 Ca1 4_665 . 1_545 103.761(7) ?
Yb1 Al2 Ca1 4_665 . 4_664 76.239(7) ?
Yb1 Al2 Ca1 4_665 . 4_665 0.0(5) ?
Yb1 Al2 Pd1 4_665 . 2_655 117.210(5) ?
Yb1 Al2 Pd1 4_665 . 3_555 117.210(5) ?
Yb1 Al2 Pd1 4_665 . 5_555 62.790(5) ?
Yb1 Al2 Pd1 4_665 . 6_655 62.790(5) ?
Yb1 Al2 Al1 4_665 . 1_554 117.776(7) ?
Yb1 Al2 Al1 4_665 . . 62.224(8) ?
Yb1 Al2 Al1 4_665 . 4_654 117.776(8) ?
Yb1 Al2 Al1 4_665 . 4_655 62.224(7) ?
Ca1 Al2 Ca1 1_544 . 1_545 76.239(7) ?
Ca1 Al2 Ca1 1_544 . 4_664 103.761(7) ?
Ca1 Al2 Ca1 1_544 . 4_665 180.0(5) ?
Ca1 Al2 Pd1 1_544 . 2_655 62.790(5) ?
Ca1 Al2 Pd1 1_544 . 3_555 62.790(5) ?
Ca1 Al2 Pd1 1_544 . 5_555 117.210(5) ?
Ca1 Al2 Pd1 1_544 . 6_655 117.210(5) ?
Ca1 Al2 Al1 1_544 . 1_554 62.224(7) ?
Ca1 Al2 Al1 1_544 . . 117.776(8) ?
Ca1 Al2 Al1 1_544 . 4_654 62.224(8) ?
Ca1 Al2 Al1 1_544 . 4_655 117.776(7) ?
Ca1 Al2 Ca1 1_545 . 4_664 180.0(5) ?
Ca1 Al2 Ca1 1_545 . 4_665 103.761(7) ?
Ca1 Al2 Pd1 1_545 . 2_655 62.790(5) ?
Ca1 Al2 Pd1 1_545 . 3_555 62.790(5) ?
Ca1 Al2 Pd1 1_545 . 5_555 117.210(5) ?
Ca1 Al2 Pd1 1_545 . 6_655 117.210(5) ?
Ca1 Al2 Al1 1_545 . 1_554 117.776(8) ?
Ca1 Al2 Al1 1_545 . . 62.224(7) ?
Ca1 Al2 Al1 1_545 . 4_654 117.776(7) ?
Ca1 Al2 Al1 1_545 . 4_655 62.224(8) ?
Ca1 Al2 Ca1 4_664 . 4_665 76.239(7) ?
Ca1 Al2 Pd1 4_664 . 2_655 117.210(5) ?
Ca1 Al2 Pd1 4_664 . 3_555 117.210(5) ?
Ca1 Al2 Pd1 4_664 . 5_555 62.790(5) ?
Ca1 Al2 Pd1 4_664 . 6_655 62.790(5) ?
Ca1 Al2 Al1 4_664 . 1_554 62.224(8) ?
Ca1 Al2 Al1 4_664 . . 117.776(7) ?
Ca1 Al2 Al1 4_664 . 4_654 62.224(7) ?
Ca1 Al2 Al1 4_664 . 4_655 117.776(8) ?
Ca1 Al2 Pd1 4_665 . 2_655 117.210(5) ?
Ca1 Al2 Pd1 4_665 . 3_555 117.210(5) ?
Ca1 Al2 Pd1 4_665 . 5_555 62.790(5) ?
Ca1 Al2 Pd1 4_665 . 6_655 62.790(5) ?
Ca1 Al2 Al1 4_665 . 1_554 117.776(7) ?
Ca1 Al2 Al1 4_665 . . 62.224(8) ?
Ca1 Al2 Al1 4_665 . 4_654 117.776(8) ?
Ca1 Al2 Al1 4_665 . 4_655 62.224(7) ?
Pd1 Al2 Pd1 2_655 . 3_555 108.928(8) ?
Pd1 Al2 Pd1 2_655 . 5_555 180.0(5) ?
Pd1 Al2 Pd1 2_655 . 6_655 71.072(8) ?
Pd1 Al2 Al1 2_655 . 1_554 122.254(10) ?
Pd1 Al2 Al1 2_655 . . 122.254(10) ?
Pd1 Al2 Al1 2_655 . 4_654 57.746(10) ?
Pd1 Al2 Al1 2_655 . 4_655 57.746(10) ?
Pd1 Al2 Pd1 3_555 . 5_555 71.072(8) ?
Pd1 Al2 Pd1 3_555 . 6_655 180.0(5) ?
Pd1 Al2 Al1 3_555 . 1_554 57.746(10) ?
Pd1 Al2 Al1 3_555 . . 57.746(10) ?
Pd1 Al2 Al1 3_555 . 4_654 122.254(10) ?
Pd1 Al2 Al1 3_555 . 4_655 122.254(10) ?
Pd1 Al2 Pd1 5_555 . 6_655 108.928(8) ?
Pd1 Al2 Al1 5_555 . 1_554 57.746(10) ?
Pd1 Al2 Al1 5_555 . . 57.746(10) ?
Pd1 Al2 Al1 5_555 . 4_654 122.254(10) ?
Pd1 Al2 Al1 5_555 . 4_655 122.254(10) ?
Pd1 Al2 Al1 6_655 . 1_554 122.254(10) ?
Pd1 Al2 Al1 6_655 . . 122.254(10) ?
Pd1 Al2 Al1 6_655 . 4_654 57.746(10) ?
Pd1 Al2 Al1 6_655 . 4_655 57.746(10) ?
Al1 Al2 Al1 1_554 . . 98.036(19) ?
Al1 Al2 Al1 1_554 . 4_654 81.964(19) ?
Al1 Al2 Al1 1_554 . 4_655 180.0(5) ?
Al1 Al2 Al1 . . 4_654 180.0(5) ?
Al1 Al2 Al1 . . 4_655 81.964(19) ?
Al1 Al2 Al1 4_654 . 4_655 98.036(19) ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion
_geom_torsion_publ_flag
? ? ? ? ? ? ? ? ? ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_D
_geom_hbond_site_symmetry_H
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_publ_flag
? ? ? ? ? ? ? ? ? ? ?


####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_I_CCDC8
_database_code_depnum_ccdc_archive 'CCDC 1910744'
loop_
_audit_author_name
_audit_author_address
'Oliver Janka'
;WWU Muenster
Germany
;
_audit_update_record             
;
2019-04-17 deposited with the CCDC.	2019-10-14 downloaded from the CCDC.
;
#=======================================================================

# 5. CHEMICAL DATA

_chemical_name_systematic        
; ?
;
_chemical_name_common            ?
_chemical_formula_moiety         ?
_chemical_formula_structural     ?
_chemical_formula_analytical     ?
_chemical_formula_iupac          ?
_chemical_formula_sum            'Al3 Ca0.658 Pd2 Yb0.342'
_chemical_formula_weight         379.3
_chemical_melting_point          ?
_chemical_compound_source        ?
_chemical_absolute_configuration .

#=======================================================================

# 6. CRYSTAL DATA

_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_H-M   'P 6/m m m'
_symmetry_space_group_name_Hall  '-P 6;-2'
_symmetry_Int_Tables_number      191

loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -y,x-y,z
3 -x+y,-x,z
4 -x,-y,z
5 y,-x+y,z
6 x-y,x,z
7 y,x,-z
8 x-y,-y,-z
9 -x,-x+y,-z
10 -y,-x,-z
11 -x+y,y,-z
12 x,x-y,-z
13 -x,-y,-z
14 y,-x+y,-z
15 x-y,x,-z
16 x,y,-z
17 -y,x-y,-z
18 -x+y,-x,-z
19 -y,-x,z
20 -x+y,y,z
21 x,x-y,z
22 y,x,z
23 x-y,-y,z
24 -x,-x+y,z

_cell_length_a                   9.3376(7)
_cell_length_b                   9.3376(7)
_cell_length_c                   4.2276(3)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_volume                     319.22(4)

loop_
_twin_individual_id
_twin_individual_mass_fraction_refined
_twin_individual_twin_matrix_11
_twin_individual_twin_matrix_12
_twin_individual_twin_matrix_13
_twin_individual_twin_matrix_21
_twin_individual_twin_matrix_22
_twin_individual_twin_matrix_23
_twin_individual_twin_matrix_31
_twin_individual_twin_matrix_32
_twin_individual_twin_matrix_33
? ? ? ? ? ? ? ? ? ? ?

_cell_formula_units_Z            3

_cell_measurement_reflns_used    5174
_cell_measurement_theta_min      4.37
_cell_measurement_theta_max      33.64
_cell_measurement_temperature    293
_cell_special_details            
; ?
;

_exptl_crystal_density_diffrn    5.92
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_F_000             504

_exptl_absorpt_coefficient_mu    17.1
_exptl_crystal_description       block
_exptl_crystal_size_max          0.045
_exptl_crystal_size_mid          0.040
_exptl_crystal_size_min          0.040
_exptl_crystal_size_rad          ?
_exptl_crystal_colour            silver
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   ?
_exptl_absorpt_correction_T_min  0.4583
_exptl_absorpt_correction_T_max  0.6349
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
? ? ? ?

#=======================================================================

# 7. EXPERIMENTAL DATA

_exptl_special_details           ?

_diffrn_ambient_temperature      293
_diffrn_source                   ?
_diffrn_source_power             ?
_diffrn_source_voltage           ?
_diffrn_source_current           ?
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_source         'X-ray tube'
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'IPDS Stoe'
_diffrn_detector                 ?
_diffrn_detector_area_resol_mean ?
_diffrn_measurement_method       '??integration method??'
_diffrn_measurement_specimen_support ?

_diffrn_reflns_number            4702
_diffrn_reflns_theta_min         2.52
_diffrn_reflns_theta_max         33.29
_diffrn_reflns_theta_full        30.29
_diffrn_measured_fraction_theta_max 0.98
_diffrn_measured_fraction_theta_full 0.98
_diffrn_reflns_av_R_equivalents  0.0218
_diffrn_reflns_av_unetI/netI     0.0049
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_l_min       -6
_diffrn_reflns_limit_l_max       6
_diffrn_reflns_reduction_process ?

_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
loop_
_diffrn_standard_refln_index_h
_diffrn_standard_refln_index_k
_diffrn_standard_refln_index_l
? ? ?

_diffrn_radiation_probe          X-ray

#=======================================================================

# 8. REFINEMENT DATA

_refine_special_details          
; ?
;

_reflns_number_total             281
_reflns_number_gt                256
_reflns_threshold_expression     I>3σ(I)

_refine_ls_structure_factor_coef Fsqd
_refine_ls_R_factor_gt           0.0088
_refine_ls_wR_factor_gt          0.0222
_refine_ls_R_factor_all          0.0111
_refine_ls_wR_factor_ref         0.0234
_refine_ls_goodness_of_fit_ref   0.92
_refine_ls_goodness_of_fit_gt    0.92
_refine_ls_restrained_S_gt       ?
_refine_ls_restrained_S_all      ?
_refine_ls_number_reflns         281
_refine_ls_number_parameters     19
_refine_ls_number_restraints     0
_refine_ls_number_constraints    4
_refine_ls_weighting_scheme      sigma
_refine_ls_weighting_details     w=1/(σ²(I)+0.0004I²)
_refine_ls_hydrogen_treatment    ?
_refine_ls_shift/su_max          0.0003
_refine_ls_shift/su_mean         0.0001
_refine_diff_density_max         0.40
_refine_diff_density_min         -0.40
_refine_ls_extinction_method     
'B-C type 1 Lorentzian isotropic (Becker & Coppens, 1974)'
_refine_ls_extinction_coef       350(30)
_refine_ls_abs_structure_details ?
_refine_ls_abs_structure_Flack   ?
_refine_ls_abs_structure_Rogers  ?

loop_
_atom_type_symbol
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Al 0.0645 0.0514 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Ca 0.2262 0.3064 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Pd -0.9988 1.0072 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Yb -0.3850 5.5486 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    ?
_computing_structure_refinement  ?
_computing_molecular_graphics    ?
_computing_publication_material  ?

loop_
_restr_distance_atom_site_label_1
_restr_distance_site_symmetry_1
_restr_distance_atom_site_label_2
_restr_distance_site_symmetry_2
_restr_distance_target
_restr_distance_target_weight_param
? ? ? ? ? ?

loop_
_restr_angle_atom_site_label_1
_restr_angle_site_symmetry_1
_restr_angle_atom_site_label_2
_restr_angle_site_symmetry_2
_restr_angle_atom_site_label_3
_restr_angle_site_symmetry_3
_restr_angle_target
_restr_angle_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_torsion_atom_site_label_1
_restr_torsion_site_symmetry_1
_restr_torsion_atom_site_label_2
_restr_torsion_site_symmetry_2
_restr_torsion_atom_site_label_3
_restr_torsion_site_symmetry_3
_restr_torsion_atom_site_label_4
_restr_torsion_site_symmetry_4
_restr_torsion_angle_target
_restr_torsion_weight_param
? ? ? ? ? ? ? ? ? ?

loop_
_restr_equal_distance_atom_site_label_1
_restr_equal_distance_site_symmetry_1
_restr_equal_distance_atom_site_label_2
_restr_equal_distance_site_symmetry_2
_restr_equal_distance_class_class_id
_restr_equal_distance_class_target_weight_param
? ? ? ? ? ?

loop_
_restr_equal_angle_atom_site_label_1
_restr_equal_angle_site_symmetry_1
_restr_equal_angle_atom_site_label_2
_restr_equal_angle_site_symmetry_2
_restr_equal_angle_atom_site_label_3
_restr_equal_angle_site_symmetry_3
_restr_equal_angle_class_class_id
_restr_equal_angle_class_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_equal_torsion_atom_site_label_1
_restr_equal_torsion_site_symmetry_1
_restr_equal_torsion_atom_site_label_2
_restr_equal_torsion_site_symmetry_2
_restr_equal_torsion_atom_site_label_3
_restr_equal_torsion_site_symmetry_3
_restr_equal_torsion_atom_site_label_4
_restr_equal_torsion_site_symmetry_4
_restr_equal_torsion_class_class_id
_restr_equal_torsion_class_target_weight_param
? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 9. ATOMIC COORDINATES AND DISPLACEMENT PARAMETERS

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_adp_type
_atom_site_U_iso_or_equiv
_atom_site_site_symmetry_multiplicity
_atom_site_occupancy
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Yb1 Yb 0.333333 0.666667 0.5 Uani 0.00830(10) 2 0.4351(19) d . . .
Ca1 Ca 0.333333 0.666667 0.5 Uani 0.00830(10) 2 0.5649(19) d . . .
Yb2 Yb 0 0 0 Uani 0.0109(2) 1 0.155(2) d . . .
Ca2 Ca 0 0 0 Uani 0.0109(2) 1 0.845(2) d . . .
Pd Pd 0.184324(10) 0.368647(19) 0 Uani 0.00687(7) 6 1 d . . .
Al1 Al 0.30303(8) 0 0.5 Uani 0.0084(2) 6 1 d . . .
Al2 Al 0.5 0 0 Uani 0.0082(3) 3 1 d . . .


loop_
_jana_atom_site_ADP_C_label
_jana_atom_site_ADP_C_type_symbol
_jana_atom_site_ADP_C_111
_jana_atom_site_ADP_C_112
_jana_atom_site_ADP_C_113
_jana_atom_site_ADP_C_122
_jana_atom_site_ADP_C_123
_jana_atom_site_ADP_C_133
_jana_atom_site_ADP_C_222
_jana_atom_site_ADP_C_223
_jana_atom_site_ADP_C_233
_jana_atom_site_ADP_C_333
? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_D_label
_jana_atom_site_ADP_D_type_symbol
_jana_atom_site_ADP_D_1111
_jana_atom_site_ADP_D_1112
_jana_atom_site_ADP_D_1113
_jana_atom_site_ADP_D_1122
_jana_atom_site_ADP_D_1123
_jana_atom_site_ADP_D_1133
_jana_atom_site_ADP_D_1222
_jana_atom_site_ADP_D_1223
_jana_atom_site_ADP_D_1233
_jana_atom_site_ADP_D_1333
_jana_atom_site_ADP_D_2222
_jana_atom_site_ADP_D_2223
_jana_atom_site_ADP_D_2233
_jana_atom_site_ADP_D_2333
_jana_atom_site_ADP_D_3333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_E_label
_jana_atom_site_ADP_E_type_symbol
_jana_atom_site_ADP_E_11111
_jana_atom_site_ADP_E_11112
_jana_atom_site_ADP_E_11113
_jana_atom_site_ADP_E_11122
_jana_atom_site_ADP_E_11123
_jana_atom_site_ADP_E_11133
_jana_atom_site_ADP_E_11222
_jana_atom_site_ADP_E_11223
_jana_atom_site_ADP_E_11233
_jana_atom_site_ADP_E_11333
_jana_atom_site_ADP_E_12222
_jana_atom_site_ADP_E_12223
_jana_atom_site_ADP_E_12233
_jana_atom_site_ADP_E_12333
_jana_atom_site_ADP_E_13333
_jana_atom_site_ADP_E_22222
_jana_atom_site_ADP_E_22223
_jana_atom_site_ADP_E_22233
_jana_atom_site_ADP_E_22333
_jana_atom_site_ADP_E_23333
_jana_atom_site_ADP_E_33333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_F_label
_jana_atom_site_ADP_F_type_symbol
_jana_atom_site_ADP_F_111111
_jana_atom_site_ADP_F_111112
_jana_atom_site_ADP_F_111113
_jana_atom_site_ADP_F_111122
_jana_atom_site_ADP_F_111123
_jana_atom_site_ADP_F_111133
_jana_atom_site_ADP_F_111222
_jana_atom_site_ADP_F_111223
_jana_atom_site_ADP_F_111233
_jana_atom_site_ADP_F_111333
_jana_atom_site_ADP_F_112222
_jana_atom_site_ADP_F_112223
_jana_atom_site_ADP_F_112233
_jana_atom_site_ADP_F_112333
_jana_atom_site_ADP_F_113333
_jana_atom_site_ADP_F_122222
_jana_atom_site_ADP_F_122223
_jana_atom_site_ADP_F_122233
_jana_atom_site_ADP_F_122333
_jana_atom_site_ADP_F_123333
_jana_atom_site_ADP_F_133333
_jana_atom_site_ADP_F_222222
_jana_atom_site_ADP_F_222223
_jana_atom_site_ADP_F_222233
_jana_atom_site_ADP_F_222333
_jana_atom_site_ADP_F_223333
_jana_atom_site_ADP_F_233333
_jana_atom_site_ADP_F_333333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 10. MOLECULAR GEOMETRY


loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Yb1 Pd . . 3.2056(4) ?
Yb1 Pd . 1_556 3.2056(4) ?
Yb1 Pd . 2_665 3.2056(4) ?
Yb1 Pd . 2_666 3.2056(4) ?
Yb1 Pd . 3_565 3.2056(3) ?
Yb1 Pd . 3_566 3.2056(3) ?
Yb1 Al1 . 1_565 3.2632(6) ?
Yb1 Al1 . 2_555 3.2632(9) ?
Yb1 Al1 . 3_665 3.2632(10) ?
Yb1 Al1 . 4_665 3.2632(9) ?
Yb1 Al1 . 5_565 3.2632(6) ?
Yb1 Al1 . 6_555 3.2632(10) ?
Yb1 Al2 . 1_565 3.4255(5) ?
Yb1 Al2 . 1_566 3.4255(5) ?
Yb1 Al2 . 2_555 3.4255(5) ?
Yb1 Al2 . 2_556 3.4255(5) ?
Yb1 Al2 . 3_665 3.4255(2) ?
Yb1 Al2 . 3_666 3.4255(2) ?
Ca1 Pd . . 3.2056(4) ?
Ca1 Pd . 1_556 3.2056(4) ?
Ca1 Pd . 2_665 3.2056(4) ?
Ca1 Pd . 2_666 3.2056(4) ?
Ca1 Pd . 3_565 3.2056(3) ?
Ca1 Pd . 3_566 3.2056(3) ?
Ca1 Al1 . 1_565 3.2632(6) ?
Ca1 Al1 . 2_555 3.2632(9) ?
Ca1 Al1 . 3_665 3.2632(10) ?
Ca1 Al1 . 4_665 3.2632(9) ?
Ca1 Al1 . 5_565 3.2632(6) ?
Ca1 Al1 . 6_555 3.2632(10) ?
Ca1 Al2 . 1_565 3.4255(5) ?
Ca1 Al2 . 1_566 3.4255(5) ?
Ca1 Al2 . 2_555 3.4255(5) ?
Ca1 Al2 . 2_556 3.4255(5) ?
Ca1 Al2 . 3_665 3.4255(2) ?
Ca1 Al2 . 3_666 3.4255(2) ?
Yb2 Pd . . 2.9811(7) ?
Yb2 Pd . 2_555 2.9811(7) ?
Yb2 Pd . 3_555 2.9811(3) ?
Yb2 Pd . 4_555 2.9811(7) ?
Yb2 Pd . 5_555 2.9811(7) ?
Yb2 Pd . 6_555 2.9811(3) ?
Yb2 Al1 . 1_554 3.5319(7) ?
Yb2 Al1 . . 3.5319(7) ?
Yb2 Al1 . 2_554 3.5319(7) ?
Yb2 Al1 . 2_555 3.5319(7) ?
Yb2 Al1 . 3_554 3.5319(7) ?
Yb2 Al1 . 3_555 3.5319(7) ?
Yb2 Al1 . 4_554 3.5319(7) ?
Yb2 Al1 . 4_555 3.5319(7) ?
Yb2 Al1 . 5_554 3.5319(7) ?
Yb2 Al1 . 5_555 3.5319(7) ?
Yb2 Al1 . 6_554 3.5319(7) ?
Yb2 Al1 . 6_555 3.5319(7) ?
Ca2 Pd . . 2.9811(7) ?
Ca2 Pd . 2_555 2.9811(7) ?
Ca2 Pd . 3_555 2.9811(3) ?
Ca2 Pd . 4_555 2.9811(7) ?
Ca2 Pd . 5_555 2.9811(7) ?
Ca2 Pd . 6_555 2.9811(3) ?
Ca2 Al1 . 1_554 3.5319(7) ?
Ca2 Al1 . . 3.5319(7) ?
Ca2 Al1 . 2_554 3.5319(7) ?
Ca2 Al1 . 2_555 3.5319(7) ?
Ca2 Al1 . 3_554 3.5319(7) ?
Ca2 Al1 . 3_555 3.5319(7) ?
Ca2 Al1 . 4_554 3.5319(7) ?
Ca2 Al1 . 4_555 3.5319(7) ?
Ca2 Al1 . 5_554 3.5319(7) ?
Ca2 Al1 . 5_555 3.5319(7) ?
Ca2 Al1 . 6_554 3.5319(7) ?
Ca2 Al1 . 6_555 3.5319(7) ?
Pd Pd . 5_555 2.9811(4) ?
Pd Pd . 6_555 2.9811(7) ?
Pd Al1 . 2_554 2.5983(3) ?
Pd Al1 . 2_555 2.5983(3) ?
Pd Al1 . 6_554 2.5983(6) ?
Pd Al1 . 6_555 2.5983(6) ?
Pd Al2 . 2_555 2.5647(3) ?
Pd Al2 . 3_665 2.5647(5) ?
Al1 Al1 . 4_655 3.6785(12) ?
Al1 Al1 . 5_555 2.8296(8) ?
Al1 Al1 . 6_555 2.8296(11) ?
Al1 Al2 . . 2.8020(6) ?
Al1 Al2 . 1_556 2.8020(6) ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
Pd Yb1 Pd . . 1_556 82.508(8) ?
Pd Yb1 Pd . . 2_665 81.245(7) ?
Pd Yb1 Pd . . 2_666 135.840(5) ?
Pd Yb1 Pd . . 3_565 81.245(6) ?
Pd Yb1 Pd . . 3_566 135.841(6) ?
Pd Yb1 Al1 . . 1_565 128.389(8) ?
Pd Yb1 Al1 . . 2_555 47.354(7) ?
Pd Yb1 Al1 . . 3_665 93.237(11) ?
Pd Yb1 Al1 . . 4_665 128.389(8) ?
Pd Yb1 Al1 . . 5_565 93.237(10) ?
Pd Yb1 Al1 . . 6_555 47.354(7) ?
Pd Yb1 Al2 . . 1_565 100.643(7) ?
Pd Yb1 Al2 . . 1_566 176.8489(18) ?
Pd Yb1 Al2 . . 2_555 45.356(4) ?
Pd Yb1 Al2 . . 2_556 96.379(7) ?
Pd Yb1 Al2 . . 3_665 45.356(5) ?
Pd Yb1 Al2 . . 3_666 96.379(6) ?
Pd Yb1 Pd 1_556 . 2_665 135.840(5) ?
Pd Yb1 Pd 1_556 . 2_666 81.245(7) ?
Pd Yb1 Pd 1_556 . 3_565 135.841(6) ?
Pd Yb1 Pd 1_556 . 3_566 81.245(6) ?
Pd Yb1 Al1 1_556 . 1_565 128.389(8) ?
Pd Yb1 Al1 1_556 . 2_555 47.354(7) ?
Pd Yb1 Al1 1_556 . 3_665 93.237(11) ?
Pd Yb1 Al1 1_556 . 4_665 128.389(8) ?
Pd Yb1 Al1 1_556 . 5_565 93.237(10) ?
Pd Yb1 Al1 1_556 . 6_555 47.354(7) ?
Pd Yb1 Al2 1_556 . 1_565 176.8489(18) ?
Pd Yb1 Al2 1_556 . 1_566 100.643(7) ?
Pd Yb1 Al2 1_556 . 2_555 96.379(7) ?
Pd Yb1 Al2 1_556 . 2_556 45.356(4) ?
Pd Yb1 Al2 1_556 . 3_665 96.379(6) ?
Pd Yb1 Al2 1_556 . 3_666 45.356(5) ?
Pd Yb1 Pd 2_665 . 2_666 82.508(8) ?
Pd Yb1 Pd 2_665 . 3_565 81.245(7) ?
Pd Yb1 Pd 2_665 . 3_566 135.841(6) ?
Pd Yb1 Al1 2_665 . 1_565 93.237(10) ?
Pd Yb1 Al1 2_665 . 2_555 128.389(8) ?
Pd Yb1 Al1 2_665 . 3_665 47.354(7) ?
Pd Yb1 Al1 2_665 . 4_665 47.354(7) ?
Pd Yb1 Al1 2_665 . 5_565 128.389(8) ?
Pd Yb1 Al1 2_665 . 6_555 93.236(11) ?
Pd Yb1 Al2 2_665 . 1_565 45.356(5) ?
Pd Yb1 Al2 2_665 . 1_566 96.379(7) ?
Pd Yb1 Al2 2_665 . 2_555 100.643(7) ?
Pd Yb1 Al2 2_665 . 2_556 176.8489(18) ?
Pd Yb1 Al2 2_665 . 3_665 45.356(6) ?
Pd Yb1 Al2 2_665 . 3_666 96.379(6) ?
Pd Yb1 Pd 2_666 . 3_565 135.841(6) ?
Pd Yb1 Pd 2_666 . 3_566 81.245(7) ?
Pd Yb1 Al1 2_666 . 1_565 93.237(10) ?
Pd Yb1 Al1 2_666 . 2_555 128.389(8) ?
Pd Yb1 Al1 2_666 . 3_665 47.354(7) ?
Pd Yb1 Al1 2_666 . 4_665 47.354(7) ?
Pd Yb1 Al1 2_666 . 5_565 128.389(8) ?
Pd Yb1 Al1 2_666 . 6_555 93.236(11) ?
Pd Yb1 Al2 2_666 . 1_565 96.379(7) ?
Pd Yb1 Al2 2_666 . 1_566 45.356(5) ?
Pd Yb1 Al2 2_666 . 2_555 176.8489(18) ?
Pd Yb1 Al2 2_666 . 2_556 100.643(7) ?
Pd Yb1 Al2 2_666 . 3_665 96.379(6) ?
Pd Yb1 Al2 2_666 . 3_666 45.356(6) ?
Pd Yb1 Pd 3_565 . 3_566 82.509(6) ?
Pd Yb1 Al1 3_565 . 1_565 47.354(6) ?
Pd Yb1 Al1 3_565 . 2_555 93.237(10) ?
Pd Yb1 Al1 3_565 . 3_665 128.389(8) ?
Pd Yb1 Al1 3_565 . 4_665 93.237(10) ?
Pd Yb1 Al1 3_565 . 5_565 47.355(6) ?
Pd Yb1 Al1 3_565 . 6_555 128.389(7) ?
Pd Yb1 Al2 3_565 . 1_565 45.356(5) ?
Pd Yb1 Al2 3_565 . 1_566 96.379(5) ?
Pd Yb1 Al2 3_565 . 2_555 45.356(5) ?
Pd Yb1 Al2 3_565 . 2_556 96.379(6) ?
Pd Yb1 Al2 3_565 . 3_665 100.643(5) ?
Pd Yb1 Al2 3_565 . 3_666 176.849(2) ?
Pd Yb1 Al1 3_566 . 1_565 47.354(6) ?
Pd Yb1 Al1 3_566 . 2_555 93.237(10) ?
Pd Yb1 Al1 3_566 . 3_665 128.389(8) ?
Pd Yb1 Al1 3_566 . 4_665 93.237(10) ?
Pd Yb1 Al1 3_566 . 5_565 47.355(6) ?
Pd Yb1 Al1 3_566 . 6_555 128.389(7) ?
Pd Yb1 Al2 3_566 . 1_565 96.379(5) ?
Pd Yb1 Al2 3_566 . 1_566 45.356(5) ?
Pd Yb1 Al2 3_566 . 2_555 96.379(6) ?
Pd Yb1 Al2 3_566 . 2_556 45.356(5) ?
Pd Yb1 Al2 3_566 . 3_665 176.849(2) ?
Pd Yb1 Al2 3_566 . 3_666 100.643(5) ?
Al1 Yb1 Al1 1_565 . 2_555 120.000(17) ?
Al1 Yb1 Al1 1_565 . 3_665 120.000(18) ?
Al1 Yb1 Al1 1_565 . 4_665 68.614(17) ?
Al1 Yb1 Al1 1_565 . 5_565 51.386(17) ?
Al1 Yb1 Al1 1_565 . 6_555 171.386(17) ?
Al1 Yb1 Al2 1_565 . 1_565 49.458(8) ?
Al1 Yb1 Al2 1_565 . 1_566 49.458(8) ?
Al1 Yb1 Al2 1_565 . 2_555 86.612(10) ?
Al1 Yb1 Al2 1_565 . 2_556 86.612(10) ?
Al1 Yb1 Al2 1_565 . 3_665 135.162(6) ?
Al1 Yb1 Al2 1_565 . 3_666 135.162(6) ?
Al1 Yb1 Al1 2_555 . 3_665 120.000(18) ?
Al1 Yb1 Al1 2_555 . 4_665 171.386(16) ?
Al1 Yb1 Al1 2_555 . 5_565 68.614(17) ?
Al1 Yb1 Al1 2_555 . 6_555 51.386(18) ?
Al1 Yb1 Al2 2_555 . 1_565 135.162(7) ?
Al1 Yb1 Al2 2_555 . 1_566 135.162(7) ?
Al1 Yb1 Al2 2_555 . 2_555 49.458(8) ?
Al1 Yb1 Al2 2_555 . 2_556 49.458(8) ?
Al1 Yb1 Al2 2_555 . 3_665 86.612(11) ?
Al1 Yb1 Al2 2_555 . 3_666 86.612(11) ?
Al1 Yb1 Al1 3_665 . 4_665 51.386(18) ?
Al1 Yb1 Al1 3_665 . 5_565 171.386(17) ?
Al1 Yb1 Al1 3_665 . 6_555 68.614(18) ?
Al1 Yb1 Al2 3_665 . 1_565 86.612(11) ?
Al1 Yb1 Al2 3_665 . 1_566 86.612(11) ?
Al1 Yb1 Al2 3_665 . 2_555 135.162(7) ?
Al1 Yb1 Al2 3_665 . 2_556 135.162(7) ?
Al1 Yb1 Al2 3_665 . 3_665 49.458(8) ?
Al1 Yb1 Al2 3_665 . 3_666 49.458(8) ?
Al1 Yb1 Al1 4_665 . 5_565 120.000(17) ?
Al1 Yb1 Al1 4_665 . 6_555 120.000(18) ?
Al1 Yb1 Al2 4_665 . 1_565 49.458(8) ?
Al1 Yb1 Al2 4_665 . 1_566 49.458(8) ?
Al1 Yb1 Al2 4_665 . 2_555 135.162(7) ?
Al1 Yb1 Al2 4_665 . 2_556 135.162(7) ?
Al1 Yb1 Al2 4_665 . 3_665 86.612(11) ?
Al1 Yb1 Al2 4_665 . 3_666 86.612(11) ?
Al1 Yb1 Al1 5_565 . 6_555 120.000(18) ?
Al1 Yb1 Al2 5_565 . 1_565 86.612(10) ?
Al1 Yb1 Al2 5_565 . 1_566 86.612(10) ?
Al1 Yb1 Al2 5_565 . 2_555 49.458(8) ?
Al1 Yb1 Al2 5_565 . 2_556 49.458(8) ?
Al1 Yb1 Al2 5_565 . 3_665 135.162(6) ?
Al1 Yb1 Al2 5_565 . 3_666 135.162(6) ?
Al1 Yb1 Al2 6_555 . 1_565 135.162(7) ?
Al1 Yb1 Al2 6_555 . 1_566 135.162(7) ?
Al1 Yb1 Al2 6_555 . 2_555 86.612(11) ?
Al1 Yb1 Al2 6_555 . 2_556 86.612(11) ?
Al1 Yb1 Al2 6_555 . 3_665 49.458(8) ?
Al1 Yb1 Al2 6_555 . 3_666 49.458(8) ?
Al2 Yb1 Al2 1_565 . 1_566 76.206(7) ?
Al2 Yb1 Al2 1_565 . 2_555 85.918(7) ?
Al2 Yb1 Al2 1_565 . 2_556 133.661(3) ?
Al2 Yb1 Al2 1_565 . 3_665 85.918(5) ?
Al2 Yb1 Al2 1_565 . 3_666 133.661(5) ?
Al2 Yb1 Al2 1_566 . 2_555 133.661(3) ?
Al2 Yb1 Al2 1_566 . 2_556 85.918(7) ?
Al2 Yb1 Al2 1_566 . 3_665 133.661(5) ?
Al2 Yb1 Al2 1_566 . 3_666 85.918(5) ?
Al2 Yb1 Al2 2_555 . 2_556 76.206(7) ?
Al2 Yb1 Al2 2_555 . 3_665 85.918(5) ?
Al2 Yb1 Al2 2_555 . 3_666 133.661(5) ?
Al2 Yb1 Al2 2_556 . 3_665 133.661(5) ?
Al2 Yb1 Al2 2_556 . 3_666 85.918(5) ?
Al2 Yb1 Al2 3_665 . 3_666 76.206(4) ?
Pd Ca1 Pd . . 1_556 82.508(8) ?
Pd Ca1 Pd . . 2_665 81.245(7) ?
Pd Ca1 Pd . . 2_666 135.840(5) ?
Pd Ca1 Pd . . 3_565 81.245(6) ?
Pd Ca1 Pd . . 3_566 135.841(6) ?
Pd Ca1 Al1 . . 1_565 128.389(8) ?
Pd Ca1 Al1 . . 2_555 47.354(7) ?
Pd Ca1 Al1 . . 3_665 93.237(11) ?
Pd Ca1 Al1 . . 4_665 128.389(8) ?
Pd Ca1 Al1 . . 5_565 93.237(10) ?
Pd Ca1 Al1 . . 6_555 47.354(7) ?
Pd Ca1 Al2 . . 1_565 100.643(7) ?
Pd Ca1 Al2 . . 1_566 176.8489(18) ?
Pd Ca1 Al2 . . 2_555 45.356(4) ?
Pd Ca1 Al2 . . 2_556 96.379(7) ?
Pd Ca1 Al2 . . 3_665 45.356(5) ?
Pd Ca1 Al2 . . 3_666 96.379(6) ?
Pd Ca1 Pd 1_556 . 2_665 135.840(5) ?
Pd Ca1 Pd 1_556 . 2_666 81.245(7) ?
Pd Ca1 Pd 1_556 . 3_565 135.841(6) ?
Pd Ca1 Pd 1_556 . 3_566 81.245(6) ?
Pd Ca1 Al1 1_556 . 1_565 128.389(8) ?
Pd Ca1 Al1 1_556 . 2_555 47.354(7) ?
Pd Ca1 Al1 1_556 . 3_665 93.237(11) ?
Pd Ca1 Al1 1_556 . 4_665 128.389(8) ?
Pd Ca1 Al1 1_556 . 5_565 93.237(10) ?
Pd Ca1 Al1 1_556 . 6_555 47.354(7) ?
Pd Ca1 Al2 1_556 . 1_565 176.8489(18) ?
Pd Ca1 Al2 1_556 . 1_566 100.643(7) ?
Pd Ca1 Al2 1_556 . 2_555 96.379(7) ?
Pd Ca1 Al2 1_556 . 2_556 45.356(4) ?
Pd Ca1 Al2 1_556 . 3_665 96.379(6) ?
Pd Ca1 Al2 1_556 . 3_666 45.356(5) ?
Pd Ca1 Pd 2_665 . 2_666 82.508(8) ?
Pd Ca1 Pd 2_665 . 3_565 81.245(7) ?
Pd Ca1 Pd 2_665 . 3_566 135.841(6) ?
Pd Ca1 Al1 2_665 . 1_565 93.237(10) ?
Pd Ca1 Al1 2_665 . 2_555 128.389(8) ?
Pd Ca1 Al1 2_665 . 3_665 47.354(7) ?
Pd Ca1 Al1 2_665 . 4_665 47.354(7) ?
Pd Ca1 Al1 2_665 . 5_565 128.389(8) ?
Pd Ca1 Al1 2_665 . 6_555 93.236(11) ?
Pd Ca1 Al2 2_665 . 1_565 45.356(5) ?
Pd Ca1 Al2 2_665 . 1_566 96.379(7) ?
Pd Ca1 Al2 2_665 . 2_555 100.643(7) ?
Pd Ca1 Al2 2_665 . 2_556 176.8489(18) ?
Pd Ca1 Al2 2_665 . 3_665 45.356(6) ?
Pd Ca1 Al2 2_665 . 3_666 96.379(6) ?
Pd Ca1 Pd 2_666 . 3_565 135.841(6) ?
Pd Ca1 Pd 2_666 . 3_566 81.245(7) ?
Pd Ca1 Al1 2_666 . 1_565 93.237(10) ?
Pd Ca1 Al1 2_666 . 2_555 128.389(8) ?
Pd Ca1 Al1 2_666 . 3_665 47.354(7) ?
Pd Ca1 Al1 2_666 . 4_665 47.354(7) ?
Pd Ca1 Al1 2_666 . 5_565 128.389(8) ?
Pd Ca1 Al1 2_666 . 6_555 93.236(11) ?
Pd Ca1 Al2 2_666 . 1_565 96.379(7) ?
Pd Ca1 Al2 2_666 . 1_566 45.356(5) ?
Pd Ca1 Al2 2_666 . 2_555 176.8489(18) ?
Pd Ca1 Al2 2_666 . 2_556 100.643(7) ?
Pd Ca1 Al2 2_666 . 3_665 96.379(6) ?
Pd Ca1 Al2 2_666 . 3_666 45.356(6) ?
Pd Ca1 Pd 3_565 . 3_566 82.509(6) ?
Pd Ca1 Al1 3_565 . 1_565 47.354(6) ?
Pd Ca1 Al1 3_565 . 2_555 93.237(10) ?
Pd Ca1 Al1 3_565 . 3_665 128.389(8) ?
Pd Ca1 Al1 3_565 . 4_665 93.237(10) ?
Pd Ca1 Al1 3_565 . 5_565 47.355(6) ?
Pd Ca1 Al1 3_565 . 6_555 128.389(7) ?
Pd Ca1 Al2 3_565 . 1_565 45.356(5) ?
Pd Ca1 Al2 3_565 . 1_566 96.379(5) ?
Pd Ca1 Al2 3_565 . 2_555 45.356(5) ?
Pd Ca1 Al2 3_565 . 2_556 96.379(6) ?
Pd Ca1 Al2 3_565 . 3_665 100.643(5) ?
Pd Ca1 Al2 3_565 . 3_666 176.849(2) ?
Pd Ca1 Al1 3_566 . 1_565 47.354(6) ?
Pd Ca1 Al1 3_566 . 2_555 93.237(10) ?
Pd Ca1 Al1 3_566 . 3_665 128.389(8) ?
Pd Ca1 Al1 3_566 . 4_665 93.237(10) ?
Pd Ca1 Al1 3_566 . 5_565 47.355(6) ?
Pd Ca1 Al1 3_566 . 6_555 128.389(7) ?
Pd Ca1 Al2 3_566 . 1_565 96.379(5) ?
Pd Ca1 Al2 3_566 . 1_566 45.356(5) ?
Pd Ca1 Al2 3_566 . 2_555 96.379(6) ?
Pd Ca1 Al2 3_566 . 2_556 45.356(5) ?
Pd Ca1 Al2 3_566 . 3_665 176.849(2) ?
Pd Ca1 Al2 3_566 . 3_666 100.643(5) ?
Al1 Ca1 Al1 1_565 . 2_555 120.000(17) ?
Al1 Ca1 Al1 1_565 . 3_665 120.000(18) ?
Al1 Ca1 Al1 1_565 . 4_665 68.614(17) ?
Al1 Ca1 Al1 1_565 . 5_565 51.386(17) ?
Al1 Ca1 Al1 1_565 . 6_555 171.386(17) ?
Al1 Ca1 Al2 1_565 . 1_565 49.458(8) ?
Al1 Ca1 Al2 1_565 . 1_566 49.458(8) ?
Al1 Ca1 Al2 1_565 . 2_555 86.612(10) ?
Al1 Ca1 Al2 1_565 . 2_556 86.612(10) ?
Al1 Ca1 Al2 1_565 . 3_665 135.162(6) ?
Al1 Ca1 Al2 1_565 . 3_666 135.162(6) ?
Al1 Ca1 Al1 2_555 . 3_665 120.000(18) ?
Al1 Ca1 Al1 2_555 . 4_665 171.386(16) ?
Al1 Ca1 Al1 2_555 . 5_565 68.614(17) ?
Al1 Ca1 Al1 2_555 . 6_555 51.386(18) ?
Al1 Ca1 Al2 2_555 . 1_565 135.162(7) ?
Al1 Ca1 Al2 2_555 . 1_566 135.162(7) ?
Al1 Ca1 Al2 2_555 . 2_555 49.458(8) ?
Al1 Ca1 Al2 2_555 . 2_556 49.458(8) ?
Al1 Ca1 Al2 2_555 . 3_665 86.612(11) ?
Al1 Ca1 Al2 2_555 . 3_666 86.612(11) ?
Al1 Ca1 Al1 3_665 . 4_665 51.386(18) ?
Al1 Ca1 Al1 3_665 . 5_565 171.386(17) ?
Al1 Ca1 Al1 3_665 . 6_555 68.614(18) ?
Al1 Ca1 Al2 3_665 . 1_565 86.612(11) ?
Al1 Ca1 Al2 3_665 . 1_566 86.612(11) ?
Al1 Ca1 Al2 3_665 . 2_555 135.162(7) ?
Al1 Ca1 Al2 3_665 . 2_556 135.162(7) ?
Al1 Ca1 Al2 3_665 . 3_665 49.458(8) ?
Al1 Ca1 Al2 3_665 . 3_666 49.458(8) ?
Al1 Ca1 Al1 4_665 . 5_565 120.000(17) ?
Al1 Ca1 Al1 4_665 . 6_555 120.000(18) ?
Al1 Ca1 Al2 4_665 . 1_565 49.458(8) ?
Al1 Ca1 Al2 4_665 . 1_566 49.458(8) ?
Al1 Ca1 Al2 4_665 . 2_555 135.162(7) ?
Al1 Ca1 Al2 4_665 . 2_556 135.162(7) ?
Al1 Ca1 Al2 4_665 . 3_665 86.612(11) ?
Al1 Ca1 Al2 4_665 . 3_666 86.612(11) ?
Al1 Ca1 Al1 5_565 . 6_555 120.000(18) ?
Al1 Ca1 Al2 5_565 . 1_565 86.612(10) ?
Al1 Ca1 Al2 5_565 . 1_566 86.612(10) ?
Al1 Ca1 Al2 5_565 . 2_555 49.458(8) ?
Al1 Ca1 Al2 5_565 . 2_556 49.458(8) ?
Al1 Ca1 Al2 5_565 . 3_665 135.162(6) ?
Al1 Ca1 Al2 5_565 . 3_666 135.162(6) ?
Al1 Ca1 Al2 6_555 . 1_565 135.162(7) ?
Al1 Ca1 Al2 6_555 . 1_566 135.162(7) ?
Al1 Ca1 Al2 6_555 . 2_555 86.612(11) ?
Al1 Ca1 Al2 6_555 . 2_556 86.612(11) ?
Al1 Ca1 Al2 6_555 . 3_665 49.458(8) ?
Al1 Ca1 Al2 6_555 . 3_666 49.458(8) ?
Al2 Ca1 Al2 1_565 . 1_566 76.206(7) ?
Al2 Ca1 Al2 1_565 . 2_555 85.918(7) ?
Al2 Ca1 Al2 1_565 . 2_556 133.661(3) ?
Al2 Ca1 Al2 1_565 . 3_665 85.918(5) ?
Al2 Ca1 Al2 1_565 . 3_666 133.661(5) ?
Al2 Ca1 Al2 1_566 . 2_555 133.661(3) ?
Al2 Ca1 Al2 1_566 . 2_556 85.918(7) ?
Al2 Ca1 Al2 1_566 . 3_665 133.661(5) ?
Al2 Ca1 Al2 1_566 . 3_666 85.918(5) ?
Al2 Ca1 Al2 2_555 . 2_556 76.206(7) ?
Al2 Ca1 Al2 2_555 . 3_665 85.918(5) ?
Al2 Ca1 Al2 2_555 . 3_666 133.661(5) ?
Al2 Ca1 Al2 2_556 . 3_665 133.661(5) ?
Al2 Ca1 Al2 2_556 . 3_666 85.918(5) ?
Al2 Ca1 Al2 3_665 . 3_666 76.206(4) ?
Pd Yb2 Pd . . 2_555 120.000(7) ?
Pd Yb2 Pd . . 3_555 120.000(7) ?
Pd Yb2 Pd . . 4_555 180.0(5) ?
Pd Yb2 Pd . . 5_555 60.000(7) ?
Pd Yb2 Pd . . 6_555 60.000(7) ?
Pd Yb2 Al1 . . 1_554 90.000(5) ?
Pd Yb2 Al1 . . . 90.000(5) ?
Pd Yb2 Al1 . . 2_554 46.068(7) ?
Pd Yb2 Al1 . . 2_555 46.068(7) ?
Pd Yb2 Al1 . . 3_554 133.932(12) ?
Pd Yb2 Al1 . . 3_555 133.932(12) ?
Pd Yb2 Al1 . . 4_554 90.000(5) ?
Pd Yb2 Al1 . . 4_555 90.000(5) ?
Pd Yb2 Al1 . . 5_554 133.932(7) ?
Pd Yb2 Al1 . . 5_555 133.932(7) ?
Pd Yb2 Al1 . . 6_554 46.068(12) ?
Pd Yb2 Al1 . . 6_555 46.068(12) ?
Pd Yb2 Pd 2_555 . 3_555 120.000(8) ?
Pd Yb2 Pd 2_555 . 4_555 60.000(7) ?
Pd Yb2 Pd 2_555 . 5_555 180.0(5) ?
Pd Yb2 Pd 2_555 . 6_555 60.000(8) ?
Pd Yb2 Al1 2_555 . 1_554 133.932(7) ?
Pd Yb2 Al1 2_555 . . 133.932(7) ?
Pd Yb2 Al1 2_555 . 2_554 90.000(6) ?
Pd Yb2 Al1 2_555 . 2_555 90.000(6) ?
Pd Yb2 Al1 2_555 . 3_554 46.068(12) ?
Pd Yb2 Al1 2_555 . 3_555 46.068(12) ?
Pd Yb2 Al1 2_555 . 4_554 46.068(7) ?
Pd Yb2 Al1 2_555 . 4_555 46.068(7) ?
Pd Yb2 Al1 2_555 . 5_554 90.000(6) ?
Pd Yb2 Al1 2_555 . 5_555 90.000(6) ?
Pd Yb2 Al1 2_555 . 6_554 133.932(12) ?
Pd Yb2 Al1 2_555 . 6_555 133.932(12) ?
Pd Yb2 Pd 3_555 . 4_555 60.000(7) ?
Pd Yb2 Pd 3_555 . 5_555 60.000(8) ?
Pd Yb2 Pd 3_555 . 6_555 180.0(5) ?
Pd Yb2 Al1 3_555 . 1_554 46.068(6) ?
Pd Yb2 Al1 3_555 . . 46.068(6) ?
Pd Yb2 Al1 3_555 . 2_554 133.932(6) ?
Pd Yb2 Al1 3_555 . 2_555 133.932(6) ?
Pd Yb2 Al1 3_555 . 3_554 90.000(17) ?
Pd Yb2 Al1 3_555 . 3_555 90.000(17) ?
Pd Yb2 Al1 3_555 . 4_554 133.932(6) ?
Pd Yb2 Al1 3_555 . 4_555 133.932(6) ?
Pd Yb2 Al1 3_555 . 5_554 46.068(6) ?
Pd Yb2 Al1 3_555 . 5_555 46.068(6) ?
Pd Yb2 Al1 3_555 . 6_554 90.000(17) ?
Pd Yb2 Al1 3_555 . 6_555 90.000(17) ?
Pd Yb2 Pd 4_555 . 5_555 120.000(7) ?
Pd Yb2 Pd 4_555 . 6_555 120.000(7) ?
Pd Yb2 Al1 4_555 . 1_554 90.000(5) ?
Pd Yb2 Al1 4_555 . . 90.000(5) ?
Pd Yb2 Al1 4_555 . 2_554 133.932(7) ?
Pd Yb2 Al1 4_555 . 2_555 133.932(7) ?
Pd Yb2 Al1 4_555 . 3_554 46.068(12) ?
Pd Yb2 Al1 4_555 . 3_555 46.068(12) ?
Pd Yb2 Al1 4_555 . 4_554 90.000(5) ?
Pd Yb2 Al1 4_555 . 4_555 90.000(5) ?
Pd Yb2 Al1 4_555 . 5_554 46.068(7) ?
Pd Yb2 Al1 4_555 . 5_555 46.068(7) ?
Pd Yb2 Al1 4_555 . 6_554 133.932(12) ?
Pd Yb2 Al1 4_555 . 6_555 133.932(12) ?
Pd Yb2 Pd 5_555 . 6_555 120.000(8) ?
Pd Yb2 Al1 5_555 . 1_554 46.068(7) ?
Pd Yb2 Al1 5_555 . . 46.068(7) ?
Pd Yb2 Al1 5_555 . 2_554 90.000(6) ?
Pd Yb2 Al1 5_555 . 2_555 90.000(6) ?
Pd Yb2 Al1 5_555 . 3_554 133.932(12) ?
Pd Yb2 Al1 5_555 . 3_555 133.932(12) ?
Pd Yb2 Al1 5_555 . 4_554 133.932(7) ?
Pd Yb2 Al1 5_555 . 4_555 133.932(7) ?
Pd Yb2 Al1 5_555 . 5_554 90.000(6) ?
Pd Yb2 Al1 5_555 . 5_555 90.000(6) ?
Pd Yb2 Al1 5_555 . 6_554 46.068(12) ?
Pd Yb2 Al1 5_555 . 6_555 46.068(12) ?
Pd Yb2 Al1 6_555 . 1_554 133.932(6) ?
Pd Yb2 Al1 6_555 . . 133.932(6) ?
Pd Yb2 Al1 6_555 . 2_554 46.068(6) ?
Pd Yb2 Al1 6_555 . 2_555 46.068(6) ?
Pd Yb2 Al1 6_555 . 3_554 90.000(17) ?
Pd Yb2 Al1 6_555 . 3_555 90.000(17) ?
Pd Yb2 Al1 6_555 . 4_554 46.068(6) ?
Pd Yb2 Al1 6_555 . 4_555 46.068(6) ?
Pd Yb2 Al1 6_555 . 5_554 133.932(6) ?
Pd Yb2 Al1 6_555 . 5_555 133.932(6) ?
Pd Yb2 Al1 6_555 . 6_554 90.000(17) ?
Pd Yb2 Al1 6_555 . 6_555 90.000(17) ?
Al1 Yb2 Al1 1_554 . . 73.523(12) ?
Al1 Yb2 Al1 1_554 . 2_554 87.864(8) ?
Al1 Yb2 Al1 1_554 . 2_555 132.773(6) ?
Al1 Yb2 Al1 1_554 . 3_554 87.864(14) ?
Al1 Yb2 Al1 1_554 . 3_555 132.773(16) ?
Al1 Yb2 Al1 1_554 . 4_554 106.477(12) ?
Al1 Yb2 Al1 1_554 . 4_555 180.0(5) ?
Al1 Yb2 Al1 1_554 . 5_554 47.227(6) ?
Al1 Yb2 Al1 1_554 . 5_555 92.136(8) ?
Al1 Yb2 Al1 1_554 . 6_554 47.227(16) ?
Al1 Yb2 Al1 1_554 . 6_555 92.136(14) ?
Al1 Yb2 Al1 . . 2_554 132.773(6) ?
Al1 Yb2 Al1 . . 2_555 87.864(8) ?
Al1 Yb2 Al1 . . 3_554 132.773(16) ?
Al1 Yb2 Al1 . . 3_555 87.864(14) ?
Al1 Yb2 Al1 . . 4_554 180.0(5) ?
Al1 Yb2 Al1 . . 4_555 106.477(12) ?
Al1 Yb2 Al1 . . 5_554 92.136(8) ?
Al1 Yb2 Al1 . . 5_555 47.227(6) ?
Al1 Yb2 Al1 . . 6_554 92.136(14) ?
Al1 Yb2 Al1 . . 6_555 47.227(16) ?
Al1 Yb2 Al1 2_554 . 2_555 73.523(12) ?
Al1 Yb2 Al1 2_554 . 3_554 87.864(14) ?
Al1 Yb2 Al1 2_554 . 3_555 132.773(16) ?
Al1 Yb2 Al1 2_554 . 4_554 47.227(6) ?
Al1 Yb2 Al1 2_554 . 4_555 92.136(8) ?
Al1 Yb2 Al1 2_554 . 5_554 106.477(12) ?
Al1 Yb2 Al1 2_554 . 5_555 180.0(5) ?
Al1 Yb2 Al1 2_554 . 6_554 47.227(16) ?
Al1 Yb2 Al1 2_554 . 6_555 92.136(14) ?
Al1 Yb2 Al1 2_555 . 3_554 132.773(16) ?
Al1 Yb2 Al1 2_555 . 3_555 87.864(14) ?
Al1 Yb2 Al1 2_555 . 4_554 92.136(8) ?
Al1 Yb2 Al1 2_555 . 4_555 47.227(6) ?
Al1 Yb2 Al1 2_555 . 5_554 180.0(5) ?
Al1 Yb2 Al1 2_555 . 5_555 106.477(12) ?
Al1 Yb2 Al1 2_555 . 6_554 92.136(14) ?
Al1 Yb2 Al1 2_555 . 6_555 47.227(16) ?
Al1 Yb2 Al1 3_554 . 3_555 73.523(11) ?
Al1 Yb2 Al1 3_554 . 4_554 47.227(16) ?
Al1 Yb2 Al1 3_554 . 4_555 92.136(14) ?
Al1 Yb2 Al1 3_554 . 5_554 47.227(16) ?
Al1 Yb2 Al1 3_554 . 5_555 92.136(14) ?
Al1 Yb2 Al1 3_554 . 6_554 106.477(11) ?
Al1 Yb2 Al1 3_554 . 6_555 180.0(5) ?
Al1 Yb2 Al1 3_555 . 4_554 92.136(14) ?
Al1 Yb2 Al1 3_555 . 4_555 47.227(16) ?
Al1 Yb2 Al1 3_555 . 5_554 92.136(14) ?
Al1 Yb2 Al1 3_555 . 5_555 47.227(16) ?
Al1 Yb2 Al1 3_555 . 6_554 180.0(5) ?
Al1 Yb2 Al1 3_555 . 6_555 106.477(11) ?
Al1 Yb2 Al1 4_554 . 4_555 73.523(12) ?
Al1 Yb2 Al1 4_554 . 5_554 87.864(8) ?
Al1 Yb2 Al1 4_554 . 5_555 132.773(6) ?
Al1 Yb2 Al1 4_554 . 6_554 87.864(14) ?
Al1 Yb2 Al1 4_554 . 6_555 132.773(16) ?
Al1 Yb2 Al1 4_555 . 5_554 132.773(6) ?
Al1 Yb2 Al1 4_555 . 5_555 87.864(8) ?
Al1 Yb2 Al1 4_555 . 6_554 132.773(16) ?
Al1 Yb2 Al1 4_555 . 6_555 87.864(14) ?
Al1 Yb2 Al1 5_554 . 5_555 73.523(12) ?
Al1 Yb2 Al1 5_554 . 6_554 87.864(14) ?
Al1 Yb2 Al1 5_554 . 6_555 132.773(16) ?
Al1 Yb2 Al1 5_555 . 6_554 132.773(16) ?
Al1 Yb2 Al1 5_555 . 6_555 87.864(14) ?
Al1 Yb2 Al1 6_554 . 6_555 73.523(11) ?
Pd Ca2 Pd . . 2_555 120.000(7) ?
Pd Ca2 Pd . . 3_555 120.000(7) ?
Pd Ca2 Pd . . 4_555 180.0(5) ?
Pd Ca2 Pd . . 5_555 60.000(7) ?
Pd Ca2 Pd . . 6_555 60.000(7) ?
Pd Ca2 Al1 . . 1_554 90.000(5) ?
Pd Ca2 Al1 . . . 90.000(5) ?
Pd Ca2 Al1 . . 2_554 46.068(7) ?
Pd Ca2 Al1 . . 2_555 46.068(7) ?
Pd Ca2 Al1 . . 3_554 133.932(12) ?
Pd Ca2 Al1 . . 3_555 133.932(12) ?
Pd Ca2 Al1 . . 4_554 90.000(5) ?
Pd Ca2 Al1 . . 4_555 90.000(5) ?
Pd Ca2 Al1 . . 5_554 133.932(7) ?
Pd Ca2 Al1 . . 5_555 133.932(7) ?
Pd Ca2 Al1 . . 6_554 46.068(12) ?
Pd Ca2 Al1 . . 6_555 46.068(12) ?
Pd Ca2 Pd 2_555 . 3_555 120.000(8) ?
Pd Ca2 Pd 2_555 . 4_555 60.000(7) ?
Pd Ca2 Pd 2_555 . 5_555 180.0(5) ?
Pd Ca2 Pd 2_555 . 6_555 60.000(8) ?
Pd Ca2 Al1 2_555 . 1_554 133.932(7) ?
Pd Ca2 Al1 2_555 . . 133.932(7) ?
Pd Ca2 Al1 2_555 . 2_554 90.000(6) ?
Pd Ca2 Al1 2_555 . 2_555 90.000(6) ?
Pd Ca2 Al1 2_555 . 3_554 46.068(12) ?
Pd Ca2 Al1 2_555 . 3_555 46.068(12) ?
Pd Ca2 Al1 2_555 . 4_554 46.068(7) ?
Pd Ca2 Al1 2_555 . 4_555 46.068(7) ?
Pd Ca2 Al1 2_555 . 5_554 90.000(6) ?
Pd Ca2 Al1 2_555 . 5_555 90.000(6) ?
Pd Ca2 Al1 2_555 . 6_554 133.932(12) ?
Pd Ca2 Al1 2_555 . 6_555 133.932(12) ?
Pd Ca2 Pd 3_555 . 4_555 60.000(7) ?
Pd Ca2 Pd 3_555 . 5_555 60.000(8) ?
Pd Ca2 Pd 3_555 . 6_555 180.0(5) ?
Pd Ca2 Al1 3_555 . 1_554 46.068(6) ?
Pd Ca2 Al1 3_555 . . 46.068(6) ?
Pd Ca2 Al1 3_555 . 2_554 133.932(6) ?
Pd Ca2 Al1 3_555 . 2_555 133.932(6) ?
Pd Ca2 Al1 3_555 . 3_554 90.000(17) ?
Pd Ca2 Al1 3_555 . 3_555 90.000(17) ?
Pd Ca2 Al1 3_555 . 4_554 133.932(6) ?
Pd Ca2 Al1 3_555 . 4_555 133.932(6) ?
Pd Ca2 Al1 3_555 . 5_554 46.068(6) ?
Pd Ca2 Al1 3_555 . 5_555 46.068(6) ?
Pd Ca2 Al1 3_555 . 6_554 90.000(17) ?
Pd Ca2 Al1 3_555 . 6_555 90.000(17) ?
Pd Ca2 Pd 4_555 . 5_555 120.000(7) ?
Pd Ca2 Pd 4_555 . 6_555 120.000(7) ?
Pd Ca2 Al1 4_555 . 1_554 90.000(5) ?
Pd Ca2 Al1 4_555 . . 90.000(5) ?
Pd Ca2 Al1 4_555 . 2_554 133.932(7) ?
Pd Ca2 Al1 4_555 . 2_555 133.932(7) ?
Pd Ca2 Al1 4_555 . 3_554 46.068(12) ?
Pd Ca2 Al1 4_555 . 3_555 46.068(12) ?
Pd Ca2 Al1 4_555 . 4_554 90.000(5) ?
Pd Ca2 Al1 4_555 . 4_555 90.000(5) ?
Pd Ca2 Al1 4_555 . 5_554 46.068(7) ?
Pd Ca2 Al1 4_555 . 5_555 46.068(7) ?
Pd Ca2 Al1 4_555 . 6_554 133.932(12) ?
Pd Ca2 Al1 4_555 . 6_555 133.932(12) ?
Pd Ca2 Pd 5_555 . 6_555 120.000(8) ?
Pd Ca2 Al1 5_555 . 1_554 46.068(7) ?
Pd Ca2 Al1 5_555 . . 46.068(7) ?
Pd Ca2 Al1 5_555 . 2_554 90.000(6) ?
Pd Ca2 Al1 5_555 . 2_555 90.000(6) ?
Pd Ca2 Al1 5_555 . 3_554 133.932(12) ?
Pd Ca2 Al1 5_555 . 3_555 133.932(12) ?
Pd Ca2 Al1 5_555 . 4_554 133.932(7) ?
Pd Ca2 Al1 5_555 . 4_555 133.932(7) ?
Pd Ca2 Al1 5_555 . 5_554 90.000(6) ?
Pd Ca2 Al1 5_555 . 5_555 90.000(6) ?
Pd Ca2 Al1 5_555 . 6_554 46.068(12) ?
Pd Ca2 Al1 5_555 . 6_555 46.068(12) ?
Pd Ca2 Al1 6_555 . 1_554 133.932(6) ?
Pd Ca2 Al1 6_555 . . 133.932(6) ?
Pd Ca2 Al1 6_555 . 2_554 46.068(6) ?
Pd Ca2 Al1 6_555 . 2_555 46.068(6) ?
Pd Ca2 Al1 6_555 . 3_554 90.000(17) ?
Pd Ca2 Al1 6_555 . 3_555 90.000(17) ?
Pd Ca2 Al1 6_555 . 4_554 46.068(6) ?
Pd Ca2 Al1 6_555 . 4_555 46.068(6) ?
Pd Ca2 Al1 6_555 . 5_554 133.932(6) ?
Pd Ca2 Al1 6_555 . 5_555 133.932(6) ?
Pd Ca2 Al1 6_555 . 6_554 90.000(17) ?
Pd Ca2 Al1 6_555 . 6_555 90.000(17) ?
Al1 Ca2 Al1 1_554 . . 73.523(12) ?
Al1 Ca2 Al1 1_554 . 2_554 87.864(8) ?
Al1 Ca2 Al1 1_554 . 2_555 132.773(6) ?
Al1 Ca2 Al1 1_554 . 3_554 87.864(14) ?
Al1 Ca2 Al1 1_554 . 3_555 132.773(16) ?
Al1 Ca2 Al1 1_554 . 4_554 106.477(12) ?
Al1 Ca2 Al1 1_554 . 4_555 180.0(5) ?
Al1 Ca2 Al1 1_554 . 5_554 47.227(6) ?
Al1 Ca2 Al1 1_554 . 5_555 92.136(8) ?
Al1 Ca2 Al1 1_554 . 6_554 47.227(16) ?
Al1 Ca2 Al1 1_554 . 6_555 92.136(14) ?
Al1 Ca2 Al1 . . 2_554 132.773(6) ?
Al1 Ca2 Al1 . . 2_555 87.864(8) ?
Al1 Ca2 Al1 . . 3_554 132.773(16) ?
Al1 Ca2 Al1 . . 3_555 87.864(14) ?
Al1 Ca2 Al1 . . 4_554 180.0(5) ?
Al1 Ca2 Al1 . . 4_555 106.477(12) ?
Al1 Ca2 Al1 . . 5_554 92.136(8) ?
Al1 Ca2 Al1 . . 5_555 47.227(6) ?
Al1 Ca2 Al1 . . 6_554 92.136(14) ?
Al1 Ca2 Al1 . . 6_555 47.227(16) ?
Al1 Ca2 Al1 2_554 . 2_555 73.523(12) ?
Al1 Ca2 Al1 2_554 . 3_554 87.864(14) ?
Al1 Ca2 Al1 2_554 . 3_555 132.773(16) ?
Al1 Ca2 Al1 2_554 . 4_554 47.227(6) ?
Al1 Ca2 Al1 2_554 . 4_555 92.136(8) ?
Al1 Ca2 Al1 2_554 . 5_554 106.477(12) ?
Al1 Ca2 Al1 2_554 . 5_555 180.0(5) ?
Al1 Ca2 Al1 2_554 . 6_554 47.227(16) ?
Al1 Ca2 Al1 2_554 . 6_555 92.136(14) ?
Al1 Ca2 Al1 2_555 . 3_554 132.773(16) ?
Al1 Ca2 Al1 2_555 . 3_555 87.864(14) ?
Al1 Ca2 Al1 2_555 . 4_554 92.136(8) ?
Al1 Ca2 Al1 2_555 . 4_555 47.227(6) ?
Al1 Ca2 Al1 2_555 . 5_554 180.0(5) ?
Al1 Ca2 Al1 2_555 . 5_555 106.477(12) ?
Al1 Ca2 Al1 2_555 . 6_554 92.136(14) ?
Al1 Ca2 Al1 2_555 . 6_555 47.227(16) ?
Al1 Ca2 Al1 3_554 . 3_555 73.523(11) ?
Al1 Ca2 Al1 3_554 . 4_554 47.227(16) ?
Al1 Ca2 Al1 3_554 . 4_555 92.136(14) ?
Al1 Ca2 Al1 3_554 . 5_554 47.227(16) ?
Al1 Ca2 Al1 3_554 . 5_555 92.136(14) ?
Al1 Ca2 Al1 3_554 . 6_554 106.477(11) ?
Al1 Ca2 Al1 3_554 . 6_555 180.0(5) ?
Al1 Ca2 Al1 3_555 . 4_554 92.136(14) ?
Al1 Ca2 Al1 3_555 . 4_555 47.227(16) ?
Al1 Ca2 Al1 3_555 . 5_554 92.136(14) ?
Al1 Ca2 Al1 3_555 . 5_555 47.227(16) ?
Al1 Ca2 Al1 3_555 . 6_554 180.0(5) ?
Al1 Ca2 Al1 3_555 . 6_555 106.477(11) ?
Al1 Ca2 Al1 4_554 . 4_555 73.523(12) ?
Al1 Ca2 Al1 4_554 . 5_554 87.864(8) ?
Al1 Ca2 Al1 4_554 . 5_555 132.773(6) ?
Al1 Ca2 Al1 4_554 . 6_554 87.864(14) ?
Al1 Ca2 Al1 4_554 . 6_555 132.773(16) ?
Al1 Ca2 Al1 4_555 . 5_554 132.773(6) ?
Al1 Ca2 Al1 4_555 . 5_555 87.864(8) ?
Al1 Ca2 Al1 4_555 . 6_554 132.773(16) ?
Al1 Ca2 Al1 4_555 . 6_555 87.864(14) ?
Al1 Ca2 Al1 5_554 . 5_555 73.523(12) ?
Al1 Ca2 Al1 5_554 . 6_554 87.864(14) ?
Al1 Ca2 Al1 5_554 . 6_555 132.773(16) ?
Al1 Ca2 Al1 5_555 . 6_554 132.773(16) ?
Al1 Ca2 Al1 5_555 . 6_555 87.864(14) ?
Al1 Ca2 Al1 6_554 . 6_555 73.523(11) ?
Yb1 Pd Yb1 1_554 . . 82.508(8) ?
Yb1 Pd Ca1 1_554 . 1_554 0.0(5) ?
Yb1 Pd Ca1 1_554 . . 82.508(8) ?
Yb1 Pd Yb2 1_554 . . 138.746(4) ?
Yb1 Pd Ca2 1_554 . . 138.746(4) ?
Yb1 Pd Pd 1_554 . 5_555 112.080(6) ?
Yb1 Pd Pd 1_554 . 6_555 112.080(6) ?
Yb1 Pd Al1 1_554 . 2_554 67.486(13) ?
Yb1 Pd Al1 1_554 . 2_555 133.628(19) ?
Yb1 Pd Al1 1_554 . 6_554 67.486(17) ?
Yb1 Pd Al1 1_554 . 6_555 133.628(13) ?
Yb1 Pd Al2 1_554 . 2_555 71.859(6) ?
Yb1 Pd Al2 1_554 . 3_665 71.859(5) ?
Yb1 Pd Ca1 . . 1_554 82.508(8) ?
Yb1 Pd Ca1 . . . 0.0(5) ?
Yb1 Pd Yb2 . . . 138.746(4) ?
Yb1 Pd Ca2 . . . 138.746(4) ?
Yb1 Pd Pd . . 5_555 112.080(6) ?
Yb1 Pd Pd . . 6_555 112.080(6) ?
Yb1 Pd Al1 . . 2_554 133.628(19) ?
Yb1 Pd Al1 . . 2_555 67.486(13) ?
Yb1 Pd Al1 . . 6_554 133.628(13) ?
Yb1 Pd Al1 . . 6_555 67.486(17) ?
Yb1 Pd Al2 . . 2_555 71.859(6) ?
Yb1 Pd Al2 . . 3_665 71.859(5) ?
Ca1 Pd Ca1 1_554 . . 82.508(8) ?
Ca1 Pd Yb2 1_554 . . 138.746(4) ?
Ca1 Pd Ca2 1_554 . . 138.746(4) ?
Ca1 Pd Pd 1_554 . 5_555 112.080(6) ?
Ca1 Pd Pd 1_554 . 6_555 112.080(6) ?
Ca1 Pd Al1 1_554 . 2_554 67.486(13) ?
Ca1 Pd Al1 1_554 . 2_555 133.628(19) ?
Ca1 Pd Al1 1_554 . 6_554 67.486(17) ?
Ca1 Pd Al1 1_554 . 6_555 133.628(13) ?
Ca1 Pd Al2 1_554 . 2_555 71.859(6) ?
Ca1 Pd Al2 1_554 . 3_665 71.859(5) ?
Ca1 Pd Yb2 . . . 138.746(4) ?
Ca1 Pd Ca2 . . . 138.746(4) ?
Ca1 Pd Pd . . 5_555 112.080(6) ?
Ca1 Pd Pd . . 6_555 112.080(6) ?
Ca1 Pd Al1 . . 2_554 133.628(19) ?
Ca1 Pd Al1 . . 2_555 67.486(13) ?
Ca1 Pd Al1 . . 6_554 133.628(13) ?
Ca1 Pd Al1 . . 6_555 67.486(17) ?
Ca1 Pd Al2 . . 2_555 71.859(6) ?
Ca1 Pd Al2 . . 3_665 71.859(5) ?
Yb2 Pd Ca2 . . . 0.0(5) ?
Yb2 Pd Pd . . 5_555 60.000(8) ?
Yb2 Pd Pd . . 6_555 60.000(6) ?
Yb2 Pd Al1 . . 2_554 78.216(16) ?
Yb2 Pd Al1 . . 2_555 78.216(16) ?
Yb2 Pd Al1 . . 6_554 78.216(15) ?
Yb2 Pd Al1 . . 6_555 78.216(15) ?
Yb2 Pd Al2 . . 2_555 114.467(7) ?
Yb2 Pd Al2 . . 3_665 114.466(8) ?
Ca2 Pd Pd . . 5_555 60.000(8) ?
Ca2 Pd Pd . . 6_555 60.000(6) ?
Ca2 Pd Al1 . . 2_554 78.216(16) ?
Ca2 Pd Al1 . . 2_555 78.216(16) ?
Ca2 Pd Al1 . . 6_554 78.216(15) ?
Ca2 Pd Al1 . . 6_555 78.216(15) ?
Ca2 Pd Al2 . . 2_555 114.467(7) ?
Ca2 Pd Al2 . . 3_665 114.466(8) ?
Pd Pd Pd 5_555 . 6_555 120.000(9) ?
Pd Pd Al1 5_555 . 2_554 111.681(16) ?
Pd Pd Al1 5_555 . 2_555 111.681(16) ?
Pd Pd Al1 5_555 . 6_554 54.994(18) ?
Pd Pd Al1 5_555 . 6_555 54.994(18) ?
Pd Pd Al2 5_555 . 2_555 174.467(6) ?
Pd Pd Al2 5_555 . 3_665 54.466(7) ?
Pd Pd Al1 6_555 . 2_554 54.994(4) ?
Pd Pd Al1 6_555 . 2_555 54.994(4) ?
Pd Pd Al1 6_555 . 6_554 111.681(13) ?
Pd Pd Al1 6_555 . 6_555 111.681(13) ?
Pd Pd Al2 6_555 . 2_555 54.467(7) ?
Pd Pd Al2 6_555 . 3_665 174.466(8) ?
Al1 Pd Al1 2_554 . 2_555 108.883(8) ?
Al1 Pd Al1 2_554 . 6_554 65.980(19) ?
Al1 Pd Al1 2_554 . 6_555 156.43(2) ?
Al1 Pd Al2 2_554 . 2_555 65.731(15) ?
Al1 Pd Al2 2_554 . 3_665 125.463(4) ?
Al1 Pd Al1 2_555 . 6_554 156.43(2) ?
Al1 Pd Al1 2_555 . 6_555 65.980(19) ?
Al1 Pd Al2 2_555 . 2_555 65.731(15) ?
Al1 Pd Al2 2_555 . 3_665 125.463(4) ?
Al1 Pd Al1 6_554 . 6_555 108.88(3) ?
Al1 Pd Al2 6_554 . 2_555 125.463(18) ?
Al1 Pd Al2 6_554 . 3_665 65.731(14) ?
Al1 Pd Al2 6_555 . 2_555 125.463(18) ?
Al1 Pd Al2 6_555 . 3_665 65.731(14) ?
Al2 Pd Al2 2_555 . 3_665 131.067(8) ?
Yb1 Al1 Yb1 1_545 . 4_665 111.39(2) ?
Yb1 Al1 Ca1 1_545 . 1_545 0.0(5) ?
Yb1 Al1 Ca1 1_545 . 4_665 111.39(2) ?
Yb1 Al1 Yb2 1_545 . . 116.843(7) ?
Yb1 Al1 Yb2 1_545 . 1_556 116.843(7) ?
Yb1 Al1 Ca2 1_545 . . 116.843(7) ?
Yb1 Al1 Ca2 1_545 . 1_556 116.843(7) ?
Yb1 Al1 Pd 1_545 . 3_555 65.159(8) ?
Yb1 Al1 Pd 1_545 . 3_556 65.159(8) ?
Yb1 Al1 Pd 1_545 . 5_555 121.845(15) ?
Yb1 Al1 Pd 1_545 . 5_556 121.845(15) ?
Yb1 Al1 Al1 1_545 . 4_655 55.693(12) ?
Yb1 Al1 Al1 1_545 . 5_555 64.307(15) ?
Yb1 Al1 Al1 1_545 . 6_555 175.69(3) ?
Yb1 Al1 Al2 1_545 . . 68.286(12) ?
Yb1 Al1 Al2 1_545 . 1_556 68.286(12) ?
Yb1 Al1 Ca1 4_665 . 1_545 111.39(2) ?
Yb1 Al1 Ca1 4_665 . 4_665 0.0(5) ?
Yb1 Al1 Yb2 4_665 . . 116.843(8) ?
Yb1 Al1 Yb2 4_665 . 1_556 116.843(8) ?
Yb1 Al1 Ca2 4_665 . . 116.843(8) ?
Yb1 Al1 Ca2 4_665 . 1_556 116.843(8) ?
Yb1 Al1 Pd 4_665 . 3_555 121.845(14) ?
Yb1 Al1 Pd 4_665 . 3_556 121.845(14) ?
Yb1 Al1 Pd 4_665 . 5_555 65.159(8) ?
Yb1 Al1 Pd 4_665 . 5_556 65.159(8) ?
Yb1 Al1 Al1 4_665 . 4_655 55.693(13) ?
Yb1 Al1 Al1 4_665 . 5_555 175.69(3) ?
Yb1 Al1 Al1 4_665 . 6_555 64.307(15) ?
Yb1 Al1 Al2 4_665 . . 68.286(13) ?
Yb1 Al1 Al2 4_665 . 1_556 68.286(13) ?
Ca1 Al1 Ca1 1_545 . 4_665 111.39(2) ?
Ca1 Al1 Yb2 1_545 . . 116.843(7) ?
Ca1 Al1 Yb2 1_545 . 1_556 116.843(7) ?
Ca1 Al1 Ca2 1_545 . . 116.843(7) ?
Ca1 Al1 Ca2 1_545 . 1_556 116.843(7) ?
Ca1 Al1 Pd 1_545 . 3_555 65.159(8) ?
Ca1 Al1 Pd 1_545 . 3_556 65.159(8) ?
Ca1 Al1 Pd 1_545 . 5_555 121.845(15) ?
Ca1 Al1 Pd 1_545 . 5_556 121.845(15) ?
Ca1 Al1 Al1 1_545 . 4_655 55.693(12) ?
Ca1 Al1 Al1 1_545 . 5_555 64.307(15) ?
Ca1 Al1 Al1 1_545 . 6_555 175.69(3) ?
Ca1 Al1 Al2 1_545 . . 68.286(12) ?
Ca1 Al1 Al2 1_545 . 1_556 68.286(12) ?
Ca1 Al1 Yb2 4_665 . . 116.843(8) ?
Ca1 Al1 Yb2 4_665 . 1_556 116.843(8) ?
Ca1 Al1 Ca2 4_665 . . 116.843(8) ?
Ca1 Al1 Ca2 4_665 . 1_556 116.843(8) ?
Ca1 Al1 Pd 4_665 . 3_555 121.845(14) ?
Ca1 Al1 Pd 4_665 . 3_556 121.845(14) ?
Ca1 Al1 Pd 4_665 . 5_555 65.159(8) ?
Ca1 Al1 Pd 4_665 . 5_556 65.159(8) ?
Ca1 Al1 Al1 4_665 . 4_655 55.693(13) ?
Ca1 Al1 Al1 4_665 . 5_555 175.69(3) ?
Ca1 Al1 Al1 4_665 . 6_555 64.307(15) ?
Ca1 Al1 Al2 4_665 . . 68.286(13) ?
Ca1 Al1 Al2 4_665 . 1_556 68.286(13) ?
Yb2 Al1 Yb2 . . 1_556 73.523(16) ?
Yb2 Al1 Ca2 . . . 0.0(5) ?
Yb2 Al1 Ca2 . . 1_556 73.523(16) ?
Yb2 Al1 Pd . . 3_555 55.716(11) ?
Yb2 Al1 Pd . . 3_556 114.23(2) ?
Yb2 Al1 Pd . . 5_555 55.716(12) ?
Yb2 Al1 Pd . . 5_556 114.23(2) ?
Yb2 Al1 Al1 . . 4_655 143.239(8) ?
Yb2 Al1 Al1 . . 5_555 66.386(17) ?
Yb2 Al1 Al1 . . 6_555 66.386(17) ?
Yb2 Al1 Al2 . . . 94.266(7) ?
Yb2 Al1 Al2 . . 1_556 167.79(2) ?
Yb2 Al1 Ca2 1_556 . . 73.523(16) ?
Yb2 Al1 Ca2 1_556 . 1_556 0.0(5) ?
Yb2 Al1 Pd 1_556 . 3_555 114.23(2) ?
Yb2 Al1 Pd 1_556 . 3_556 55.716(11) ?
Yb2 Al1 Pd 1_556 . 5_555 114.23(2) ?
Yb2 Al1 Pd 1_556 . 5_556 55.716(12) ?
Yb2 Al1 Al1 1_556 . 4_655 143.239(8) ?
Yb2 Al1 Al1 1_556 . 5_555 66.386(17) ?
Yb2 Al1 Al1 1_556 . 6_555 66.386(17) ?
Yb2 Al1 Al2 1_556 . . 167.79(2) ?
Yb2 Al1 Al2 1_556 . 1_556 94.266(7) ?
Ca2 Al1 Ca2 . . 1_556 73.523(16) ?
Ca2 Al1 Pd . . 3_555 55.716(11) ?
Ca2 Al1 Pd . . 3_556 114.23(2) ?
Ca2 Al1 Pd . . 5_555 55.716(12) ?
Ca2 Al1 Pd . . 5_556 114.23(2) ?
Ca2 Al1 Al1 . . 4_655 143.239(8) ?
Ca2 Al1 Al1 . . 5_555 66.386(17) ?
Ca2 Al1 Al1 . . 6_555 66.386(17) ?
Ca2 Al1 Al2 . . . 94.266(7) ?
Ca2 Al1 Al2 . . 1_556 167.79(2) ?
Ca2 Al1 Pd 1_556 . 3_555 114.23(2) ?
Ca2 Al1 Pd 1_556 . 3_556 55.716(11) ?
Ca2 Al1 Pd 1_556 . 5_555 114.23(2) ?
Ca2 Al1 Pd 1_556 . 5_556 55.716(12) ?
Ca2 Al1 Al1 1_556 . 4_655 143.239(8) ?
Ca2 Al1 Al1 1_556 . 5_555 66.386(17) ?
Ca2 Al1 Al1 1_556 . 6_555 66.386(17) ?
Ca2 Al1 Al2 1_556 . . 167.79(2) ?
Ca2 Al1 Al2 1_556 . 1_556 94.266(7) ?
Pd Al1 Pd 3_555 . 3_556 108.883(9) ?
Pd Al1 Pd 3_555 . 5_555 70.011(8) ?
Pd Al1 Pd 3_555 . 5_556 169.05(4) ?
Pd Al1 Al1 3_555 . 4_655 95.474(18) ?
Pd Al1 Al1 3_555 . 5_555 57.010(8) ?
Pd Al1 Al1 3_555 . 6_555 116.686(18) ?
Pd Al1 Al2 3_555 . . 56.557(9) ?
Pd Al1 Al2 3_555 . 1_556 132.56(2) ?
Pd Al1 Pd 3_556 . 5_555 169.05(4) ?
Pd Al1 Pd 3_556 . 5_556 70.011(8) ?
Pd Al1 Al1 3_556 . 4_655 95.474(18) ?
Pd Al1 Al1 3_556 . 5_555 57.010(8) ?
Pd Al1 Al1 3_556 . 6_555 116.686(18) ?
Pd Al1 Al2 3_556 . . 132.56(2) ?
Pd Al1 Al2 3_556 . 1_556 56.557(9) ?
Pd Al1 Pd 5_555 . 5_556 108.883(9) ?
Pd Al1 Al1 5_555 . 4_655 95.474(18) ?
Pd Al1 Al1 5_555 . 5_555 116.687(18) ?
Pd Al1 Al1 5_555 . 6_555 57.010(9) ?
Pd Al1 Al2 5_555 . . 56.557(8) ?
Pd Al1 Al2 5_555 . 1_556 132.56(2) ?
Pd Al1 Al1 5_556 . 4_655 95.474(18) ?
Pd Al1 Al1 5_556 . 5_555 116.687(18) ?
Pd Al1 Al1 5_556 . 6_555 57.010(9) ?
Pd Al1 Al2 5_556 . . 132.56(2) ?
Pd Al1 Al2 5_556 . 1_556 56.557(8) ?
Al1 Al1 Al1 4_655 . 5_555 120.00(2) ?
Al1 Al1 Al1 4_655 . 6_555 120.00(2) ?
Al1 Al1 Al2 4_655 . . 48.973(12) ?
Al1 Al1 Al2 4_655 . 1_556 48.973(12) ?
Al1 Al1 Al1 5_555 . 6_555 120.00(3) ?
Al1 Al1 Al2 5_555 . . 109.160(10) ?
Al1 Al1 Al2 5_555 . 1_556 109.160(10) ?
Al1 Al1 Al2 6_555 . . 109.160(9) ?
Al1 Al1 Al2 6_555 . 1_556 109.160(9) ?
Al2 Al1 Al2 . . 1_556 97.95(2) ?
Yb1 Al2 Yb1 1_544 . 1_545 76.206(7) ?
Yb1 Al2 Yb1 1_544 . 4_664 103.794(7) ?
Yb1 Al2 Yb1 1_544 . 4_665 180.0(5) ?
Yb1 Al2 Ca1 1_544 . 1_544 0.0(5) ?
Yb1 Al2 Ca1 1_544 . 1_545 76.206(7) ?
Yb1 Al2 Ca1 1_544 . 4_664 103.794(7) ?
Yb1 Al2 Ca1 1_544 . 4_665 180.0(5) ?
Yb1 Al2 Pd 1_544 . 2_655 62.785(5) ?
Yb1 Al2 Pd 1_544 . 3_555 62.785(5) ?
Yb1 Al2 Pd 1_544 . 5_555 117.215(5) ?
Yb1 Al2 Pd 1_544 . 6_655 117.215(5) ?
Yb1 Al2 Al1 1_544 . 1_554 62.256(7) ?
Yb1 Al2 Al1 1_544 . . 117.744(8) ?
Yb1 Al2 Al1 1_544 . 4_654 62.256(8) ?
Yb1 Al2 Al1 1_544 . 4_655 117.744(7) ?
Yb1 Al2 Yb1 1_545 . 4_664 180.0(5) ?
Yb1 Al2 Yb1 1_545 . 4_665 103.794(7) ?
Yb1 Al2 Ca1 1_545 . 1_544 76.206(7) ?
Yb1 Al2 Ca1 1_545 . 1_545 0.0(5) ?
Yb1 Al2 Ca1 1_545 . 4_664 180.0(5) ?
Yb1 Al2 Ca1 1_545 . 4_665 103.794(7) ?
Yb1 Al2 Pd 1_545 . 2_655 62.785(5) ?
Yb1 Al2 Pd 1_545 . 3_555 62.785(5) ?
Yb1 Al2 Pd 1_545 . 5_555 117.215(5) ?
Yb1 Al2 Pd 1_545 . 6_655 117.215(5) ?
Yb1 Al2 Al1 1_545 . 1_554 117.744(8) ?
Yb1 Al2 Al1 1_545 . . 62.256(7) ?
Yb1 Al2 Al1 1_545 . 4_654 117.744(7) ?
Yb1 Al2 Al1 1_545 . 4_655 62.256(8) ?
Yb1 Al2 Yb1 4_664 . 4_665 76.206(7) ?
Yb1 Al2 Ca1 4_664 . 1_544 103.794(7) ?
Yb1 Al2 Ca1 4_664 . 1_545 180.0(5) ?
Yb1 Al2 Ca1 4_664 . 4_664 0.0(5) ?
Yb1 Al2 Ca1 4_664 . 4_665 76.206(7) ?
Yb1 Al2 Pd 4_664 . 2_655 117.215(5) ?
Yb1 Al2 Pd 4_664 . 3_555 117.215(5) ?
Yb1 Al2 Pd 4_664 . 5_555 62.785(5) ?
Yb1 Al2 Pd 4_664 . 6_655 62.785(5) ?
Yb1 Al2 Al1 4_664 . 1_554 62.256(8) ?
Yb1 Al2 Al1 4_664 . . 117.744(7) ?
Yb1 Al2 Al1 4_664 . 4_654 62.256(7) ?
Yb1 Al2 Al1 4_664 . 4_655 117.744(8) ?
Yb1 Al2 Ca1 4_665 . 1_544 180.0(5) ?
Yb1 Al2 Ca1 4_665 . 1_545 103.794(7) ?
Yb1 Al2 Ca1 4_665 . 4_664 76.206(7) ?
Yb1 Al2 Ca1 4_665 . 4_665 0.0(5) ?
Yb1 Al2 Pd 4_665 . 2_655 117.215(5) ?
Yb1 Al2 Pd 4_665 . 3_555 117.215(5) ?
Yb1 Al2 Pd 4_665 . 5_555 62.785(5) ?
Yb1 Al2 Pd 4_665 . 6_655 62.785(5) ?
Yb1 Al2 Al1 4_665 . 1_554 117.744(7) ?
Yb1 Al2 Al1 4_665 . . 62.256(8) ?
Yb1 Al2 Al1 4_665 . 4_654 117.744(8) ?
Yb1 Al2 Al1 4_665 . 4_655 62.256(7) ?
Ca1 Al2 Ca1 1_544 . 1_545 76.206(7) ?
Ca1 Al2 Ca1 1_544 . 4_664 103.794(7) ?
Ca1 Al2 Ca1 1_544 . 4_665 180.0(5) ?
Ca1 Al2 Pd 1_544 . 2_655 62.785(5) ?
Ca1 Al2 Pd 1_544 . 3_555 62.785(5) ?
Ca1 Al2 Pd 1_544 . 5_555 117.215(5) ?
Ca1 Al2 Pd 1_544 . 6_655 117.215(5) ?
Ca1 Al2 Al1 1_544 . 1_554 62.256(7) ?
Ca1 Al2 Al1 1_544 . . 117.744(8) ?
Ca1 Al2 Al1 1_544 . 4_654 62.256(8) ?
Ca1 Al2 Al1 1_544 . 4_655 117.744(7) ?
Ca1 Al2 Ca1 1_545 . 4_664 180.0(5) ?
Ca1 Al2 Ca1 1_545 . 4_665 103.794(7) ?
Ca1 Al2 Pd 1_545 . 2_655 62.785(5) ?
Ca1 Al2 Pd 1_545 . 3_555 62.785(5) ?
Ca1 Al2 Pd 1_545 . 5_555 117.215(5) ?
Ca1 Al2 Pd 1_545 . 6_655 117.215(5) ?
Ca1 Al2 Al1 1_545 . 1_554 117.744(8) ?
Ca1 Al2 Al1 1_545 . . 62.256(7) ?
Ca1 Al2 Al1 1_545 . 4_654 117.744(7) ?
Ca1 Al2 Al1 1_545 . 4_655 62.256(8) ?
Ca1 Al2 Ca1 4_664 . 4_665 76.206(7) ?
Ca1 Al2 Pd 4_664 . 2_655 117.215(5) ?
Ca1 Al2 Pd 4_664 . 3_555 117.215(5) ?
Ca1 Al2 Pd 4_664 . 5_555 62.785(5) ?
Ca1 Al2 Pd 4_664 . 6_655 62.785(5) ?
Ca1 Al2 Al1 4_664 . 1_554 62.256(8) ?
Ca1 Al2 Al1 4_664 . . 117.744(7) ?
Ca1 Al2 Al1 4_664 . 4_654 62.256(7) ?
Ca1 Al2 Al1 4_664 . 4_655 117.744(8) ?
Ca1 Al2 Pd 4_665 . 2_655 117.215(5) ?
Ca1 Al2 Pd 4_665 . 3_555 117.215(5) ?
Ca1 Al2 Pd 4_665 . 5_555 62.785(5) ?
Ca1 Al2 Pd 4_665 . 6_655 62.785(5) ?
Ca1 Al2 Al1 4_665 . 1_554 117.744(7) ?
Ca1 Al2 Al1 4_665 . . 62.256(8) ?
Ca1 Al2 Al1 4_665 . 4_654 117.744(8) ?
Ca1 Al2 Al1 4_665 . 4_655 62.256(7) ?
Pd Al2 Pd 2_655 . 3_555 108.933(8) ?
Pd Al2 Pd 2_655 . 5_555 180.0(5) ?
Pd Al2 Pd 2_655 . 6_655 71.067(8) ?
Pd Al2 Al1 2_655 . 1_554 122.288(9) ?
Pd Al2 Al1 2_655 . . 122.288(9) ?
Pd Al2 Al1 2_655 . 4_654 57.712(9) ?
Pd Al2 Al1 2_655 . 4_655 57.712(9) ?
Pd Al2 Pd 3_555 . 5_555 71.067(8) ?
Pd Al2 Pd 3_555 . 6_655 180.0(5) ?
Pd Al2 Al1 3_555 . 1_554 57.712(10) ?
Pd Al2 Al1 3_555 . . 57.712(10) ?
Pd Al2 Al1 3_555 . 4_654 122.288(10) ?
Pd Al2 Al1 3_555 . 4_655 122.288(10) ?
Pd Al2 Pd 5_555 . 6_655 108.933(8) ?
Pd Al2 Al1 5_555 . 1_554 57.712(9) ?
Pd Al2 Al1 5_555 . . 57.712(9) ?
Pd Al2 Al1 5_555 . 4_654 122.288(9) ?
Pd Al2 Al1 5_555 . 4_655 122.288(9) ?
Pd Al2 Al1 6_655 . 1_554 122.288(10) ?
Pd Al2 Al1 6_655 . . 122.288(10) ?
Pd Al2 Al1 6_655 . 4_654 57.712(10) ?
Pd Al2 Al1 6_655 . 4_655 57.712(10) ?
Al1 Al2 Al1 1_554 . . 97.946(18) ?
Al1 Al2 Al1 1_554 . 4_654 82.054(18) ?
Al1 Al2 Al1 1_554 . 4_655 180.0(5) ?
Al1 Al2 Al1 . . 4_654 180.0(5) ?
Al1 Al2 Al1 . . 4_655 82.054(18) ?
Al1 Al2 Al1 4_654 . 4_655 97.946(18) ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion
_geom_torsion_publ_flag
? ? ? ? ? ? ? ? ? ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_D
_geom_hbond_site_symmetry_H
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_publ_flag
? ? ? ? ? ? ? ? ? ? ?


####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_I_CCDC9
_database_code_depnum_ccdc_archive 'CCDC 1895370'
loop_
_audit_author_name
_audit_author_address
'Oliver Janka'
;WWU Muenster
Germany
;
_audit_update_record             
;
2019-04-17 deposited with the CCDC.	2019-10-14 downloaded from the CCDC.
;
#=======================================================================

# 5. CHEMICAL DATA

_chemical_name_systematic        
; ?
;
_chemical_name_common            ?
_chemical_formula_moiety         ?
_chemical_formula_structural     ?
_chemical_formula_analytical     ?
_chemical_formula_iupac          ?
_chemical_formula_sum            'Al3 Ca0.655 Pd2 Yb0.345'
_chemical_formula_weight         379.7
_chemical_melting_point          ?
_chemical_compound_source        ?
_chemical_absolute_configuration .

#=======================================================================

# 6. CRYSTAL DATA

_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_H-M   'P 6/m m m'
_symmetry_space_group_name_Hall  '-P 6;-2'
_symmetry_Int_Tables_number      191

loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -y,x-y,z
3 -x+y,-x,z
4 -x,-y,z
5 y,-x+y,z
6 x-y,x,z
7 y,x,-z
8 x-y,-y,-z
9 -x,-x+y,-z
10 -y,-x,-z
11 -x+y,y,-z
12 x,x-y,-z
13 -x,-y,-z
14 y,-x+y,-z
15 x-y,x,-z
16 x,y,-z
17 -y,x-y,-z
18 -x+y,-x,-z
19 -y,-x,z
20 -x+y,y,z
21 x,x-y,z
22 y,x,z
23 x-y,-y,z
24 -x,-x+y,z

_cell_length_a                   9.3330(8)
_cell_length_b                   9.3330(8)
_cell_length_c                   4.2276(3)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_volume                     318.91(4)

loop_
_twin_individual_id
_twin_individual_mass_fraction_refined
_twin_individual_twin_matrix_11
_twin_individual_twin_matrix_12
_twin_individual_twin_matrix_13
_twin_individual_twin_matrix_21
_twin_individual_twin_matrix_22
_twin_individual_twin_matrix_23
_twin_individual_twin_matrix_31
_twin_individual_twin_matrix_32
_twin_individual_twin_matrix_33
? ? ? ? ? ? ? ? ? ? ?

_cell_formula_units_Z            3

_cell_measurement_reflns_used    6163
_cell_measurement_theta_min      4.37
_cell_measurement_theta_max      33.60
_cell_measurement_temperature    293
_cell_special_details            
; ?
;

_exptl_crystal_density_diffrn    5.93
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_F_000             505

_exptl_absorpt_coefficient_mu    17.1
_exptl_crystal_description       block
_exptl_crystal_size_max          0.050
_exptl_crystal_size_mid          0.030
_exptl_crystal_size_min          0.025
_exptl_crystal_size_rad          ?
_exptl_crystal_colour            silver
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   ?
_exptl_absorpt_correction_T_min  0.3704
_exptl_absorpt_correction_T_max  0.6422
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
? ? ? ?

#=======================================================================

# 7. EXPERIMENTAL DATA

_exptl_special_details           ?

_diffrn_ambient_temperature      293
_diffrn_source                   ?
_diffrn_source_power             ?
_diffrn_source_voltage           ?
_diffrn_source_current           ?
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_source         'X-ray tube'
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'IPDS Stoe'
_diffrn_detector                 ?
_diffrn_detector_area_resol_mean ?
_diffrn_measurement_method       '??integration method??'
_diffrn_measurement_specimen_support ?

_diffrn_reflns_number            6815
_diffrn_reflns_theta_min         2.52
_diffrn_reflns_theta_max         33.42
_diffrn_reflns_theta_full        33.42
_diffrn_measured_fraction_theta_max 0.99
_diffrn_measured_fraction_theta_full 0.99
_diffrn_reflns_av_R_equivalents  0.0317
_diffrn_reflns_av_unetI/netI     0.0067
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_l_min       -6
_diffrn_reflns_limit_l_max       6
_diffrn_reflns_reduction_process ?

_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
loop_
_diffrn_standard_refln_index_h
_diffrn_standard_refln_index_k
_diffrn_standard_refln_index_l
? ? ?

_diffrn_radiation_probe          X-ray

#=======================================================================

# 8. REFINEMENT DATA

_refine_special_details          
; ?
;

_reflns_number_total             288
_reflns_number_gt                242
_reflns_threshold_expression     I>3σ(I)

_refine_ls_structure_factor_coef Fsqd
_refine_ls_R_factor_gt           0.0097
_refine_ls_wR_factor_gt          0.0231
_refine_ls_R_factor_all          0.0141
_refine_ls_wR_factor_ref         0.0247
_refine_ls_goodness_of_fit_ref   0.90
_refine_ls_goodness_of_fit_gt    0.93
_refine_ls_restrained_S_gt       ?
_refine_ls_restrained_S_all      ?
_refine_ls_number_reflns         288
_refine_ls_number_parameters     19
_refine_ls_number_restraints     0
_refine_ls_number_constraints    4
_refine_ls_weighting_scheme      sigma
_refine_ls_weighting_details     w=1/(σ²(I)+0.0004I²)
_refine_ls_hydrogen_treatment    ?
_refine_ls_shift/su_max          0.0005
_refine_ls_shift/su_mean         0.0001
_refine_diff_density_max         0.39
_refine_diff_density_min         -0.44
_refine_ls_extinction_method     
'B-C type 1 Lorentzian isotropic (Becker & Coppens, 1974)'
_refine_ls_extinction_coef       174(19)
_refine_ls_abs_structure_details ?
_refine_ls_abs_structure_Flack   ?
_refine_ls_abs_structure_Rogers  ?

loop_
_atom_type_symbol
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Al 0.0645 0.0514 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Ca 0.2262 0.3064 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Pd -0.9988 1.0072 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Yb -0.3850 5.5486 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    ?
_computing_structure_refinement  ?
_computing_molecular_graphics    ?
_computing_publication_material  ?

loop_
_restr_distance_atom_site_label_1
_restr_distance_site_symmetry_1
_restr_distance_atom_site_label_2
_restr_distance_site_symmetry_2
_restr_distance_target
_restr_distance_target_weight_param
? ? ? ? ? ?

loop_
_restr_angle_atom_site_label_1
_restr_angle_site_symmetry_1
_restr_angle_atom_site_label_2
_restr_angle_site_symmetry_2
_restr_angle_atom_site_label_3
_restr_angle_site_symmetry_3
_restr_angle_target
_restr_angle_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_torsion_atom_site_label_1
_restr_torsion_site_symmetry_1
_restr_torsion_atom_site_label_2
_restr_torsion_site_symmetry_2
_restr_torsion_atom_site_label_3
_restr_torsion_site_symmetry_3
_restr_torsion_atom_site_label_4
_restr_torsion_site_symmetry_4
_restr_torsion_angle_target
_restr_torsion_weight_param
? ? ? ? ? ? ? ? ? ?

loop_
_restr_equal_distance_atom_site_label_1
_restr_equal_distance_site_symmetry_1
_restr_equal_distance_atom_site_label_2
_restr_equal_distance_site_symmetry_2
_restr_equal_distance_class_class_id
_restr_equal_distance_class_target_weight_param
? ? ? ? ? ?

loop_
_restr_equal_angle_atom_site_label_1
_restr_equal_angle_site_symmetry_1
_restr_equal_angle_atom_site_label_2
_restr_equal_angle_site_symmetry_2
_restr_equal_angle_atom_site_label_3
_restr_equal_angle_site_symmetry_3
_restr_equal_angle_class_class_id
_restr_equal_angle_class_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_equal_torsion_atom_site_label_1
_restr_equal_torsion_site_symmetry_1
_restr_equal_torsion_atom_site_label_2
_restr_equal_torsion_site_symmetry_2
_restr_equal_torsion_atom_site_label_3
_restr_equal_torsion_site_symmetry_3
_restr_equal_torsion_atom_site_label_4
_restr_equal_torsion_site_symmetry_4
_restr_equal_torsion_class_class_id
_restr_equal_torsion_class_target_weight_param
? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 9. ATOMIC COORDINATES AND DISPLACEMENT PARAMETERS

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_adp_type
_atom_site_U_iso_or_equiv
_atom_site_site_symmetry_multiplicity
_atom_site_occupancy
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Yb1 Yb 0.333333 0.666667 0.5 Uani 0.01043(11) 2 0.440(2) d . . .
Ca1 Ca 0.333333 0.666667 0.5 Uani 0.01043(11) 2 0.560(2) d . . .
Yb2 Yb 0 0 0 Uani 0.0126(3) 1 0.154(3) d . . .
Ca2 Ca 0 0 0 Uani 0.0126(3) 1 0.846(3) d . . .
Pd Pd 0.184330(12) 0.36866(2) 0 Uani 0.00884(8) 6 1 d . . .
Al1 Al 0.30309(10) 0 0.5 Uani 0.0102(2) 6 1 d . . .
Al2 Al 0.5 0 0 Uani 0.0101(3) 3 1 d . . .


loop_
_jana_atom_site_ADP_C_label
_jana_atom_site_ADP_C_type_symbol
_jana_atom_site_ADP_C_111
_jana_atom_site_ADP_C_112
_jana_atom_site_ADP_C_113
_jana_atom_site_ADP_C_122
_jana_atom_site_ADP_C_123
_jana_atom_site_ADP_C_133
_jana_atom_site_ADP_C_222
_jana_atom_site_ADP_C_223
_jana_atom_site_ADP_C_233
_jana_atom_site_ADP_C_333
? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_D_label
_jana_atom_site_ADP_D_type_symbol
_jana_atom_site_ADP_D_1111
_jana_atom_site_ADP_D_1112
_jana_atom_site_ADP_D_1113
_jana_atom_site_ADP_D_1122
_jana_atom_site_ADP_D_1123
_jana_atom_site_ADP_D_1133
_jana_atom_site_ADP_D_1222
_jana_atom_site_ADP_D_1223
_jana_atom_site_ADP_D_1233
_jana_atom_site_ADP_D_1333
_jana_atom_site_ADP_D_2222
_jana_atom_site_ADP_D_2223
_jana_atom_site_ADP_D_2233
_jana_atom_site_ADP_D_2333
_jana_atom_site_ADP_D_3333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_E_label
_jana_atom_site_ADP_E_type_symbol
_jana_atom_site_ADP_E_11111
_jana_atom_site_ADP_E_11112
_jana_atom_site_ADP_E_11113
_jana_atom_site_ADP_E_11122
_jana_atom_site_ADP_E_11123
_jana_atom_site_ADP_E_11133
_jana_atom_site_ADP_E_11222
_jana_atom_site_ADP_E_11223
_jana_atom_site_ADP_E_11233
_jana_atom_site_ADP_E_11333
_jana_atom_site_ADP_E_12222
_jana_atom_site_ADP_E_12223
_jana_atom_site_ADP_E_12233
_jana_atom_site_ADP_E_12333
_jana_atom_site_ADP_E_13333
_jana_atom_site_ADP_E_22222
_jana_atom_site_ADP_E_22223
_jana_atom_site_ADP_E_22233
_jana_atom_site_ADP_E_22333
_jana_atom_site_ADP_E_23333
_jana_atom_site_ADP_E_33333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_F_label
_jana_atom_site_ADP_F_type_symbol
_jana_atom_site_ADP_F_111111
_jana_atom_site_ADP_F_111112
_jana_atom_site_ADP_F_111113
_jana_atom_site_ADP_F_111122
_jana_atom_site_ADP_F_111123
_jana_atom_site_ADP_F_111133
_jana_atom_site_ADP_F_111222
_jana_atom_site_ADP_F_111223
_jana_atom_site_ADP_F_111233
_jana_atom_site_ADP_F_111333
_jana_atom_site_ADP_F_112222
_jana_atom_site_ADP_F_112223
_jana_atom_site_ADP_F_112233
_jana_atom_site_ADP_F_112333
_jana_atom_site_ADP_F_113333
_jana_atom_site_ADP_F_122222
_jana_atom_site_ADP_F_122223
_jana_atom_site_ADP_F_122233
_jana_atom_site_ADP_F_122333
_jana_atom_site_ADP_F_123333
_jana_atom_site_ADP_F_133333
_jana_atom_site_ADP_F_222222
_jana_atom_site_ADP_F_222223
_jana_atom_site_ADP_F_222233
_jana_atom_site_ADP_F_222333
_jana_atom_site_ADP_F_223333
_jana_atom_site_ADP_F_233333
_jana_atom_site_ADP_F_333333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 10. MOLECULAR GEOMETRY


loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Yb1 Pd . . 3.2047(5) ?
Yb1 Pd . 1_556 3.2047(5) ?
Yb1 Pd . 2_665 3.2047(5) ?
Yb1 Pd . 2_666 3.2047(5) ?
Yb1 Pd . 3_565 3.2047(3) ?
Yb1 Pd . 3_566 3.2047(3) ?
Yb1 Al1 . 1_565 3.2613(7) ?
Yb1 Al1 . 2_555 3.2613(10) ?
Yb1 Al1 . 3_665 3.2613(12) ?
Yb1 Al1 . 4_665 3.2613(10) ?
Yb1 Al1 . 5_565 3.2613(7) ?
Yb1 Al1 . 6_555 3.2613(12) ?
Yb1 Al2 . 1_565 3.4245(5) ?
Yb1 Al2 . 1_566 3.4245(5) ?
Yb1 Al2 . 2_555 3.4245(5) ?
Yb1 Al2 . 2_556 3.4245(5) ?
Yb1 Al2 . 3_665 3.4245(3) ?
Yb1 Al2 . 3_666 3.4245(3) ?
Ca1 Pd . . 3.2047(5) ?
Ca1 Pd . 1_556 3.2047(5) ?
Ca1 Pd . 2_665 3.2047(5) ?
Ca1 Pd . 2_666 3.2047(5) ?
Ca1 Pd . 3_565 3.2047(3) ?
Ca1 Pd . 3_566 3.2047(3) ?
Ca1 Al1 . 1_565 3.2613(7) ?
Ca1 Al1 . 2_555 3.2613(10) ?
Ca1 Al1 . 3_665 3.2613(12) ?
Ca1 Al1 . 4_665 3.2613(10) ?
Ca1 Al1 . 5_565 3.2613(7) ?
Ca1 Al1 . 6_555 3.2613(12) ?
Ca1 Al2 . 1_565 3.4245(5) ?
Ca1 Al2 . 1_566 3.4245(5) ?
Ca1 Al2 . 2_555 3.4245(5) ?
Ca1 Al2 . 2_556 3.4245(5) ?
Ca1 Al2 . 3_665 3.4245(3) ?
Ca1 Al2 . 3_666 3.4245(3) ?
Yb2 Pd . . 2.9797(7) ?
Yb2 Pd . 2_555 2.9797(7) ?
Yb2 Pd . 3_555 2.9797(3) ?
Yb2 Pd . 4_555 2.9797(7) ?
Yb2 Pd . 5_555 2.9797(7) ?
Yb2 Pd . 6_555 2.9797(3) ?
Yb2 Al1 . 1_554 3.5313(9) ?
Yb2 Al1 . . 3.5313(9) ?
Yb2 Al1 . 2_554 3.5313(9) ?
Yb2 Al1 . 2_555 3.5313(9) ?
Yb2 Al1 . 3_554 3.5313(8) ?
Yb2 Al1 . 3_555 3.5313(8) ?
Yb2 Al1 . 4_554 3.5313(9) ?
Yb2 Al1 . 4_555 3.5313(9) ?
Yb2 Al1 . 5_554 3.5313(9) ?
Yb2 Al1 . 5_555 3.5313(9) ?
Yb2 Al1 . 6_554 3.5313(8) ?
Yb2 Al1 . 6_555 3.5313(8) ?
Ca2 Pd . . 2.9797(7) ?
Ca2 Pd . 2_555 2.9797(7) ?
Ca2 Pd . 3_555 2.9797(3) ?
Ca2 Pd . 4_555 2.9797(7) ?
Ca2 Pd . 5_555 2.9797(7) ?
Ca2 Pd . 6_555 2.9797(3) ?
Ca2 Al1 . 1_554 3.5313(9) ?
Ca2 Al1 . . 3.5313(9) ?
Ca2 Al1 . 2_554 3.5313(9) ?
Ca2 Al1 . 2_555 3.5313(9) ?
Ca2 Al1 . 3_554 3.5313(8) ?
Ca2 Al1 . 3_555 3.5313(8) ?
Ca2 Al1 . 4_554 3.5313(9) ?
Ca2 Al1 . 4_555 3.5313(9) ?
Ca2 Al1 . 5_554 3.5313(9) ?
Ca2 Al1 . 5_555 3.5313(9) ?
Ca2 Al1 . 6_554 3.5313(8) ?
Ca2 Al1 . 6_555 3.5313(8) ?
Pd Pd . 5_555 2.9797(4) ?
Pd Pd . 6_555 2.9797(8) ?
Pd Al1 . 2_554 2.5980(3) ?
Pd Al1 . 2_555 2.5980(3) ?
Pd Al1 . 6_554 2.5980(7) ?
Pd Al1 . 6_555 2.5980(7) ?
Pd Al2 . 2_555 2.5634(3) ?
Pd Al2 . 3_665 2.5634(6) ?
Al1 Al1 . 4_655 3.6755(15) ?
Al1 Al1 . 5_555 2.8288(10) ?
Al1 Al1 . 6_555 2.8288(12) ?
Al1 Al2 . . 2.8010(7) ?
Al1 Al2 . 1_556 2.8010(7) ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
Pd Yb1 Pd . . 1_556 82.539(9) ?
Pd Yb1 Pd . . 2_665 81.222(8) ?
Pd Yb1 Pd . . 2_666 135.851(7) ?
Pd Yb1 Pd . . 3_565 81.222(7) ?
Pd Yb1 Pd . . 3_566 135.852(7) ?
Pd Yb1 Al1 . . 1_565 128.384(9) ?
Pd Yb1 Al1 . . 2_555 47.371(8) ?
Pd Yb1 Al1 . . 3_665 93.229(12) ?
Pd Yb1 Al1 . . 4_665 128.383(9) ?
Pd Yb1 Al1 . . 5_565 93.229(12) ?
Pd Yb1 Al1 . . 6_555 47.371(8) ?
Pd Yb1 Al2 . . 1_565 100.614(8) ?
Pd Yb1 Al2 . . 1_566 176.847(2) ?
Pd Yb1 Al2 . . 2_555 45.347(4) ?
Pd Yb1 Al2 . . 2_556 96.401(8) ?
Pd Yb1 Al2 . . 3_665 45.346(6) ?
Pd Yb1 Al2 . . 3_666 96.401(7) ?
Pd Yb1 Pd 1_556 . 2_665 135.851(7) ?
Pd Yb1 Pd 1_556 . 2_666 81.222(8) ?
Pd Yb1 Pd 1_556 . 3_565 135.852(7) ?
Pd Yb1 Pd 1_556 . 3_566 81.222(7) ?
Pd Yb1 Al1 1_556 . 1_565 128.384(9) ?
Pd Yb1 Al1 1_556 . 2_555 47.371(8) ?
Pd Yb1 Al1 1_556 . 3_665 93.229(12) ?
Pd Yb1 Al1 1_556 . 4_665 128.383(9) ?
Pd Yb1 Al1 1_556 . 5_565 93.229(12) ?
Pd Yb1 Al1 1_556 . 6_555 47.371(8) ?
Pd Yb1 Al2 1_556 . 1_565 176.847(2) ?
Pd Yb1 Al2 1_556 . 1_566 100.614(8) ?
Pd Yb1 Al2 1_556 . 2_555 96.401(8) ?
Pd Yb1 Al2 1_556 . 2_556 45.347(4) ?
Pd Yb1 Al2 1_556 . 3_665 96.401(7) ?
Pd Yb1 Al2 1_556 . 3_666 45.346(6) ?
Pd Yb1 Pd 2_665 . 2_666 82.539(9) ?
Pd Yb1 Pd 2_665 . 3_565 81.222(8) ?
Pd Yb1 Pd 2_665 . 3_566 135.852(7) ?
Pd Yb1 Al1 2_665 . 1_565 93.229(12) ?
Pd Yb1 Al1 2_665 . 2_555 128.383(9) ?
Pd Yb1 Al1 2_665 . 3_665 47.371(9) ?
Pd Yb1 Al1 2_665 . 4_665 47.371(8) ?
Pd Yb1 Al1 2_665 . 5_565 128.383(10) ?
Pd Yb1 Al1 2_665 . 6_555 93.229(13) ?
Pd Yb1 Al2 2_665 . 1_565 45.346(6) ?
Pd Yb1 Al2 2_665 . 1_566 96.401(8) ?
Pd Yb1 Al2 2_665 . 2_555 100.614(8) ?
Pd Yb1 Al2 2_665 . 2_556 176.847(2) ?
Pd Yb1 Al2 2_665 . 3_665 45.346(7) ?
Pd Yb1 Al2 2_665 . 3_666 96.401(7) ?
Pd Yb1 Pd 2_666 . 3_565 135.852(7) ?
Pd Yb1 Pd 2_666 . 3_566 81.222(8) ?
Pd Yb1 Al1 2_666 . 1_565 93.229(12) ?
Pd Yb1 Al1 2_666 . 2_555 128.383(9) ?
Pd Yb1 Al1 2_666 . 3_665 47.371(9) ?
Pd Yb1 Al1 2_666 . 4_665 47.371(8) ?
Pd Yb1 Al1 2_666 . 5_565 128.383(10) ?
Pd Yb1 Al1 2_666 . 6_555 93.229(13) ?
Pd Yb1 Al2 2_666 . 1_565 96.401(8) ?
Pd Yb1 Al2 2_666 . 1_566 45.346(6) ?
Pd Yb1 Al2 2_666 . 2_555 176.847(2) ?
Pd Yb1 Al2 2_666 . 2_556 100.614(8) ?
Pd Yb1 Al2 2_666 . 3_665 96.401(7) ?
Pd Yb1 Al2 2_666 . 3_666 45.346(7) ?
Pd Yb1 Pd 3_565 . 3_566 82.539(6) ?
Pd Yb1 Al1 3_565 . 1_565 47.371(7) ?
Pd Yb1 Al1 3_565 . 2_555 93.229(12) ?
Pd Yb1 Al1 3_565 . 3_665 128.383(9) ?
Pd Yb1 Al1 3_565 . 4_665 93.229(12) ?
Pd Yb1 Al1 3_565 . 5_565 47.371(7) ?
Pd Yb1 Al1 3_565 . 6_555 128.383(9) ?
Pd Yb1 Al2 3_565 . 1_565 45.347(6) ?
Pd Yb1 Al2 3_565 . 1_566 96.401(6) ?
Pd Yb1 Al2 3_565 . 2_555 45.346(6) ?
Pd Yb1 Al2 3_565 . 2_556 96.401(7) ?
Pd Yb1 Al2 3_565 . 3_665 100.614(5) ?
Pd Yb1 Al2 3_565 . 3_666 176.847(3) ?
Pd Yb1 Al1 3_566 . 1_565 47.371(7) ?
Pd Yb1 Al1 3_566 . 2_555 93.229(12) ?
Pd Yb1 Al1 3_566 . 3_665 128.383(9) ?
Pd Yb1 Al1 3_566 . 4_665 93.229(12) ?
Pd Yb1 Al1 3_566 . 5_565 47.371(7) ?
Pd Yb1 Al1 3_566 . 6_555 128.383(9) ?
Pd Yb1 Al2 3_566 . 1_565 96.401(6) ?
Pd Yb1 Al2 3_566 . 1_566 45.347(6) ?
Pd Yb1 Al2 3_566 . 2_555 96.401(7) ?
Pd Yb1 Al2 3_566 . 2_556 45.346(6) ?
Pd Yb1 Al2 3_566 . 3_665 176.847(3) ?
Pd Yb1 Al2 3_566 . 3_666 100.614(5) ?
Al1 Yb1 Al1 1_565 . 2_555 120.00(2) ?
Al1 Yb1 Al1 1_565 . 3_665 120.00(2) ?
Al1 Yb1 Al1 1_565 . 4_665 68.60(2) ?
Al1 Yb1 Al1 1_565 . 5_565 51.40(2) ?
Al1 Yb1 Al1 1_565 . 6_555 171.40(2) ?
Al1 Yb1 Al2 1_565 . 1_565 49.462(9) ?
Al1 Yb1 Al2 1_565 . 1_566 49.462(9) ?
Al1 Yb1 Al2 1_565 . 2_555 86.620(12) ?
Al1 Yb1 Al2 1_565 . 2_556 86.620(12) ?
Al1 Yb1 Al2 1_565 . 3_665 135.147(7) ?
Al1 Yb1 Al2 1_565 . 3_666 135.147(7) ?
Al1 Yb1 Al1 2_555 . 3_665 120.00(2) ?
Al1 Yb1 Al1 2_555 . 4_665 171.403(19) ?
Al1 Yb1 Al1 2_555 . 5_565 68.60(2) ?
Al1 Yb1 Al1 2_555 . 6_555 51.40(2) ?
Al1 Yb1 Al2 2_555 . 1_565 135.147(8) ?
Al1 Yb1 Al2 2_555 . 1_566 135.147(8) ?
Al1 Yb1 Al2 2_555 . 2_555 49.462(9) ?
Al1 Yb1 Al2 2_555 . 2_556 49.462(9) ?
Al1 Yb1 Al2 2_555 . 3_665 86.619(12) ?
Al1 Yb1 Al2 2_555 . 3_666 86.619(12) ?
Al1 Yb1 Al1 3_665 . 4_665 51.40(2) ?
Al1 Yb1 Al1 3_665 . 5_565 171.40(2) ?
Al1 Yb1 Al1 3_665 . 6_555 68.60(2) ?
Al1 Yb1 Al2 3_665 . 1_565 86.619(13) ?
Al1 Yb1 Al2 3_665 . 1_566 86.619(13) ?
Al1 Yb1 Al2 3_665 . 2_555 135.147(8) ?
Al1 Yb1 Al2 3_665 . 2_556 135.147(8) ?
Al1 Yb1 Al2 3_665 . 3_665 49.462(9) ?
Al1 Yb1 Al2 3_665 . 3_666 49.462(9) ?
Al1 Yb1 Al1 4_665 . 5_565 120.00(2) ?
Al1 Yb1 Al1 4_665 . 6_555 120.00(2) ?
Al1 Yb1 Al2 4_665 . 1_565 49.462(9) ?
Al1 Yb1 Al2 4_665 . 1_566 49.462(9) ?
Al1 Yb1 Al2 4_665 . 2_555 135.147(8) ?
Al1 Yb1 Al2 4_665 . 2_556 135.147(8) ?
Al1 Yb1 Al2 4_665 . 3_665 86.619(12) ?
Al1 Yb1 Al2 4_665 . 3_666 86.619(12) ?
Al1 Yb1 Al1 5_565 . 6_555 120.00(2) ?
Al1 Yb1 Al2 5_565 . 1_565 86.620(12) ?
Al1 Yb1 Al2 5_565 . 1_566 86.620(12) ?
Al1 Yb1 Al2 5_565 . 2_555 49.462(9) ?
Al1 Yb1 Al2 5_565 . 2_556 49.462(9) ?
Al1 Yb1 Al2 5_565 . 3_665 135.147(7) ?
Al1 Yb1 Al2 5_565 . 3_666 135.147(7) ?
Al1 Yb1 Al2 6_555 . 1_565 135.147(8) ?
Al1 Yb1 Al2 6_555 . 1_566 135.147(8) ?
Al1 Yb1 Al2 6_555 . 2_555 86.619(13) ?
Al1 Yb1 Al2 6_555 . 2_556 86.619(13) ?
Al1 Yb1 Al2 6_555 . 3_665 49.462(9) ?
Al1 Yb1 Al2 6_555 . 3_666 49.462(9) ?
Al2 Yb1 Al2 1_565 . 1_566 76.234(8) ?
Al2 Yb1 Al2 1_565 . 2_555 85.898(8) ?
Al2 Yb1 Al2 1_565 . 2_556 133.671(3) ?
Al2 Yb1 Al2 1_565 . 3_665 85.898(6) ?
Al2 Yb1 Al2 1_565 . 3_666 133.670(6) ?
Al2 Yb1 Al2 1_566 . 2_555 133.671(3) ?
Al2 Yb1 Al2 1_566 . 2_556 85.898(8) ?
Al2 Yb1 Al2 1_566 . 3_665 133.670(6) ?
Al2 Yb1 Al2 1_566 . 3_666 85.898(6) ?
Al2 Yb1 Al2 2_555 . 2_556 76.234(8) ?
Al2 Yb1 Al2 2_555 . 3_665 85.898(6) ?
Al2 Yb1 Al2 2_555 . 3_666 133.670(6) ?
Al2 Yb1 Al2 2_556 . 3_665 133.670(6) ?
Al2 Yb1 Al2 2_556 . 3_666 85.898(6) ?
Al2 Yb1 Al2 3_665 . 3_666 76.233(5) ?
Pd Ca1 Pd . . 1_556 82.539(9) ?
Pd Ca1 Pd . . 2_665 81.222(8) ?
Pd Ca1 Pd . . 2_666 135.851(7) ?
Pd Ca1 Pd . . 3_565 81.222(7) ?
Pd Ca1 Pd . . 3_566 135.852(7) ?
Pd Ca1 Al1 . . 1_565 128.384(9) ?
Pd Ca1 Al1 . . 2_555 47.371(8) ?
Pd Ca1 Al1 . . 3_665 93.229(12) ?
Pd Ca1 Al1 . . 4_665 128.383(9) ?
Pd Ca1 Al1 . . 5_565 93.229(12) ?
Pd Ca1 Al1 . . 6_555 47.371(8) ?
Pd Ca1 Al2 . . 1_565 100.614(8) ?
Pd Ca1 Al2 . . 1_566 176.847(2) ?
Pd Ca1 Al2 . . 2_555 45.347(4) ?
Pd Ca1 Al2 . . 2_556 96.401(8) ?
Pd Ca1 Al2 . . 3_665 45.346(6) ?
Pd Ca1 Al2 . . 3_666 96.401(7) ?
Pd Ca1 Pd 1_556 . 2_665 135.851(7) ?
Pd Ca1 Pd 1_556 . 2_666 81.222(8) ?
Pd Ca1 Pd 1_556 . 3_565 135.852(7) ?
Pd Ca1 Pd 1_556 . 3_566 81.222(7) ?
Pd Ca1 Al1 1_556 . 1_565 128.384(9) ?
Pd Ca1 Al1 1_556 . 2_555 47.371(8) ?
Pd Ca1 Al1 1_556 . 3_665 93.229(12) ?
Pd Ca1 Al1 1_556 . 4_665 128.383(9) ?
Pd Ca1 Al1 1_556 . 5_565 93.229(12) ?
Pd Ca1 Al1 1_556 . 6_555 47.371(8) ?
Pd Ca1 Al2 1_556 . 1_565 176.847(2) ?
Pd Ca1 Al2 1_556 . 1_566 100.614(8) ?
Pd Ca1 Al2 1_556 . 2_555 96.401(8) ?
Pd Ca1 Al2 1_556 . 2_556 45.347(4) ?
Pd Ca1 Al2 1_556 . 3_665 96.401(7) ?
Pd Ca1 Al2 1_556 . 3_666 45.346(6) ?
Pd Ca1 Pd 2_665 . 2_666 82.539(9) ?
Pd Ca1 Pd 2_665 . 3_565 81.222(8) ?
Pd Ca1 Pd 2_665 . 3_566 135.852(7) ?
Pd Ca1 Al1 2_665 . 1_565 93.229(12) ?
Pd Ca1 Al1 2_665 . 2_555 128.383(9) ?
Pd Ca1 Al1 2_665 . 3_665 47.371(9) ?
Pd Ca1 Al1 2_665 . 4_665 47.371(8) ?
Pd Ca1 Al1 2_665 . 5_565 128.383(10) ?
Pd Ca1 Al1 2_665 . 6_555 93.229(13) ?
Pd Ca1 Al2 2_665 . 1_565 45.346(6) ?
Pd Ca1 Al2 2_665 . 1_566 96.401(8) ?
Pd Ca1 Al2 2_665 . 2_555 100.614(8) ?
Pd Ca1 Al2 2_665 . 2_556 176.847(2) ?
Pd Ca1 Al2 2_665 . 3_665 45.346(7) ?
Pd Ca1 Al2 2_665 . 3_666 96.401(7) ?
Pd Ca1 Pd 2_666 . 3_565 135.852(7) ?
Pd Ca1 Pd 2_666 . 3_566 81.222(8) ?
Pd Ca1 Al1 2_666 . 1_565 93.229(12) ?
Pd Ca1 Al1 2_666 . 2_555 128.383(9) ?
Pd Ca1 Al1 2_666 . 3_665 47.371(9) ?
Pd Ca1 Al1 2_666 . 4_665 47.371(8) ?
Pd Ca1 Al1 2_666 . 5_565 128.383(10) ?
Pd Ca1 Al1 2_666 . 6_555 93.229(13) ?
Pd Ca1 Al2 2_666 . 1_565 96.401(8) ?
Pd Ca1 Al2 2_666 . 1_566 45.346(6) ?
Pd Ca1 Al2 2_666 . 2_555 176.847(2) ?
Pd Ca1 Al2 2_666 . 2_556 100.614(8) ?
Pd Ca1 Al2 2_666 . 3_665 96.401(7) ?
Pd Ca1 Al2 2_666 . 3_666 45.346(7) ?
Pd Ca1 Pd 3_565 . 3_566 82.539(6) ?
Pd Ca1 Al1 3_565 . 1_565 47.371(7) ?
Pd Ca1 Al1 3_565 . 2_555 93.229(12) ?
Pd Ca1 Al1 3_565 . 3_665 128.383(9) ?
Pd Ca1 Al1 3_565 . 4_665 93.229(12) ?
Pd Ca1 Al1 3_565 . 5_565 47.371(7) ?
Pd Ca1 Al1 3_565 . 6_555 128.383(9) ?
Pd Ca1 Al2 3_565 . 1_565 45.347(6) ?
Pd Ca1 Al2 3_565 . 1_566 96.401(6) ?
Pd Ca1 Al2 3_565 . 2_555 45.346(6) ?
Pd Ca1 Al2 3_565 . 2_556 96.401(7) ?
Pd Ca1 Al2 3_565 . 3_665 100.614(5) ?
Pd Ca1 Al2 3_565 . 3_666 176.847(3) ?
Pd Ca1 Al1 3_566 . 1_565 47.371(7) ?
Pd Ca1 Al1 3_566 . 2_555 93.229(12) ?
Pd Ca1 Al1 3_566 . 3_665 128.383(9) ?
Pd Ca1 Al1 3_566 . 4_665 93.229(12) ?
Pd Ca1 Al1 3_566 . 5_565 47.371(7) ?
Pd Ca1 Al1 3_566 . 6_555 128.383(9) ?
Pd Ca1 Al2 3_566 . 1_565 96.401(6) ?
Pd Ca1 Al2 3_566 . 1_566 45.347(6) ?
Pd Ca1 Al2 3_566 . 2_555 96.401(7) ?
Pd Ca1 Al2 3_566 . 2_556 45.346(6) ?
Pd Ca1 Al2 3_566 . 3_665 176.847(3) ?
Pd Ca1 Al2 3_566 . 3_666 100.614(5) ?
Al1 Ca1 Al1 1_565 . 2_555 120.00(2) ?
Al1 Ca1 Al1 1_565 . 3_665 120.00(2) ?
Al1 Ca1 Al1 1_565 . 4_665 68.60(2) ?
Al1 Ca1 Al1 1_565 . 5_565 51.40(2) ?
Al1 Ca1 Al1 1_565 . 6_555 171.40(2) ?
Al1 Ca1 Al2 1_565 . 1_565 49.462(9) ?
Al1 Ca1 Al2 1_565 . 1_566 49.462(9) ?
Al1 Ca1 Al2 1_565 . 2_555 86.620(12) ?
Al1 Ca1 Al2 1_565 . 2_556 86.620(12) ?
Al1 Ca1 Al2 1_565 . 3_665 135.147(7) ?
Al1 Ca1 Al2 1_565 . 3_666 135.147(7) ?
Al1 Ca1 Al1 2_555 . 3_665 120.00(2) ?
Al1 Ca1 Al1 2_555 . 4_665 171.403(19) ?
Al1 Ca1 Al1 2_555 . 5_565 68.60(2) ?
Al1 Ca1 Al1 2_555 . 6_555 51.40(2) ?
Al1 Ca1 Al2 2_555 . 1_565 135.147(8) ?
Al1 Ca1 Al2 2_555 . 1_566 135.147(8) ?
Al1 Ca1 Al2 2_555 . 2_555 49.462(9) ?
Al1 Ca1 Al2 2_555 . 2_556 49.462(9) ?
Al1 Ca1 Al2 2_555 . 3_665 86.619(12) ?
Al1 Ca1 Al2 2_555 . 3_666 86.619(12) ?
Al1 Ca1 Al1 3_665 . 4_665 51.40(2) ?
Al1 Ca1 Al1 3_665 . 5_565 171.40(2) ?
Al1 Ca1 Al1 3_665 . 6_555 68.60(2) ?
Al1 Ca1 Al2 3_665 . 1_565 86.619(13) ?
Al1 Ca1 Al2 3_665 . 1_566 86.619(13) ?
Al1 Ca1 Al2 3_665 . 2_555 135.147(8) ?
Al1 Ca1 Al2 3_665 . 2_556 135.147(8) ?
Al1 Ca1 Al2 3_665 . 3_665 49.462(9) ?
Al1 Ca1 Al2 3_665 . 3_666 49.462(9) ?
Al1 Ca1 Al1 4_665 . 5_565 120.00(2) ?
Al1 Ca1 Al1 4_665 . 6_555 120.00(2) ?
Al1 Ca1 Al2 4_665 . 1_565 49.462(9) ?
Al1 Ca1 Al2 4_665 . 1_566 49.462(9) ?
Al1 Ca1 Al2 4_665 . 2_555 135.147(8) ?
Al1 Ca1 Al2 4_665 . 2_556 135.147(8) ?
Al1 Ca1 Al2 4_665 . 3_665 86.619(12) ?
Al1 Ca1 Al2 4_665 . 3_666 86.619(12) ?
Al1 Ca1 Al1 5_565 . 6_555 120.00(2) ?
Al1 Ca1 Al2 5_565 . 1_565 86.620(12) ?
Al1 Ca1 Al2 5_565 . 1_566 86.620(12) ?
Al1 Ca1 Al2 5_565 . 2_555 49.462(9) ?
Al1 Ca1 Al2 5_565 . 2_556 49.462(9) ?
Al1 Ca1 Al2 5_565 . 3_665 135.147(7) ?
Al1 Ca1 Al2 5_565 . 3_666 135.147(7) ?
Al1 Ca1 Al2 6_555 . 1_565 135.147(8) ?
Al1 Ca1 Al2 6_555 . 1_566 135.147(8) ?
Al1 Ca1 Al2 6_555 . 2_555 86.619(13) ?
Al1 Ca1 Al2 6_555 . 2_556 86.619(13) ?
Al1 Ca1 Al2 6_555 . 3_665 49.462(9) ?
Al1 Ca1 Al2 6_555 . 3_666 49.462(9) ?
Al2 Ca1 Al2 1_565 . 1_566 76.234(8) ?
Al2 Ca1 Al2 1_565 . 2_555 85.898(8) ?
Al2 Ca1 Al2 1_565 . 2_556 133.671(3) ?
Al2 Ca1 Al2 1_565 . 3_665 85.898(6) ?
Al2 Ca1 Al2 1_565 . 3_666 133.670(6) ?
Al2 Ca1 Al2 1_566 . 2_555 133.671(3) ?
Al2 Ca1 Al2 1_566 . 2_556 85.898(8) ?
Al2 Ca1 Al2 1_566 . 3_665 133.670(6) ?
Al2 Ca1 Al2 1_566 . 3_666 85.898(6) ?
Al2 Ca1 Al2 2_555 . 2_556 76.234(8) ?
Al2 Ca1 Al2 2_555 . 3_665 85.898(6) ?
Al2 Ca1 Al2 2_555 . 3_666 133.670(6) ?
Al2 Ca1 Al2 2_556 . 3_665 133.670(6) ?
Al2 Ca1 Al2 2_556 . 3_666 85.898(6) ?
Al2 Ca1 Al2 3_665 . 3_666 76.233(5) ?
Pd Yb2 Pd . . 2_555 120.000(8) ?
Pd Yb2 Pd . . 3_555 120.000(8) ?
Pd Yb2 Pd . . 4_555 180.0(5) ?
Pd Yb2 Pd . . 5_555 60.000(8) ?
Pd Yb2 Pd . . 6_555 60.000(8) ?
Pd Yb2 Al1 . . 1_554 90.000(6) ?
Pd Yb2 Al1 . . . 90.000(6) ?
Pd Yb2 Al1 . . 2_554 46.074(8) ?
Pd Yb2 Al1 . . 2_555 46.074(8) ?
Pd Yb2 Al1 . . 3_554 133.926(14) ?
Pd Yb2 Al1 . . 3_555 133.926(14) ?
Pd Yb2 Al1 . . 4_554 90.000(6) ?
Pd Yb2 Al1 . . 4_555 90.000(6) ?
Pd Yb2 Al1 . . 5_554 133.926(8) ?
Pd Yb2 Al1 . . 5_555 133.926(8) ?
Pd Yb2 Al1 . . 6_554 46.074(14) ?
Pd Yb2 Al1 . . 6_555 46.074(14) ?
Pd Yb2 Pd 2_555 . 3_555 120.000(9) ?
Pd Yb2 Pd 2_555 . 4_555 60.000(8) ?
Pd Yb2 Pd 2_555 . 5_555 180.0(5) ?
Pd Yb2 Pd 2_555 . 6_555 60.000(9) ?
Pd Yb2 Al1 2_555 . 1_554 133.926(8) ?
Pd Yb2 Al1 2_555 . . 133.926(8) ?
Pd Yb2 Al1 2_555 . 2_554 90.000(7) ?
Pd Yb2 Al1 2_555 . 2_555 90.000(7) ?
Pd Yb2 Al1 2_555 . 3_554 46.074(15) ?
Pd Yb2 Al1 2_555 . 3_555 46.074(15) ?
Pd Yb2 Al1 2_555 . 4_554 46.074(8) ?
Pd Yb2 Al1 2_555 . 4_555 46.074(8) ?
Pd Yb2 Al1 2_555 . 5_554 90.000(7) ?
Pd Yb2 Al1 2_555 . 5_555 90.000(7) ?
Pd Yb2 Al1 2_555 . 6_554 133.926(15) ?
Pd Yb2 Al1 2_555 . 6_555 133.926(15) ?
Pd Yb2 Pd 3_555 . 4_555 60.000(8) ?
Pd Yb2 Pd 3_555 . 5_555 60.000(9) ?
Pd Yb2 Pd 3_555 . 6_555 180.0(5) ?
Pd Yb2 Al1 3_555 . 1_554 46.074(7) ?
Pd Yb2 Al1 3_555 . . 46.074(7) ?
Pd Yb2 Al1 3_555 . 2_554 133.926(7) ?
Pd Yb2 Al1 3_555 . 2_555 133.926(7) ?
Pd Yb2 Al1 3_555 . 3_554 90.00(2) ?
Pd Yb2 Al1 3_555 . 3_555 90.00(2) ?
Pd Yb2 Al1 3_555 . 4_554 133.926(7) ?
Pd Yb2 Al1 3_555 . 4_555 133.926(7) ?
Pd Yb2 Al1 3_555 . 5_554 46.074(7) ?
Pd Yb2 Al1 3_555 . 5_555 46.074(7) ?
Pd Yb2 Al1 3_555 . 6_554 90.00(2) ?
Pd Yb2 Al1 3_555 . 6_555 90.00(2) ?
Pd Yb2 Pd 4_555 . 5_555 120.000(8) ?
Pd Yb2 Pd 4_555 . 6_555 120.000(8) ?
Pd Yb2 Al1 4_555 . 1_554 90.000(6) ?
Pd Yb2 Al1 4_555 . . 90.000(6) ?
Pd Yb2 Al1 4_555 . 2_554 133.926(8) ?
Pd Yb2 Al1 4_555 . 2_555 133.926(8) ?
Pd Yb2 Al1 4_555 . 3_554 46.074(14) ?
Pd Yb2 Al1 4_555 . 3_555 46.074(14) ?
Pd Yb2 Al1 4_555 . 4_554 90.000(6) ?
Pd Yb2 Al1 4_555 . 4_555 90.000(6) ?
Pd Yb2 Al1 4_555 . 5_554 46.074(8) ?
Pd Yb2 Al1 4_555 . 5_555 46.074(8) ?
Pd Yb2 Al1 4_555 . 6_554 133.926(14) ?
Pd Yb2 Al1 4_555 . 6_555 133.926(14) ?
Pd Yb2 Pd 5_555 . 6_555 120.000(9) ?
Pd Yb2 Al1 5_555 . 1_554 46.074(8) ?
Pd Yb2 Al1 5_555 . . 46.074(8) ?
Pd Yb2 Al1 5_555 . 2_554 90.000(7) ?
Pd Yb2 Al1 5_555 . 2_555 90.000(7) ?
Pd Yb2 Al1 5_555 . 3_554 133.926(15) ?
Pd Yb2 Al1 5_555 . 3_555 133.926(15) ?
Pd Yb2 Al1 5_555 . 4_554 133.926(8) ?
Pd Yb2 Al1 5_555 . 4_555 133.926(8) ?
Pd Yb2 Al1 5_555 . 5_554 90.000(7) ?
Pd Yb2 Al1 5_555 . 5_555 90.000(7) ?
Pd Yb2 Al1 5_555 . 6_554 46.074(15) ?
Pd Yb2 Al1 5_555 . 6_555 46.074(15) ?
Pd Yb2 Al1 6_555 . 1_554 133.926(7) ?
Pd Yb2 Al1 6_555 . . 133.926(7) ?
Pd Yb2 Al1 6_555 . 2_554 46.074(7) ?
Pd Yb2 Al1 6_555 . 2_555 46.074(7) ?
Pd Yb2 Al1 6_555 . 3_554 90.00(2) ?
Pd Yb2 Al1 6_555 . 3_555 90.00(2) ?
Pd Yb2 Al1 6_555 . 4_554 46.074(7) ?
Pd Yb2 Al1 6_555 . 4_555 46.074(7) ?
Pd Yb2 Al1 6_555 . 5_554 133.926(7) ?
Pd Yb2 Al1 6_555 . 5_555 133.926(7) ?
Pd Yb2 Al1 6_555 . 6_554 90.00(2) ?
Pd Yb2 Al1 6_555 . 6_555 90.00(2) ?
Al1 Yb2 Al1 1_554 . . 73.538(14) ?
Al1 Yb2 Al1 1_554 . 2_554 87.853(10) ?
Al1 Yb2 Al1 1_554 . 2_555 132.778(7) ?
Al1 Yb2 Al1 1_554 . 3_554 87.853(17) ?
Al1 Yb2 Al1 1_554 . 3_555 132.778(18) ?
Al1 Yb2 Al1 1_554 . 4_554 106.462(14) ?
Al1 Yb2 Al1 1_554 . 4_555 180.0(5) ?
Al1 Yb2 Al1 1_554 . 5_554 47.222(7) ?
Al1 Yb2 Al1 1_554 . 5_555 92.147(10) ?
Al1 Yb2 Al1 1_554 . 6_554 47.222(18) ?
Al1 Yb2 Al1 1_554 . 6_555 92.147(17) ?
Al1 Yb2 Al1 . . 2_554 132.778(7) ?
Al1 Yb2 Al1 . . 2_555 87.853(10) ?
Al1 Yb2 Al1 . . 3_554 132.778(18) ?
Al1 Yb2 Al1 . . 3_555 87.853(17) ?
Al1 Yb2 Al1 . . 4_554 180.0(5) ?
Al1 Yb2 Al1 . . 4_555 106.462(14) ?
Al1 Yb2 Al1 . . 5_554 92.147(10) ?
Al1 Yb2 Al1 . . 5_555 47.222(7) ?
Al1 Yb2 Al1 . . 6_554 92.147(17) ?
Al1 Yb2 Al1 . . 6_555 47.222(18) ?
Al1 Yb2 Al1 2_554 . 2_555 73.538(14) ?
Al1 Yb2 Al1 2_554 . 3_554 87.853(17) ?
Al1 Yb2 Al1 2_554 . 3_555 132.778(18) ?
Al1 Yb2 Al1 2_554 . 4_554 47.222(7) ?
Al1 Yb2 Al1 2_554 . 4_555 92.147(10) ?
Al1 Yb2 Al1 2_554 . 5_554 106.462(14) ?
Al1 Yb2 Al1 2_554 . 5_555 180.0(5) ?
Al1 Yb2 Al1 2_554 . 6_554 47.222(18) ?
Al1 Yb2 Al1 2_554 . 6_555 92.147(17) ?
Al1 Yb2 Al1 2_555 . 3_554 132.778(18) ?
Al1 Yb2 Al1 2_555 . 3_555 87.853(17) ?
Al1 Yb2 Al1 2_555 . 4_554 92.147(10) ?
Al1 Yb2 Al1 2_555 . 4_555 47.222(7) ?
Al1 Yb2 Al1 2_555 . 5_554 180.0(5) ?
Al1 Yb2 Al1 2_555 . 5_555 106.462(14) ?
Al1 Yb2 Al1 2_555 . 6_554 92.147(17) ?
Al1 Yb2 Al1 2_555 . 6_555 47.222(18) ?
Al1 Yb2 Al1 3_554 . 3_555 73.538(12) ?
Al1 Yb2 Al1 3_554 . 4_554 47.222(18) ?
Al1 Yb2 Al1 3_554 . 4_555 92.147(17) ?
Al1 Yb2 Al1 3_554 . 5_554 47.222(18) ?
Al1 Yb2 Al1 3_554 . 5_555 92.147(17) ?
Al1 Yb2 Al1 3_554 . 6_554 106.462(12) ?
Al1 Yb2 Al1 3_554 . 6_555 180.0(5) ?
Al1 Yb2 Al1 3_555 . 4_554 92.147(17) ?
Al1 Yb2 Al1 3_555 . 4_555 47.222(18) ?
Al1 Yb2 Al1 3_555 . 5_554 92.147(17) ?
Al1 Yb2 Al1 3_555 . 5_555 47.222(18) ?
Al1 Yb2 Al1 3_555 . 6_554 180.0(5) ?
Al1 Yb2 Al1 3_555 . 6_555 106.462(12) ?
Al1 Yb2 Al1 4_554 . 4_555 73.538(14) ?
Al1 Yb2 Al1 4_554 . 5_554 87.853(10) ?
Al1 Yb2 Al1 4_554 . 5_555 132.778(7) ?
Al1 Yb2 Al1 4_554 . 6_554 87.853(17) ?
Al1 Yb2 Al1 4_554 . 6_555 132.778(18) ?
Al1 Yb2 Al1 4_555 . 5_554 132.778(7) ?
Al1 Yb2 Al1 4_555 . 5_555 87.853(10) ?
Al1 Yb2 Al1 4_555 . 6_554 132.778(18) ?
Al1 Yb2 Al1 4_555 . 6_555 87.853(17) ?
Al1 Yb2 Al1 5_554 . 5_555 73.538(14) ?
Al1 Yb2 Al1 5_554 . 6_554 87.853(17) ?
Al1 Yb2 Al1 5_554 . 6_555 132.778(18) ?
Al1 Yb2 Al1 5_555 . 6_554 132.778(18) ?
Al1 Yb2 Al1 5_555 . 6_555 87.853(17) ?
Al1 Yb2 Al1 6_554 . 6_555 73.538(12) ?
Pd Ca2 Pd . . 2_555 120.000(8) ?
Pd Ca2 Pd . . 3_555 120.000(8) ?
Pd Ca2 Pd . . 4_555 180.0(5) ?
Pd Ca2 Pd . . 5_555 60.000(8) ?
Pd Ca2 Pd . . 6_555 60.000(8) ?
Pd Ca2 Al1 . . 1_554 90.000(6) ?
Pd Ca2 Al1 . . . 90.000(6) ?
Pd Ca2 Al1 . . 2_554 46.074(8) ?
Pd Ca2 Al1 . . 2_555 46.074(8) ?
Pd Ca2 Al1 . . 3_554 133.926(14) ?
Pd Ca2 Al1 . . 3_555 133.926(14) ?
Pd Ca2 Al1 . . 4_554 90.000(6) ?
Pd Ca2 Al1 . . 4_555 90.000(6) ?
Pd Ca2 Al1 . . 5_554 133.926(8) ?
Pd Ca2 Al1 . . 5_555 133.926(8) ?
Pd Ca2 Al1 . . 6_554 46.074(14) ?
Pd Ca2 Al1 . . 6_555 46.074(14) ?
Pd Ca2 Pd 2_555 . 3_555 120.000(9) ?
Pd Ca2 Pd 2_555 . 4_555 60.000(8) ?
Pd Ca2 Pd 2_555 . 5_555 180.0(5) ?
Pd Ca2 Pd 2_555 . 6_555 60.000(9) ?
Pd Ca2 Al1 2_555 . 1_554 133.926(8) ?
Pd Ca2 Al1 2_555 . . 133.926(8) ?
Pd Ca2 Al1 2_555 . 2_554 90.000(7) ?
Pd Ca2 Al1 2_555 . 2_555 90.000(7) ?
Pd Ca2 Al1 2_555 . 3_554 46.074(15) ?
Pd Ca2 Al1 2_555 . 3_555 46.074(15) ?
Pd Ca2 Al1 2_555 . 4_554 46.074(8) ?
Pd Ca2 Al1 2_555 . 4_555 46.074(8) ?
Pd Ca2 Al1 2_555 . 5_554 90.000(7) ?
Pd Ca2 Al1 2_555 . 5_555 90.000(7) ?
Pd Ca2 Al1 2_555 . 6_554 133.926(15) ?
Pd Ca2 Al1 2_555 . 6_555 133.926(15) ?
Pd Ca2 Pd 3_555 . 4_555 60.000(8) ?
Pd Ca2 Pd 3_555 . 5_555 60.000(9) ?
Pd Ca2 Pd 3_555 . 6_555 180.0(5) ?
Pd Ca2 Al1 3_555 . 1_554 46.074(7) ?
Pd Ca2 Al1 3_555 . . 46.074(7) ?
Pd Ca2 Al1 3_555 . 2_554 133.926(7) ?
Pd Ca2 Al1 3_555 . 2_555 133.926(7) ?
Pd Ca2 Al1 3_555 . 3_554 90.00(2) ?
Pd Ca2 Al1 3_555 . 3_555 90.00(2) ?
Pd Ca2 Al1 3_555 . 4_554 133.926(7) ?
Pd Ca2 Al1 3_555 . 4_555 133.926(7) ?
Pd Ca2 Al1 3_555 . 5_554 46.074(7) ?
Pd Ca2 Al1 3_555 . 5_555 46.074(7) ?
Pd Ca2 Al1 3_555 . 6_554 90.00(2) ?
Pd Ca2 Al1 3_555 . 6_555 90.00(2) ?
Pd Ca2 Pd 4_555 . 5_555 120.000(8) ?
Pd Ca2 Pd 4_555 . 6_555 120.000(8) ?
Pd Ca2 Al1 4_555 . 1_554 90.000(6) ?
Pd Ca2 Al1 4_555 . . 90.000(6) ?
Pd Ca2 Al1 4_555 . 2_554 133.926(8) ?
Pd Ca2 Al1 4_555 . 2_555 133.926(8) ?
Pd Ca2 Al1 4_555 . 3_554 46.074(14) ?
Pd Ca2 Al1 4_555 . 3_555 46.074(14) ?
Pd Ca2 Al1 4_555 . 4_554 90.000(6) ?
Pd Ca2 Al1 4_555 . 4_555 90.000(6) ?
Pd Ca2 Al1 4_555 . 5_554 46.074(8) ?
Pd Ca2 Al1 4_555 . 5_555 46.074(8) ?
Pd Ca2 Al1 4_555 . 6_554 133.926(14) ?
Pd Ca2 Al1 4_555 . 6_555 133.926(14) ?
Pd Ca2 Pd 5_555 . 6_555 120.000(9) ?
Pd Ca2 Al1 5_555 . 1_554 46.074(8) ?
Pd Ca2 Al1 5_555 . . 46.074(8) ?
Pd Ca2 Al1 5_555 . 2_554 90.000(7) ?
Pd Ca2 Al1 5_555 . 2_555 90.000(7) ?
Pd Ca2 Al1 5_555 . 3_554 133.926(15) ?
Pd Ca2 Al1 5_555 . 3_555 133.926(15) ?
Pd Ca2 Al1 5_555 . 4_554 133.926(8) ?
Pd Ca2 Al1 5_555 . 4_555 133.926(8) ?
Pd Ca2 Al1 5_555 . 5_554 90.000(7) ?
Pd Ca2 Al1 5_555 . 5_555 90.000(7) ?
Pd Ca2 Al1 5_555 . 6_554 46.074(15) ?
Pd Ca2 Al1 5_555 . 6_555 46.074(15) ?
Pd Ca2 Al1 6_555 . 1_554 133.926(7) ?
Pd Ca2 Al1 6_555 . . 133.926(7) ?
Pd Ca2 Al1 6_555 . 2_554 46.074(7) ?
Pd Ca2 Al1 6_555 . 2_555 46.074(7) ?
Pd Ca2 Al1 6_555 . 3_554 90.00(2) ?
Pd Ca2 Al1 6_555 . 3_555 90.00(2) ?
Pd Ca2 Al1 6_555 . 4_554 46.074(7) ?
Pd Ca2 Al1 6_555 . 4_555 46.074(7) ?
Pd Ca2 Al1 6_555 . 5_554 133.926(7) ?
Pd Ca2 Al1 6_555 . 5_555 133.926(7) ?
Pd Ca2 Al1 6_555 . 6_554 90.00(2) ?
Pd Ca2 Al1 6_555 . 6_555 90.00(2) ?
Al1 Ca2 Al1 1_554 . . 73.538(14) ?
Al1 Ca2 Al1 1_554 . 2_554 87.853(10) ?
Al1 Ca2 Al1 1_554 . 2_555 132.778(7) ?
Al1 Ca2 Al1 1_554 . 3_554 87.853(17) ?
Al1 Ca2 Al1 1_554 . 3_555 132.778(18) ?
Al1 Ca2 Al1 1_554 . 4_554 106.462(14) ?
Al1 Ca2 Al1 1_554 . 4_555 180.0(5) ?
Al1 Ca2 Al1 1_554 . 5_554 47.222(7) ?
Al1 Ca2 Al1 1_554 . 5_555 92.147(10) ?
Al1 Ca2 Al1 1_554 . 6_554 47.222(18) ?
Al1 Ca2 Al1 1_554 . 6_555 92.147(17) ?
Al1 Ca2 Al1 . . 2_554 132.778(7) ?
Al1 Ca2 Al1 . . 2_555 87.853(10) ?
Al1 Ca2 Al1 . . 3_554 132.778(18) ?
Al1 Ca2 Al1 . . 3_555 87.853(17) ?
Al1 Ca2 Al1 . . 4_554 180.0(5) ?
Al1 Ca2 Al1 . . 4_555 106.462(14) ?
Al1 Ca2 Al1 . . 5_554 92.147(10) ?
Al1 Ca2 Al1 . . 5_555 47.222(7) ?
Al1 Ca2 Al1 . . 6_554 92.147(17) ?
Al1 Ca2 Al1 . . 6_555 47.222(18) ?
Al1 Ca2 Al1 2_554 . 2_555 73.538(14) ?
Al1 Ca2 Al1 2_554 . 3_554 87.853(17) ?
Al1 Ca2 Al1 2_554 . 3_555 132.778(18) ?
Al1 Ca2 Al1 2_554 . 4_554 47.222(7) ?
Al1 Ca2 Al1 2_554 . 4_555 92.147(10) ?
Al1 Ca2 Al1 2_554 . 5_554 106.462(14) ?
Al1 Ca2 Al1 2_554 . 5_555 180.0(5) ?
Al1 Ca2 Al1 2_554 . 6_554 47.222(18) ?
Al1 Ca2 Al1 2_554 . 6_555 92.147(17) ?
Al1 Ca2 Al1 2_555 . 3_554 132.778(18) ?
Al1 Ca2 Al1 2_555 . 3_555 87.853(17) ?
Al1 Ca2 Al1 2_555 . 4_554 92.147(10) ?
Al1 Ca2 Al1 2_555 . 4_555 47.222(7) ?
Al1 Ca2 Al1 2_555 . 5_554 180.0(5) ?
Al1 Ca2 Al1 2_555 . 5_555 106.462(14) ?
Al1 Ca2 Al1 2_555 . 6_554 92.147(17) ?
Al1 Ca2 Al1 2_555 . 6_555 47.222(18) ?
Al1 Ca2 Al1 3_554 . 3_555 73.538(12) ?
Al1 Ca2 Al1 3_554 . 4_554 47.222(18) ?
Al1 Ca2 Al1 3_554 . 4_555 92.147(17) ?
Al1 Ca2 Al1 3_554 . 5_554 47.222(18) ?
Al1 Ca2 Al1 3_554 . 5_555 92.147(17) ?
Al1 Ca2 Al1 3_554 . 6_554 106.462(12) ?
Al1 Ca2 Al1 3_554 . 6_555 180.0(5) ?
Al1 Ca2 Al1 3_555 . 4_554 92.147(17) ?
Al1 Ca2 Al1 3_555 . 4_555 47.222(18) ?
Al1 Ca2 Al1 3_555 . 5_554 92.147(17) ?
Al1 Ca2 Al1 3_555 . 5_555 47.222(18) ?
Al1 Ca2 Al1 3_555 . 6_554 180.0(5) ?
Al1 Ca2 Al1 3_555 . 6_555 106.462(12) ?
Al1 Ca2 Al1 4_554 . 4_555 73.538(14) ?
Al1 Ca2 Al1 4_554 . 5_554 87.853(10) ?
Al1 Ca2 Al1 4_554 . 5_555 132.778(7) ?
Al1 Ca2 Al1 4_554 . 6_554 87.853(17) ?
Al1 Ca2 Al1 4_554 . 6_555 132.778(18) ?
Al1 Ca2 Al1 4_555 . 5_554 132.778(7) ?
Al1 Ca2 Al1 4_555 . 5_555 87.853(10) ?
Al1 Ca2 Al1 4_555 . 6_554 132.778(18) ?
Al1 Ca2 Al1 4_555 . 6_555 87.853(17) ?
Al1 Ca2 Al1 5_554 . 5_555 73.538(14) ?
Al1 Ca2 Al1 5_554 . 6_554 87.853(17) ?
Al1 Ca2 Al1 5_554 . 6_555 132.778(18) ?
Al1 Ca2 Al1 5_555 . 6_554 132.778(18) ?
Al1 Ca2 Al1 5_555 . 6_555 87.853(17) ?
Al1 Ca2 Al1 6_554 . 6_555 73.538(12) ?
Yb1 Pd Yb1 1_554 . . 82.539(9) ?
Yb1 Pd Ca1 1_554 . 1_554 0.0(5) ?
Yb1 Pd Ca1 1_554 . . 82.539(9) ?
Yb1 Pd Yb2 1_554 . . 138.730(5) ?
Yb1 Pd Ca2 1_554 . . 138.730(5) ?
Yb1 Pd Pd 1_554 . 5_555 112.074(6) ?
Yb1 Pd Pd 1_554 . 6_555 112.074(7) ?
Yb1 Pd Al1 1_554 . 2_554 67.459(15) ?
Yb1 Pd Al1 1_554 . 2_555 133.63(2) ?
Yb1 Pd Al1 1_554 . 6_554 67.459(19) ?
Yb1 Pd Al1 1_554 . 6_555 133.630(16) ?
Yb1 Pd Al2 1_554 . 2_555 71.865(7) ?
Yb1 Pd Al2 1_554 . 3_665 71.865(6) ?
Yb1 Pd Ca1 . . 1_554 82.539(9) ?
Yb1 Pd Ca1 . . . 0.0(5) ?
Yb1 Pd Yb2 . . . 138.730(5) ?
Yb1 Pd Ca2 . . . 138.730(5) ?
Yb1 Pd Pd . . 5_555 112.074(6) ?
Yb1 Pd Pd . . 6_555 112.074(7) ?
Yb1 Pd Al1 . . 2_554 133.63(2) ?
Yb1 Pd Al1 . . 2_555 67.459(15) ?
Yb1 Pd Al1 . . 6_554 133.630(16) ?
Yb1 Pd Al1 . . 6_555 67.459(19) ?
Yb1 Pd Al2 . . 2_555 71.865(7) ?
Yb1 Pd Al2 . . 3_665 71.865(6) ?
Ca1 Pd Ca1 1_554 . . 82.539(9) ?
Ca1 Pd Yb2 1_554 . . 138.730(5) ?
Ca1 Pd Ca2 1_554 . . 138.730(5) ?
Ca1 Pd Pd 1_554 . 5_555 112.074(6) ?
Ca1 Pd Pd 1_554 . 6_555 112.074(7) ?
Ca1 Pd Al1 1_554 . 2_554 67.459(15) ?
Ca1 Pd Al1 1_554 . 2_555 133.63(2) ?
Ca1 Pd Al1 1_554 . 6_554 67.459(19) ?
Ca1 Pd Al1 1_554 . 6_555 133.630(16) ?
Ca1 Pd Al2 1_554 . 2_555 71.865(7) ?
Ca1 Pd Al2 1_554 . 3_665 71.865(6) ?
Ca1 Pd Yb2 . . . 138.730(5) ?
Ca1 Pd Ca2 . . . 138.730(5) ?
Ca1 Pd Pd . . 5_555 112.074(6) ?
Ca1 Pd Pd . . 6_555 112.074(7) ?
Ca1 Pd Al1 . . 2_554 133.63(2) ?
Ca1 Pd Al1 . . 2_555 67.459(15) ?
Ca1 Pd Al1 . . 6_554 133.630(16) ?
Ca1 Pd Al1 . . 6_555 67.459(19) ?
Ca1 Pd Al2 . . 2_555 71.865(7) ?
Ca1 Pd Al2 . . 3_665 71.865(6) ?
Yb2 Pd Ca2 . . . 0.0(5) ?
Yb2 Pd Pd . . 5_555 60.000(9) ?
Yb2 Pd Pd . . 6_555 60.000(7) ?
Yb2 Pd Al1 . . 2_554 78.229(19) ?
Yb2 Pd Al1 . . 2_555 78.229(19) ?
Yb2 Pd Al1 . . 6_554 78.229(18) ?
Yb2 Pd Al1 . . 6_555 78.229(18) ?
Yb2 Pd Al2 . . 2_555 114.464(8) ?
Yb2 Pd Al2 . . 3_665 114.464(10) ?
Ca2 Pd Pd . . 5_555 60.000(9) ?
Ca2 Pd Pd . . 6_555 60.000(7) ?
Ca2 Pd Al1 . . 2_554 78.229(19) ?
Ca2 Pd Al1 . . 2_555 78.229(19) ?
Ca2 Pd Al1 . . 6_554 78.229(18) ?
Ca2 Pd Al1 . . 6_555 78.229(18) ?
Ca2 Pd Al2 . . 2_555 114.464(8) ?
Ca2 Pd Al2 . . 3_665 114.464(10) ?
Pd Pd Pd 5_555 . 6_555 120.000(11) ?
Pd Pd Al1 5_555 . 2_554 111.684(19) ?
Pd Pd Al1 5_555 . 2_555 111.684(19) ?
Pd Pd Al1 5_555 . 6_554 55.01(2) ?
Pd Pd Al1 5_555 . 6_555 55.01(2) ?
Pd Pd Al2 5_555 . 2_555 174.464(7) ?
Pd Pd Al2 5_555 . 3_665 54.464(8) ?
Pd Pd Al1 6_555 . 2_554 55.007(4) ?
Pd Pd Al1 6_555 . 2_555 55.007(4) ?
Pd Pd Al1 6_555 . 6_554 111.684(16) ?
Pd Pd Al1 6_555 . 6_555 111.684(16) ?
Pd Pd Al2 6_555 . 2_555 54.464(8) ?
Pd Pd Al2 6_555 . 3_665 174.464(10) ?
Al1 Pd Al1 2_554 . 2_555 108.905(9) ?
Al1 Pd Al1 2_554 . 6_554 65.97(2) ?
Al1 Pd Al1 2_554 . 6_555 156.46(3) ?
Al1 Pd Al2 2_554 . 2_555 65.728(18) ?
Al1 Pd Al2 2_554 . 3_665 125.452(4) ?
Al1 Pd Al1 2_555 . 6_554 156.46(3) ?
Al1 Pd Al1 2_555 . 6_555 65.97(2) ?
Al1 Pd Al2 2_555 . 2_555 65.728(18) ?
Al1 Pd Al2 2_555 . 3_665 125.452(4) ?
Al1 Pd Al1 6_554 . 6_555 108.91(3) ?
Al1 Pd Al2 6_554 . 2_555 125.45(2) ?
Al1 Pd Al2 6_554 . 3_665 65.729(16) ?
Al1 Pd Al2 6_555 . 2_555 125.45(2) ?
Al1 Pd Al2 6_555 . 3_665 65.729(16) ?
Al2 Pd Al2 2_555 . 3_665 131.072(10) ?
Yb1 Al1 Yb1 1_545 . 4_665 111.40(3) ?
Yb1 Al1 Ca1 1_545 . 1_545 0.0(5) ?
Yb1 Al1 Ca1 1_545 . 4_665 111.40(3) ?
Yb1 Al1 Yb2 1_545 . . 116.833(8) ?
Yb1 Al1 Yb2 1_545 . 1_556 116.833(8) ?
Yb1 Al1 Ca2 1_545 . . 116.833(8) ?
Yb1 Al1 Ca2 1_545 . 1_556 116.833(8) ?
Yb1 Al1 Pd 1_545 . 3_555 65.171(10) ?
Yb1 Al1 Pd 1_545 . 3_556 65.171(10) ?
Yb1 Al1 Pd 1_545 . 5_555 121.843(17) ?
Yb1 Al1 Pd 1_545 . 5_556 121.843(17) ?
Yb1 Al1 Al1 1_545 . 4_655 55.702(14) ?
Yb1 Al1 Al1 1_545 . 5_555 64.298(18) ?
Yb1 Al1 Al1 1_545 . 6_555 175.70(3) ?
Yb1 Al1 Al2 1_545 . . 68.302(15) ?
Yb1 Al1 Al2 1_545 . 1_556 68.302(15) ?
Yb1 Al1 Ca1 4_665 . 1_545 111.40(3) ?
Yb1 Al1 Ca1 4_665 . 4_665 0.0(5) ?
Yb1 Al1 Yb2 4_665 . . 116.833(9) ?
Yb1 Al1 Yb2 4_665 . 1_556 116.833(9) ?
Yb1 Al1 Ca2 4_665 . . 116.833(9) ?
Yb1 Al1 Ca2 4_665 . 1_556 116.833(9) ?
Yb1 Al1 Pd 4_665 . 3_555 121.843(17) ?
Yb1 Al1 Pd 4_665 . 3_556 121.843(17) ?
Yb1 Al1 Pd 4_665 . 5_555 65.171(9) ?
Yb1 Al1 Pd 4_665 . 5_556 65.171(9) ?
Yb1 Al1 Al1 4_665 . 4_655 55.702(15) ?
Yb1 Al1 Al1 4_665 . 5_555 175.70(3) ?
Yb1 Al1 Al1 4_665 . 6_555 64.298(18) ?
Yb1 Al1 Al2 4_665 . . 68.302(15) ?
Yb1 Al1 Al2 4_665 . 1_556 68.302(15) ?
Ca1 Al1 Ca1 1_545 . 4_665 111.40(3) ?
Ca1 Al1 Yb2 1_545 . . 116.833(8) ?
Ca1 Al1 Yb2 1_545 . 1_556 116.833(8) ?
Ca1 Al1 Ca2 1_545 . . 116.833(8) ?
Ca1 Al1 Ca2 1_545 . 1_556 116.833(8) ?
Ca1 Al1 Pd 1_545 . 3_555 65.171(10) ?
Ca1 Al1 Pd 1_545 . 3_556 65.171(10) ?
Ca1 Al1 Pd 1_545 . 5_555 121.843(17) ?
Ca1 Al1 Pd 1_545 . 5_556 121.843(17) ?
Ca1 Al1 Al1 1_545 . 4_655 55.702(14) ?
Ca1 Al1 Al1 1_545 . 5_555 64.298(18) ?
Ca1 Al1 Al1 1_545 . 6_555 175.70(3) ?
Ca1 Al1 Al2 1_545 . . 68.302(15) ?
Ca1 Al1 Al2 1_545 . 1_556 68.302(15) ?
Ca1 Al1 Yb2 4_665 . . 116.833(9) ?
Ca1 Al1 Yb2 4_665 . 1_556 116.833(9) ?
Ca1 Al1 Ca2 4_665 . . 116.833(9) ?
Ca1 Al1 Ca2 4_665 . 1_556 116.833(9) ?
Ca1 Al1 Pd 4_665 . 3_555 121.843(17) ?
Ca1 Al1 Pd 4_665 . 3_556 121.843(17) ?
Ca1 Al1 Pd 4_665 . 5_555 65.171(9) ?
Ca1 Al1 Pd 4_665 . 5_556 65.171(9) ?
Ca1 Al1 Al1 4_665 . 4_655 55.702(15) ?
Ca1 Al1 Al1 4_665 . 5_555 175.70(3) ?
Ca1 Al1 Al1 4_665 . 6_555 64.298(18) ?
Ca1 Al1 Al2 4_665 . . 68.302(15) ?
Ca1 Al1 Al2 4_665 . 1_556 68.302(15) ?
Yb2 Al1 Yb2 . . 1_556 73.538(19) ?
Yb2 Al1 Ca2 . . . 0.0(5) ?
Yb2 Al1 Ca2 . . 1_556 73.538(19) ?
Yb2 Al1 Pd . . 3_555 55.697(14) ?
Yb2 Al1 Pd . . 3_556 114.24(3) ?
Yb2 Al1 Pd . . 5_555 55.697(14) ?
Yb2 Al1 Pd . . 5_556 114.24(3) ?
Yb2 Al1 Al1 . . 4_655 143.231(9) ?
Yb2 Al1 Al1 . . 5_555 66.39(2) ?
Yb2 Al1 Al1 . . 6_555 66.39(2) ?
Yb2 Al1 Al2 . . . 94.235(8) ?
Yb2 Al1 Al2 . . 1_556 167.77(2) ?
Yb2 Al1 Ca2 1_556 . . 73.538(19) ?
Yb2 Al1 Ca2 1_556 . 1_556 0.0(5) ?
Yb2 Al1 Pd 1_556 . 3_555 114.24(3) ?
Yb2 Al1 Pd 1_556 . 3_556 55.697(14) ?
Yb2 Al1 Pd 1_556 . 5_555 114.24(3) ?
Yb2 Al1 Pd 1_556 . 5_556 55.697(14) ?
Yb2 Al1 Al1 1_556 . 4_655 143.231(9) ?
Yb2 Al1 Al1 1_556 . 5_555 66.39(2) ?
Yb2 Al1 Al1 1_556 . 6_555 66.39(2) ?
Yb2 Al1 Al2 1_556 . . 167.77(2) ?
Yb2 Al1 Al2 1_556 . 1_556 94.235(8) ?
Ca2 Al1 Ca2 . . 1_556 73.538(19) ?
Ca2 Al1 Pd . . 3_555 55.697(14) ?
Ca2 Al1 Pd . . 3_556 114.24(3) ?
Ca2 Al1 Pd . . 5_555 55.697(14) ?
Ca2 Al1 Pd . . 5_556 114.24(3) ?
Ca2 Al1 Al1 . . 4_655 143.231(9) ?
Ca2 Al1 Al1 . . 5_555 66.39(2) ?
Ca2 Al1 Al1 . . 6_555 66.39(2) ?
Ca2 Al1 Al2 . . . 94.235(8) ?
Ca2 Al1 Al2 . . 1_556 167.77(2) ?
Ca2 Al1 Pd 1_556 . 3_555 114.24(3) ?
Ca2 Al1 Pd 1_556 . 3_556 55.697(14) ?
Ca2 Al1 Pd 1_556 . 5_555 114.24(3) ?
Ca2 Al1 Pd 1_556 . 5_556 55.697(14) ?
Ca2 Al1 Al1 1_556 . 4_655 143.231(9) ?
Ca2 Al1 Al1 1_556 . 5_555 66.39(2) ?
Ca2 Al1 Al1 1_556 . 6_555 66.39(2) ?
Ca2 Al1 Al2 1_556 . . 167.77(2) ?
Ca2 Al1 Al2 1_556 . 1_556 94.235(8) ?
Pd Al1 Pd 3_555 . 3_556 108.905(10) ?
Pd Al1 Pd 3_555 . 5_555 69.986(9) ?
Pd Al1 Pd 3_555 . 5_556 169.03(4) ?
Pd Al1 Al1 3_555 . 4_655 95.48(2) ?
Pd Al1 Al1 3_555 . 5_555 57.015(9) ?
Pd Al1 Al1 3_555 . 6_555 116.67(2) ?
Pd Al1 Al2 3_555 . . 56.542(11) ?
Pd Al1 Al2 3_555 . 1_556 132.59(3) ?
Pd Al1 Pd 3_556 . 5_555 169.03(4) ?
Pd Al1 Pd 3_556 . 5_556 69.986(9) ?
Pd Al1 Al1 3_556 . 4_655 95.48(2) ?
Pd Al1 Al1 3_556 . 5_555 57.015(9) ?
Pd Al1 Al1 3_556 . 6_555 116.67(2) ?
Pd Al1 Al2 3_556 . . 132.59(3) ?
Pd Al1 Al2 3_556 . 1_556 56.542(11) ?
Pd Al1 Pd 5_555 . 5_556 108.905(11) ?
Pd Al1 Al1 5_555 . 4_655 95.48(2) ?
Pd Al1 Al1 5_555 . 5_555 116.67(2) ?
Pd Al1 Al1 5_555 . 6_555 57.015(10) ?
Pd Al1 Al2 5_555 . . 56.541(10) ?
Pd Al1 Al2 5_555 . 1_556 132.59(3) ?
Pd Al1 Al1 5_556 . 4_655 95.48(2) ?
Pd Al1 Al1 5_556 . 5_555 116.67(2) ?
Pd Al1 Al1 5_556 . 6_555 57.015(10) ?
Pd Al1 Al2 5_556 . . 132.59(3) ?
Pd Al1 Al2 5_556 . 1_556 56.541(10) ?
Al1 Al1 Al1 4_655 . 5_555 120.00(2) ?
Al1 Al1 Al1 4_655 . 6_555 120.00(2) ?
Al1 Al1 Al2 4_655 . . 48.996(15) ?
Al1 Al1 Al2 4_655 . 1_556 48.996(15) ?
Al1 Al1 Al1 5_555 . 6_555 120.00(4) ?
Al1 Al1 Al2 5_555 . . 109.151(12) ?
Al1 Al1 Al2 5_555 . 1_556 109.151(12) ?
Al1 Al1 Al2 6_555 . . 109.151(11) ?
Al1 Al1 Al2 6_555 . 1_556 109.151(11) ?
Al2 Al1 Al2 . . 1_556 97.99(3) ?
Yb1 Al2 Yb1 1_544 . 1_545 76.234(8) ?
Yb1 Al2 Yb1 1_544 . 4_664 103.766(8) ?
Yb1 Al2 Yb1 1_544 . 4_665 180.0(5) ?
Yb1 Al2 Ca1 1_544 . 1_544 0.0(5) ?
Yb1 Al2 Ca1 1_544 . 1_545 76.234(8) ?
Yb1 Al2 Ca1 1_544 . 4_664 103.766(8) ?
Yb1 Al2 Ca1 1_544 . 4_665 180.0(5) ?
Yb1 Al2 Pd 1_544 . 2_655 62.789(6) ?
Yb1 Al2 Pd 1_544 . 3_555 62.789(6) ?
Yb1 Al2 Pd 1_544 . 5_555 117.211(6) ?
Yb1 Al2 Pd 1_544 . 6_655 117.211(6) ?
Yb1 Al2 Al1 1_544 . 1_554 62.236(8) ?
Yb1 Al2 Al1 1_544 . . 117.764(9) ?
Yb1 Al2 Al1 1_544 . 4_654 62.236(9) ?
Yb1 Al2 Al1 1_544 . 4_655 117.764(8) ?
Yb1 Al2 Yb1 1_545 . 4_664 180.0(5) ?
Yb1 Al2 Yb1 1_545 . 4_665 103.766(8) ?
Yb1 Al2 Ca1 1_545 . 1_544 76.234(8) ?
Yb1 Al2 Ca1 1_545 . 1_545 0.0(5) ?
Yb1 Al2 Ca1 1_545 . 4_664 180.0(5) ?
Yb1 Al2 Ca1 1_545 . 4_665 103.766(8) ?
Yb1 Al2 Pd 1_545 . 2_655 62.789(6) ?
Yb1 Al2 Pd 1_545 . 3_555 62.789(6) ?
Yb1 Al2 Pd 1_545 . 5_555 117.211(6) ?
Yb1 Al2 Pd 1_545 . 6_655 117.211(6) ?
Yb1 Al2 Al1 1_545 . 1_554 117.764(9) ?
Yb1 Al2 Al1 1_545 . . 62.236(8) ?
Yb1 Al2 Al1 1_545 . 4_654 117.764(8) ?
Yb1 Al2 Al1 1_545 . 4_655 62.236(9) ?
Yb1 Al2 Yb1 4_664 . 4_665 76.234(8) ?
Yb1 Al2 Ca1 4_664 . 1_544 103.766(8) ?
Yb1 Al2 Ca1 4_664 . 1_545 180.0(5) ?
Yb1 Al2 Ca1 4_664 . 4_664 0.0(5) ?
Yb1 Al2 Ca1 4_664 . 4_665 76.234(8) ?
Yb1 Al2 Pd 4_664 . 2_655 117.211(6) ?
Yb1 Al2 Pd 4_664 . 3_555 117.211(6) ?
Yb1 Al2 Pd 4_664 . 5_555 62.789(6) ?
Yb1 Al2 Pd 4_664 . 6_655 62.789(6) ?
Yb1 Al2 Al1 4_664 . 1_554 62.236(9) ?
Yb1 Al2 Al1 4_664 . . 117.764(8) ?
Yb1 Al2 Al1 4_664 . 4_654 62.236(8) ?
Yb1 Al2 Al1 4_664 . 4_655 117.764(9) ?
Yb1 Al2 Ca1 4_665 . 1_544 180.0(5) ?
Yb1 Al2 Ca1 4_665 . 1_545 103.766(8) ?
Yb1 Al2 Ca1 4_665 . 4_664 76.234(8) ?
Yb1 Al2 Ca1 4_665 . 4_665 0.0(5) ?
Yb1 Al2 Pd 4_665 . 2_655 117.211(6) ?
Yb1 Al2 Pd 4_665 . 3_555 117.211(6) ?
Yb1 Al2 Pd 4_665 . 5_555 62.789(6) ?
Yb1 Al2 Pd 4_665 . 6_655 62.789(6) ?
Yb1 Al2 Al1 4_665 . 1_554 117.764(8) ?
Yb1 Al2 Al1 4_665 . . 62.236(9) ?
Yb1 Al2 Al1 4_665 . 4_654 117.764(9) ?
Yb1 Al2 Al1 4_665 . 4_655 62.236(8) ?
Ca1 Al2 Ca1 1_544 . 1_545 76.234(8) ?
Ca1 Al2 Ca1 1_544 . 4_664 103.766(8) ?
Ca1 Al2 Ca1 1_544 . 4_665 180.0(5) ?
Ca1 Al2 Pd 1_544 . 2_655 62.789(6) ?
Ca1 Al2 Pd 1_544 . 3_555 62.789(6) ?
Ca1 Al2 Pd 1_544 . 5_555 117.211(6) ?
Ca1 Al2 Pd 1_544 . 6_655 117.211(6) ?
Ca1 Al2 Al1 1_544 . 1_554 62.236(8) ?
Ca1 Al2 Al1 1_544 . . 117.764(9) ?
Ca1 Al2 Al1 1_544 . 4_654 62.236(9) ?
Ca1 Al2 Al1 1_544 . 4_655 117.764(8) ?
Ca1 Al2 Ca1 1_545 . 4_664 180.0(5) ?
Ca1 Al2 Ca1 1_545 . 4_665 103.766(8) ?
Ca1 Al2 Pd 1_545 . 2_655 62.789(6) ?
Ca1 Al2 Pd 1_545 . 3_555 62.789(6) ?
Ca1 Al2 Pd 1_545 . 5_555 117.211(6) ?
Ca1 Al2 Pd 1_545 . 6_655 117.211(6) ?
Ca1 Al2 Al1 1_545 . 1_554 117.764(9) ?
Ca1 Al2 Al1 1_545 . . 62.236(8) ?
Ca1 Al2 Al1 1_545 . 4_654 117.764(8) ?
Ca1 Al2 Al1 1_545 . 4_655 62.236(9) ?
Ca1 Al2 Ca1 4_664 . 4_665 76.234(8) ?
Ca1 Al2 Pd 4_664 . 2_655 117.211(6) ?
Ca1 Al2 Pd 4_664 . 3_555 117.211(6) ?
Ca1 Al2 Pd 4_664 . 5_555 62.789(6) ?
Ca1 Al2 Pd 4_664 . 6_655 62.789(6) ?
Ca1 Al2 Al1 4_664 . 1_554 62.236(9) ?
Ca1 Al2 Al1 4_664 . . 117.764(8) ?
Ca1 Al2 Al1 4_664 . 4_654 62.236(8) ?
Ca1 Al2 Al1 4_664 . 4_655 117.764(9) ?
Ca1 Al2 Pd 4_665 . 2_655 117.211(6) ?
Ca1 Al2 Pd 4_665 . 3_555 117.211(6) ?
Ca1 Al2 Pd 4_665 . 5_555 62.789(6) ?
Ca1 Al2 Pd 4_665 . 6_655 62.789(6) ?
Ca1 Al2 Al1 4_665 . 1_554 117.764(8) ?
Ca1 Al2 Al1 4_665 . . 62.236(9) ?
Ca1 Al2 Al1 4_665 . 4_654 117.764(9) ?
Ca1 Al2 Al1 4_665 . 4_655 62.236(8) ?
Pd Al2 Pd 2_655 . 3_555 108.928(9) ?
Pd Al2 Pd 2_655 . 5_555 180.0(5) ?
Pd Al2 Pd 2_655 . 6_655 71.072(9) ?
Pd Al2 Al1 2_655 . 1_554 122.270(11) ?
Pd Al2 Al1 2_655 . . 122.270(11) ?
Pd Al2 Al1 2_655 . 4_654 57.730(11) ?
Pd Al2 Al1 2_655 . 4_655 57.730(11) ?
Pd Al2 Pd 3_555 . 5_555 71.072(9) ?
Pd Al2 Pd 3_555 . 6_655 180.0(5) ?
Pd Al2 Al1 3_555 . 1_554 57.730(11) ?
Pd Al2 Al1 3_555 . . 57.730(11) ?
Pd Al2 Al1 3_555 . 4_654 122.270(11) ?
Pd Al2 Al1 3_555 . 4_655 122.270(11) ?
Pd Al2 Pd 5_555 . 6_655 108.928(9) ?
Pd Al2 Al1 5_555 . 1_554 57.730(11) ?
Pd Al2 Al1 5_555 . . 57.730(11) ?
Pd Al2 Al1 5_555 . 4_654 122.270(11) ?
Pd Al2 Al1 5_555 . 4_655 122.270(11) ?
Pd Al2 Al1 6_655 . 1_554 122.270(11) ?
Pd Al2 Al1 6_655 . . 122.270(11) ?
Pd Al2 Al1 6_655 . 4_654 57.730(11) ?
Pd Al2 Al1 6_655 . 4_655 57.730(11) ?
Al1 Al2 Al1 1_554 . . 97.99(2) ?
Al1 Al2 Al1 1_554 . 4_654 82.01(2) ?
Al1 Al2 Al1 1_554 . 4_655 180.0(5) ?
Al1 Al2 Al1 . . 4_654 180.0(5) ?
Al1 Al2 Al1 . . 4_655 82.01(2) ?
Al1 Al2 Al1 4_654 . 4_655 97.99(2) ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion
_geom_torsion_publ_flag
? ? ? ? ? ? ? ? ? ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_D
_geom_hbond_site_symmetry_H
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_publ_flag
? ? ? ? ? ? ? ? ? ? ?


####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_I_CCDC10
_database_code_depnum_ccdc_archive 'CCDC 1892598'
loop_
_audit_author_name
_audit_author_address
'Oliver Janka'
;WWU Muenster
Germany
;
_audit_update_record             
;
2019-04-17 deposited with the CCDC.	2019-10-14 downloaded from the CCDC.
;
#=======================================================================

# 5. CHEMICAL DATA

_chemical_name_systematic        
; ?
;
_chemical_name_common            ?
_chemical_formula_moiety         ?
_chemical_formula_structural     ?
_chemical_formula_analytical     ?
_chemical_formula_iupac          ?
_chemical_formula_sum            'Al3 Ca0.315 Pd2 Yb0.685'
_chemical_formula_weight         424.9
_chemical_melting_point          ?
_chemical_compound_source        ?
_chemical_absolute_configuration .

#=======================================================================

# 6. CRYSTAL DATA

_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_H-M   'P 6/m m m'
_symmetry_space_group_name_Hall  '-P 6;-2'
_symmetry_Int_Tables_number      191

loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -y,x-y,z
3 -x+y,-x,z
4 -x,-y,z
5 y,-x+y,z
6 x-y,x,z
7 y,x,-z
8 x-y,-y,-z
9 -x,-x+y,-z
10 -y,-x,-z
11 -x+y,y,-z
12 x,x-y,-z
13 -x,-y,-z
14 y,-x+y,-z
15 x-y,x,-z
16 x,y,-z
17 -y,x-y,-z
18 -x+y,-x,-z
19 -y,-x,z
20 -x+y,y,z
21 x,x-y,z
22 y,x,z
23 x-y,-y,z
24 -x,-x+y,z

_cell_length_a                   9.3122(12)
_cell_length_b                   9.3122(12)
_cell_length_c                   4.2090(5)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_volume                     316.09(7)

loop_
_twin_individual_id
_twin_individual_mass_fraction_refined
_twin_individual_twin_matrix_11
_twin_individual_twin_matrix_12
_twin_individual_twin_matrix_13
_twin_individual_twin_matrix_21
_twin_individual_twin_matrix_22
_twin_individual_twin_matrix_23
_twin_individual_twin_matrix_31
_twin_individual_twin_matrix_32
_twin_individual_twin_matrix_33
? ? ? ? ? ? ? ? ? ? ?

_cell_formula_units_Z            3

_cell_measurement_reflns_used    6499
_cell_measurement_theta_min      2.49
_cell_measurement_theta_max      30.00
_cell_measurement_temperature    293
_cell_special_details            
; ?
;

_exptl_crystal_density_diffrn    6.70
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_F_000             556

_exptl_absorpt_coefficient_mu    24.3
_exptl_crystal_description       block
_exptl_crystal_size_max          0.060
_exptl_crystal_size_mid          0.050
_exptl_crystal_size_min          0.040
_exptl_crystal_size_rad          ?
_exptl_crystal_colour            silver
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   ?
_exptl_absorpt_correction_T_min  0.3131
_exptl_absorpt_correction_T_max  0.4775
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
? ? ? ?

#=======================================================================

# 7. EXPERIMENTAL DATA

_exptl_special_details           ?

_diffrn_ambient_temperature      293
_diffrn_source                   ?
_diffrn_source_power             ?
_diffrn_source_voltage           ?
_diffrn_source_current           ?
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_source         'X-ray tube'
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'IPDS Stoe'
_diffrn_detector                 ?
_diffrn_detector_area_resol_mean ?
_diffrn_measurement_method       '??integration method??'
_diffrn_measurement_specimen_support ?

_diffrn_reflns_number            5375
_diffrn_reflns_theta_min         2.53
_diffrn_reflns_theta_max         33.37
_diffrn_reflns_theta_full        33.37
_diffrn_measured_fraction_theta_max 0.99
_diffrn_measured_fraction_theta_full 0.99
_diffrn_reflns_av_R_equivalents  0.0277
_diffrn_reflns_av_unetI/netI     0.0061
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_l_min       -6
_diffrn_reflns_limit_l_max       6
_diffrn_reflns_reduction_process ?

_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
loop_
_diffrn_standard_refln_index_h
_diffrn_standard_refln_index_k
_diffrn_standard_refln_index_l
? ? ?

_diffrn_radiation_probe          X-ray

#=======================================================================

# 8. REFINEMENT DATA

_refine_special_details          
; ?
;

_reflns_number_total             285
_reflns_number_gt                255
_reflns_threshold_expression     I>3σ(I)

_refine_ls_structure_factor_coef Fsqd
_refine_ls_R_factor_gt           0.0101
_refine_ls_wR_factor_gt          0.0221
_refine_ls_R_factor_all          0.0129
_refine_ls_wR_factor_ref         0.0232
_refine_ls_goodness_of_fit_ref   0.88
_refine_ls_goodness_of_fit_gt    0.89
_refine_ls_restrained_S_gt       ?
_refine_ls_restrained_S_all      ?
_refine_ls_number_reflns         285
_refine_ls_number_parameters     19
_refine_ls_number_restraints     0
_refine_ls_number_constraints    4
_refine_ls_weighting_scheme      sigma
_refine_ls_weighting_details     w=1/(σ²(I)+0.0004I²)
_refine_ls_hydrogen_treatment    ?
_refine_ls_shift/su_max          0.0001
_refine_ls_shift/su_mean         0.0000
_refine_diff_density_max         0.49
_refine_diff_density_min         -0.44
_refine_ls_extinction_method     
'B-C type 1 Lorentzian isotropic (Becker & Coppens, 1974)'
_refine_ls_extinction_coef       335(18)
_refine_ls_abs_structure_details ?
_refine_ls_abs_structure_Flack   ?
_refine_ls_abs_structure_Rogers  ?

loop_
_atom_type_symbol
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Al 0.0645 0.0514 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Ca 0.2262 0.3064 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Pd -0.9988 1.0072 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Yb -0.3850 5.5486 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    ?
_computing_structure_refinement  ?
_computing_molecular_graphics    ?
_computing_publication_material  ?

loop_
_restr_distance_atom_site_label_1
_restr_distance_site_symmetry_1
_restr_distance_atom_site_label_2
_restr_distance_site_symmetry_2
_restr_distance_target
_restr_distance_target_weight_param
? ? ? ? ? ?

loop_
_restr_angle_atom_site_label_1
_restr_angle_site_symmetry_1
_restr_angle_atom_site_label_2
_restr_angle_site_symmetry_2
_restr_angle_atom_site_label_3
_restr_angle_site_symmetry_3
_restr_angle_target
_restr_angle_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_torsion_atom_site_label_1
_restr_torsion_site_symmetry_1
_restr_torsion_atom_site_label_2
_restr_torsion_site_symmetry_2
_restr_torsion_atom_site_label_3
_restr_torsion_site_symmetry_3
_restr_torsion_atom_site_label_4
_restr_torsion_site_symmetry_4
_restr_torsion_angle_target
_restr_torsion_weight_param
? ? ? ? ? ? ? ? ? ?

loop_
_restr_equal_distance_atom_site_label_1
_restr_equal_distance_site_symmetry_1
_restr_equal_distance_atom_site_label_2
_restr_equal_distance_site_symmetry_2
_restr_equal_distance_class_class_id
_restr_equal_distance_class_target_weight_param
? ? ? ? ? ?

loop_
_restr_equal_angle_atom_site_label_1
_restr_equal_angle_site_symmetry_1
_restr_equal_angle_atom_site_label_2
_restr_equal_angle_site_symmetry_2
_restr_equal_angle_atom_site_label_3
_restr_equal_angle_site_symmetry_3
_restr_equal_angle_class_class_id
_restr_equal_angle_class_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_equal_torsion_atom_site_label_1
_restr_equal_torsion_site_symmetry_1
_restr_equal_torsion_atom_site_label_2
_restr_equal_torsion_site_symmetry_2
_restr_equal_torsion_atom_site_label_3
_restr_equal_torsion_site_symmetry_3
_restr_equal_torsion_atom_site_label_4
_restr_equal_torsion_site_symmetry_4
_restr_equal_torsion_class_class_id
_restr_equal_torsion_class_target_weight_param
? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 9. ATOMIC COORDINATES AND DISPLACEMENT PARAMETERS

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_adp_type
_atom_site_U_iso_or_equiv
_atom_site_site_symmetry_multiplicity
_atom_site_occupancy
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Yb1 Yb 0.333333 0.666667 0.5 Uani 0.00832(8) 2 0.797(3) d . . .
Ca1 Ca 0.333333 0.666667 0.5 Uani 0.00832(8) 2 0.203(3) d . . .
Yb2 Yb 0 0 0 Uani 0.01081(16) 1 0.461(3) d . . .
Ca2 Ca 0 0 0 Uani 0.01081(16) 1 0.539(3) d . . .
Pd Pd 0.37061(3) 0.185304(14) 0 Uani 0.00710(8) 6 1 d . . .
Al1 Al 0.30414(10) 0 0.5 Uani 0.0083(2) 6 1 d . . .
Al2 Al 0.5 0 0 Uani 0.0084(4) 3 1 d . . .


loop_
_jana_atom_site_ADP_C_label
_jana_atom_site_ADP_C_type_symbol
_jana_atom_site_ADP_C_111
_jana_atom_site_ADP_C_112
_jana_atom_site_ADP_C_113
_jana_atom_site_ADP_C_122
_jana_atom_site_ADP_C_123
_jana_atom_site_ADP_C_133
_jana_atom_site_ADP_C_222
_jana_atom_site_ADP_C_223
_jana_atom_site_ADP_C_233
_jana_atom_site_ADP_C_333
? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_D_label
_jana_atom_site_ADP_D_type_symbol
_jana_atom_site_ADP_D_1111
_jana_atom_site_ADP_D_1112
_jana_atom_site_ADP_D_1113
_jana_atom_site_ADP_D_1122
_jana_atom_site_ADP_D_1123
_jana_atom_site_ADP_D_1133
_jana_atom_site_ADP_D_1222
_jana_atom_site_ADP_D_1223
_jana_atom_site_ADP_D_1233
_jana_atom_site_ADP_D_1333
_jana_atom_site_ADP_D_2222
_jana_atom_site_ADP_D_2223
_jana_atom_site_ADP_D_2233
_jana_atom_site_ADP_D_2333
_jana_atom_site_ADP_D_3333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_E_label
_jana_atom_site_ADP_E_type_symbol
_jana_atom_site_ADP_E_11111
_jana_atom_site_ADP_E_11112
_jana_atom_site_ADP_E_11113
_jana_atom_site_ADP_E_11122
_jana_atom_site_ADP_E_11123
_jana_atom_site_ADP_E_11133
_jana_atom_site_ADP_E_11222
_jana_atom_site_ADP_E_11223
_jana_atom_site_ADP_E_11233
_jana_atom_site_ADP_E_11333
_jana_atom_site_ADP_E_12222
_jana_atom_site_ADP_E_12223
_jana_atom_site_ADP_E_12233
_jana_atom_site_ADP_E_12333
_jana_atom_site_ADP_E_13333
_jana_atom_site_ADP_E_22222
_jana_atom_site_ADP_E_22223
_jana_atom_site_ADP_E_22233
_jana_atom_site_ADP_E_22333
_jana_atom_site_ADP_E_23333
_jana_atom_site_ADP_E_33333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_F_label
_jana_atom_site_ADP_F_type_symbol
_jana_atom_site_ADP_F_111111
_jana_atom_site_ADP_F_111112
_jana_atom_site_ADP_F_111113
_jana_atom_site_ADP_F_111122
_jana_atom_site_ADP_F_111123
_jana_atom_site_ADP_F_111133
_jana_atom_site_ADP_F_111222
_jana_atom_site_ADP_F_111223
_jana_atom_site_ADP_F_111233
_jana_atom_site_ADP_F_111333
_jana_atom_site_ADP_F_112222
_jana_atom_site_ADP_F_112223
_jana_atom_site_ADP_F_112233
_jana_atom_site_ADP_F_112333
_jana_atom_site_ADP_F_113333
_jana_atom_site_ADP_F_122222
_jana_atom_site_ADP_F_122223
_jana_atom_site_ADP_F_122233
_jana_atom_site_ADP_F_122333
_jana_atom_site_ADP_F_123333
_jana_atom_site_ADP_F_133333
_jana_atom_site_ADP_F_222222
_jana_atom_site_ADP_F_222223
_jana_atom_site_ADP_F_222233
_jana_atom_site_ADP_F_222333
_jana_atom_site_ADP_F_223333
_jana_atom_site_ADP_F_233333
_jana_atom_site_ADP_F_333333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 10. MOLECULAR GEOMETRY


loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Yb1 Pd . 4_665 3.1827(7) ?
Yb1 Pd . 4_666 3.1827(7) ?
Yb1 Pd . 5_565 3.1827(5) ?
Yb1 Pd . 5_566 3.1827(5) ?
Yb1 Pd . 6_555 3.1827(7) ?
Yb1 Pd . 6_556 3.1827(7) ?
Yb1 Al1 . 1_565 3.2485(9) ?
Yb1 Al1 . 2_555 3.2485(14) ?
Yb1 Al1 . 3_665 3.2486(14) ?
Yb1 Al1 . 4_665 3.2485(14) ?
Yb1 Al1 . 5_565 3.2485(9) ?
Yb1 Al1 . 6_555 3.2486(14) ?
Yb1 Al2 . 1_565 3.4140(8) ?
Yb1 Al2 . 1_566 3.4140(8) ?
Yb1 Al2 . 2_555 3.4140(8) ?
Yb1 Al2 . 2_556 3.4140(8) ?
Yb1 Al2 . 3_665 3.4140(4) ?
Yb1 Al2 . 3_666 3.4140(4) ?
Ca1 Pd . 4_665 3.1827(7) ?
Ca1 Pd . 4_666 3.1827(7) ?
Ca1 Pd . 5_565 3.1827(5) ?
Ca1 Pd . 5_566 3.1827(5) ?
Ca1 Pd . 6_555 3.1827(7) ?
Ca1 Pd . 6_556 3.1827(7) ?
Ca1 Al1 . 1_565 3.2485(9) ?
Ca1 Al1 . 2_555 3.2485(14) ?
Ca1 Al1 . 3_665 3.2486(14) ?
Ca1 Al1 . 4_665 3.2485(14) ?
Ca1 Al1 . 5_565 3.2485(9) ?
Ca1 Al1 . 6_555 3.2486(14) ?
Ca1 Al2 . 1_565 3.4140(8) ?
Ca1 Al2 . 1_566 3.4140(8) ?
Ca1 Al2 . 2_555 3.4140(8) ?
Ca1 Al2 . 2_556 3.4140(8) ?
Ca1 Al2 . 3_665 3.4140(4) ?
Ca1 Al2 . 3_666 3.4140(4) ?
Yb2 Pd . . 2.9888(11) ?
Yb2 Pd . 2_555 2.9888(5) ?
Yb2 Pd . 3_555 2.9888(11) ?
Yb2 Pd . 4_555 2.9888(11) ?
Yb2 Pd . 5_555 2.9888(5) ?
Yb2 Pd . 6_555 2.9888(11) ?
Yb2 Al1 . 1_554 3.5285(10) ?
Yb2 Al1 . . 3.5285(10) ?
Yb2 Al1 . 2_554 3.5285(10) ?
Yb2 Al1 . 2_555 3.5285(10) ?
Yb2 Al1 . 3_554 3.5285(11) ?
Yb2 Al1 . 3_555 3.5285(11) ?
Yb2 Al1 . 4_554 3.5285(10) ?
Yb2 Al1 . 4_555 3.5285(10) ?
Yb2 Al1 . 5_554 3.5285(10) ?
Yb2 Al1 . 5_555 3.5285(10) ?
Yb2 Al1 . 6_554 3.5285(11) ?
Yb2 Al1 . 6_555 3.5285(11) ?
Ca2 Pd . . 2.9888(11) ?
Ca2 Pd . 2_555 2.9888(5) ?
Ca2 Pd . 3_555 2.9888(11) ?
Ca2 Pd . 4_555 2.9888(11) ?
Ca2 Pd . 5_555 2.9888(5) ?
Ca2 Pd . 6_555 2.9888(11) ?
Ca2 Al1 . 1_554 3.5285(10) ?
Ca2 Al1 . . 3.5285(10) ?
Ca2 Al1 . 2_554 3.5285(10) ?
Ca2 Al1 . 2_555 3.5285(10) ?
Ca2 Al1 . 3_554 3.5285(11) ?
Ca2 Al1 . 3_555 3.5285(11) ?
Ca2 Al1 . 4_554 3.5285(10) ?
Ca2 Al1 . 4_555 3.5285(10) ?
Ca2 Al1 . 5_554 3.5285(10) ?
Ca2 Al1 . 5_555 3.5285(10) ?
Ca2 Al1 . 6_554 3.5285(11) ?
Ca2 Al1 . 6_555 3.5285(11) ?
Pd Pd . 5_555 2.9888(11) ?
Pd Pd . 6_555 2.9888(6) ?
Pd Al1 . 1_554 2.5926(5) ?
Pd Al1 . . 2.5926(5) ?
Pd Al1 . 6_554 2.5926(8) ?
Pd Al1 . 6_555 2.5926(8) ?
Pd Al2 . . 2.5512(4) ?
Pd Al2 . 3_665 2.5512(9) ?
Al1 Al1 . 4_655 3.6478(17) ?
Al1 Al1 . 5_555 2.8322(13) ?
Al1 Al1 . 6_555 2.8322(14) ?
Al1 Al2 . . 2.7849(8) ?
Al1 Al2 . 1_556 2.7849(8) ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
Pd Yb1 Pd 4_665 . 4_666 82.788(13) ?
Pd Yb1 Pd 4_665 . 5_565 81.034(10) ?
Pd Yb1 Pd 4_665 . 5_566 135.940(9) ?
Pd Yb1 Pd 4_665 . 6_555 81.034(12) ?
Pd Yb1 Pd 4_665 . 6_556 135.940(8) ?
Pd Yb1 Al1 4_665 . 1_565 93.117(14) ?
Pd Yb1 Al1 4_665 . 2_555 128.373(11) ?
Pd Yb1 Al1 4_665 . 3_665 47.534(10) ?
Pd Yb1 Al1 4_665 . 4_665 47.534(9) ?
Pd Yb1 Al1 4_665 . 5_565 128.373(11) ?
Pd Yb1 Al1 4_665 . 6_555 93.117(14) ?
Pd Yb1 Al2 4_665 . 1_565 45.335(6) ?
Pd Yb1 Al2 4_665 . 1_566 96.445(12) ?
Pd Yb1 Al2 4_665 . 2_555 100.550(13) ?
Pd Yb1 Al2 4_665 . 2_556 176.662(3) ?
Pd Yb1 Al2 4_665 . 3_665 45.335(9) ?
Pd Yb1 Al2 4_665 . 3_666 96.445(10) ?
Pd Yb1 Pd 4_666 . 5_565 135.940(9) ?
Pd Yb1 Pd 4_666 . 5_566 81.034(10) ?
Pd Yb1 Pd 4_666 . 6_555 135.940(8) ?
Pd Yb1 Pd 4_666 . 6_556 81.034(12) ?
Pd Yb1 Al1 4_666 . 1_565 93.117(14) ?
Pd Yb1 Al1 4_666 . 2_555 128.373(11) ?
Pd Yb1 Al1 4_666 . 3_665 47.534(10) ?
Pd Yb1 Al1 4_666 . 4_665 47.534(9) ?
Pd Yb1 Al1 4_666 . 5_565 128.373(11) ?
Pd Yb1 Al1 4_666 . 6_555 93.117(14) ?
Pd Yb1 Al2 4_666 . 1_565 96.445(12) ?
Pd Yb1 Al2 4_666 . 1_566 45.335(6) ?
Pd Yb1 Al2 4_666 . 2_555 176.662(3) ?
Pd Yb1 Al2 4_666 . 2_556 100.550(13) ?
Pd Yb1 Al2 4_666 . 3_665 96.445(10) ?
Pd Yb1 Al2 4_666 . 3_666 45.335(9) ?
Pd Yb1 Pd 5_565 . 5_566 82.788(9) ?
Pd Yb1 Pd 5_565 . 6_555 81.034(11) ?
Pd Yb1 Pd 5_565 . 6_556 135.940(10) ?
Pd Yb1 Al1 5_565 . 1_565 47.534(8) ?
Pd Yb1 Al1 5_565 . 2_555 93.117(15) ?
Pd Yb1 Al1 5_565 . 3_665 128.373(9) ?
Pd Yb1 Al1 5_565 . 4_665 93.117(15) ?
Pd Yb1 Al1 5_565 . 5_565 47.534(8) ?
Pd Yb1 Al1 5_565 . 6_555 128.373(10) ?
Pd Yb1 Al2 5_565 . 1_565 45.335(8) ?
Pd Yb1 Al2 5_565 . 1_566 96.446(10) ?
Pd Yb1 Al2 5_565 . 2_555 45.335(9) ?
Pd Yb1 Al2 5_565 . 2_556 96.446(9) ?
Pd Yb1 Al2 5_565 . 3_665 100.550(8) ?
Pd Yb1 Al2 5_565 . 3_666 176.662(3) ?
Pd Yb1 Pd 5_566 . 6_555 135.940(10) ?
Pd Yb1 Pd 5_566 . 6_556 81.034(11) ?
Pd Yb1 Al1 5_566 . 1_565 47.534(8) ?
Pd Yb1 Al1 5_566 . 2_555 93.117(15) ?
Pd Yb1 Al1 5_566 . 3_665 128.373(9) ?
Pd Yb1 Al1 5_566 . 4_665 93.117(15) ?
Pd Yb1 Al1 5_566 . 5_565 47.534(8) ?
Pd Yb1 Al1 5_566 . 6_555 128.373(10) ?
Pd Yb1 Al2 5_566 . 1_565 96.446(10) ?
Pd Yb1 Al2 5_566 . 1_566 45.335(8) ?
Pd Yb1 Al2 5_566 . 2_555 96.446(9) ?
Pd Yb1 Al2 5_566 . 2_556 45.335(9) ?
Pd Yb1 Al2 5_566 . 3_665 176.662(3) ?
Pd Yb1 Al2 5_566 . 3_666 100.550(8) ?
Pd Yb1 Pd 6_555 . 6_556 82.788(13) ?
Pd Yb1 Al1 6_555 . 1_565 128.373(11) ?
Pd Yb1 Al1 6_555 . 2_555 47.534(10) ?
Pd Yb1 Al1 6_555 . 3_665 93.117(15) ?
Pd Yb1 Al1 6_555 . 4_665 128.373(11) ?
Pd Yb1 Al1 6_555 . 5_565 93.117(14) ?
Pd Yb1 Al1 6_555 . 6_555 47.534(11) ?
Pd Yb1 Al2 6_555 . 1_565 100.550(13) ?
Pd Yb1 Al2 6_555 . 1_566 176.662(3) ?
Pd Yb1 Al2 6_555 . 2_555 45.335(7) ?
Pd Yb1 Al2 6_555 . 2_556 96.445(12) ?
Pd Yb1 Al2 6_555 . 3_665 45.335(10) ?
Pd Yb1 Al2 6_555 . 3_666 96.445(10) ?
Pd Yb1 Al1 6_556 . 1_565 128.373(11) ?
Pd Yb1 Al1 6_556 . 2_555 47.534(10) ?
Pd Yb1 Al1 6_556 . 3_665 93.117(15) ?
Pd Yb1 Al1 6_556 . 4_665 128.373(11) ?
Pd Yb1 Al1 6_556 . 5_565 93.117(14) ?
Pd Yb1 Al1 6_556 . 6_555 47.534(11) ?
Pd Yb1 Al2 6_556 . 1_565 176.662(3) ?
Pd Yb1 Al2 6_556 . 1_566 100.550(13) ?
Pd Yb1 Al2 6_556 . 2_555 96.445(12) ?
Pd Yb1 Al2 6_556 . 2_556 45.335(7) ?
Pd Yb1 Al2 6_556 . 3_665 96.445(10) ?
Pd Yb1 Al2 6_556 . 3_666 45.335(10) ?
Al1 Yb1 Al1 1_565 . 2_555 120.00(2) ?
Al1 Yb1 Al1 1_565 . 3_665 120.00(2) ?
Al1 Yb1 Al1 1_565 . 4_665 68.31(2) ?
Al1 Yb1 Al1 1_565 . 5_565 51.69(2) ?
Al1 Yb1 Al1 1_565 . 6_555 171.69(2) ?
Al1 Yb1 Al2 1_565 . 1_565 49.339(11) ?
Al1 Yb1 Al2 1_565 . 1_566 49.339(11) ?
Al1 Yb1 Al2 1_565 . 2_555 86.728(14) ?
Al1 Yb1 Al2 1_565 . 2_556 86.728(14) ?
Al1 Yb1 Al2 1_565 . 3_665 135.126(8) ?
Al1 Yb1 Al2 1_565 . 3_666 135.126(8) ?
Al1 Yb1 Al1 2_555 . 3_665 120.00(2) ?
Al1 Yb1 Al1 2_555 . 4_665 171.69(2) ?
Al1 Yb1 Al1 2_555 . 5_565 68.31(2) ?
Al1 Yb1 Al1 2_555 . 6_555 51.69(2) ?
Al1 Yb1 Al2 2_555 . 1_565 135.126(10) ?
Al1 Yb1 Al2 2_555 . 1_566 135.126(10) ?
Al1 Yb1 Al2 2_555 . 2_555 49.339(11) ?
Al1 Yb1 Al2 2_555 . 2_556 49.339(11) ?
Al1 Yb1 Al2 2_555 . 3_665 86.728(15) ?
Al1 Yb1 Al2 2_555 . 3_666 86.728(15) ?
Al1 Yb1 Al1 3_665 . 4_665 51.69(2) ?
Al1 Yb1 Al1 3_665 . 5_565 171.69(2) ?
Al1 Yb1 Al1 3_665 . 6_555 68.31(2) ?
Al1 Yb1 Al2 3_665 . 1_565 86.728(15) ?
Al1 Yb1 Al2 3_665 . 1_566 86.728(15) ?
Al1 Yb1 Al2 3_665 . 2_555 135.126(10) ?
Al1 Yb1 Al2 3_665 . 2_556 135.126(10) ?
Al1 Yb1 Al2 3_665 . 3_665 49.339(10) ?
Al1 Yb1 Al2 3_665 . 3_666 49.339(10) ?
Al1 Yb1 Al1 4_665 . 5_565 120.00(2) ?
Al1 Yb1 Al1 4_665 . 6_555 120.00(2) ?
Al1 Yb1 Al2 4_665 . 1_565 49.339(11) ?
Al1 Yb1 Al2 4_665 . 1_566 49.339(11) ?
Al1 Yb1 Al2 4_665 . 2_555 135.126(10) ?
Al1 Yb1 Al2 4_665 . 2_556 135.126(10) ?
Al1 Yb1 Al2 4_665 . 3_665 86.728(15) ?
Al1 Yb1 Al2 4_665 . 3_666 86.728(15) ?
Al1 Yb1 Al1 5_565 . 6_555 120.00(2) ?
Al1 Yb1 Al2 5_565 . 1_565 86.728(14) ?
Al1 Yb1 Al2 5_565 . 1_566 86.728(14) ?
Al1 Yb1 Al2 5_565 . 2_555 49.339(11) ?
Al1 Yb1 Al2 5_565 . 2_556 49.339(11) ?
Al1 Yb1 Al2 5_565 . 3_665 135.126(8) ?
Al1 Yb1 Al2 5_565 . 3_666 135.126(8) ?
Al1 Yb1 Al2 6_555 . 1_565 135.126(10) ?
Al1 Yb1 Al2 6_555 . 1_566 135.126(10) ?
Al1 Yb1 Al2 6_555 . 2_555 86.728(15) ?
Al1 Yb1 Al2 6_555 . 2_556 86.728(15) ?
Al1 Yb1 Al2 6_555 . 3_665 49.339(10) ?
Al1 Yb1 Al2 6_555 . 3_666 49.339(10) ?
Al2 Yb1 Al2 1_565 . 1_566 76.112(12) ?
Al2 Yb1 Al2 1_565 . 2_555 85.987(12) ?
Al2 Yb1 Al2 1_565 . 2_556 133.630(5) ?
Al2 Yb1 Al2 1_565 . 3_665 85.987(9) ?
Al2 Yb1 Al2 1_565 . 3_666 133.630(8) ?
Al2 Yb1 Al2 1_566 . 2_555 133.630(5) ?
Al2 Yb1 Al2 1_566 . 2_556 85.987(12) ?
Al2 Yb1 Al2 1_566 . 3_665 133.630(8) ?
Al2 Yb1 Al2 1_566 . 3_666 85.987(9) ?
Al2 Yb1 Al2 2_555 . 2_556 76.112(12) ?
Al2 Yb1 Al2 2_555 . 3_665 85.987(9) ?
Al2 Yb1 Al2 2_555 . 3_666 133.630(8) ?
Al2 Yb1 Al2 2_556 . 3_665 133.630(8) ?
Al2 Yb1 Al2 2_556 . 3_666 85.987(9) ?
Al2 Yb1 Al2 3_665 . 3_666 76.112(8) ?
Pd Ca1 Pd 4_665 . 4_666 82.788(13) ?
Pd Ca1 Pd 4_665 . 5_565 81.034(10) ?
Pd Ca1 Pd 4_665 . 5_566 135.940(9) ?
Pd Ca1 Pd 4_665 . 6_555 81.034(12) ?
Pd Ca1 Pd 4_665 . 6_556 135.940(8) ?
Pd Ca1 Al1 4_665 . 1_565 93.117(14) ?
Pd Ca1 Al1 4_665 . 2_555 128.373(11) ?
Pd Ca1 Al1 4_665 . 3_665 47.534(10) ?
Pd Ca1 Al1 4_665 . 4_665 47.534(9) ?
Pd Ca1 Al1 4_665 . 5_565 128.373(11) ?
Pd Ca1 Al1 4_665 . 6_555 93.117(14) ?
Pd Ca1 Al2 4_665 . 1_565 45.335(6) ?
Pd Ca1 Al2 4_665 . 1_566 96.445(12) ?
Pd Ca1 Al2 4_665 . 2_555 100.550(13) ?
Pd Ca1 Al2 4_665 . 2_556 176.662(3) ?
Pd Ca1 Al2 4_665 . 3_665 45.335(9) ?
Pd Ca1 Al2 4_665 . 3_666 96.445(10) ?
Pd Ca1 Pd 4_666 . 5_565 135.940(9) ?
Pd Ca1 Pd 4_666 . 5_566 81.034(10) ?
Pd Ca1 Pd 4_666 . 6_555 135.940(8) ?
Pd Ca1 Pd 4_666 . 6_556 81.034(12) ?
Pd Ca1 Al1 4_666 . 1_565 93.117(14) ?
Pd Ca1 Al1 4_666 . 2_555 128.373(11) ?
Pd Ca1 Al1 4_666 . 3_665 47.534(10) ?
Pd Ca1 Al1 4_666 . 4_665 47.534(9) ?
Pd Ca1 Al1 4_666 . 5_565 128.373(11) ?
Pd Ca1 Al1 4_666 . 6_555 93.117(14) ?
Pd Ca1 Al2 4_666 . 1_565 96.445(12) ?
Pd Ca1 Al2 4_666 . 1_566 45.335(6) ?
Pd Ca1 Al2 4_666 . 2_555 176.662(3) ?
Pd Ca1 Al2 4_666 . 2_556 100.550(13) ?
Pd Ca1 Al2 4_666 . 3_665 96.445(10) ?
Pd Ca1 Al2 4_666 . 3_666 45.335(9) ?
Pd Ca1 Pd 5_565 . 5_566 82.788(9) ?
Pd Ca1 Pd 5_565 . 6_555 81.034(11) ?
Pd Ca1 Pd 5_565 . 6_556 135.940(10) ?
Pd Ca1 Al1 5_565 . 1_565 47.534(8) ?
Pd Ca1 Al1 5_565 . 2_555 93.117(15) ?
Pd Ca1 Al1 5_565 . 3_665 128.373(9) ?
Pd Ca1 Al1 5_565 . 4_665 93.117(15) ?
Pd Ca1 Al1 5_565 . 5_565 47.534(8) ?
Pd Ca1 Al1 5_565 . 6_555 128.373(10) ?
Pd Ca1 Al2 5_565 . 1_565 45.335(8) ?
Pd Ca1 Al2 5_565 . 1_566 96.446(10) ?
Pd Ca1 Al2 5_565 . 2_555 45.335(9) ?
Pd Ca1 Al2 5_565 . 2_556 96.446(9) ?
Pd Ca1 Al2 5_565 . 3_665 100.550(8) ?
Pd Ca1 Al2 5_565 . 3_666 176.662(3) ?
Pd Ca1 Pd 5_566 . 6_555 135.940(10) ?
Pd Ca1 Pd 5_566 . 6_556 81.034(11) ?
Pd Ca1 Al1 5_566 . 1_565 47.534(8) ?
Pd Ca1 Al1 5_566 . 2_555 93.117(15) ?
Pd Ca1 Al1 5_566 . 3_665 128.373(9) ?
Pd Ca1 Al1 5_566 . 4_665 93.117(15) ?
Pd Ca1 Al1 5_566 . 5_565 47.534(8) ?
Pd Ca1 Al1 5_566 . 6_555 128.373(10) ?
Pd Ca1 Al2 5_566 . 1_565 96.446(10) ?
Pd Ca1 Al2 5_566 . 1_566 45.335(8) ?
Pd Ca1 Al2 5_566 . 2_555 96.446(9) ?
Pd Ca1 Al2 5_566 . 2_556 45.335(9) ?
Pd Ca1 Al2 5_566 . 3_665 176.662(3) ?
Pd Ca1 Al2 5_566 . 3_666 100.550(8) ?
Pd Ca1 Pd 6_555 . 6_556 82.788(13) ?
Pd Ca1 Al1 6_555 . 1_565 128.373(11) ?
Pd Ca1 Al1 6_555 . 2_555 47.534(10) ?
Pd Ca1 Al1 6_555 . 3_665 93.117(15) ?
Pd Ca1 Al1 6_555 . 4_665 128.373(11) ?
Pd Ca1 Al1 6_555 . 5_565 93.117(14) ?
Pd Ca1 Al1 6_555 . 6_555 47.534(11) ?
Pd Ca1 Al2 6_555 . 1_565 100.550(13) ?
Pd Ca1 Al2 6_555 . 1_566 176.662(3) ?
Pd Ca1 Al2 6_555 . 2_555 45.335(7) ?
Pd Ca1 Al2 6_555 . 2_556 96.445(12) ?
Pd Ca1 Al2 6_555 . 3_665 45.335(10) ?
Pd Ca1 Al2 6_555 . 3_666 96.445(10) ?
Pd Ca1 Al1 6_556 . 1_565 128.373(11) ?
Pd Ca1 Al1 6_556 . 2_555 47.534(10) ?
Pd Ca1 Al1 6_556 . 3_665 93.117(15) ?
Pd Ca1 Al1 6_556 . 4_665 128.373(11) ?
Pd Ca1 Al1 6_556 . 5_565 93.117(14) ?
Pd Ca1 Al1 6_556 . 6_555 47.534(11) ?
Pd Ca1 Al2 6_556 . 1_565 176.662(3) ?
Pd Ca1 Al2 6_556 . 1_566 100.550(13) ?
Pd Ca1 Al2 6_556 . 2_555 96.445(12) ?
Pd Ca1 Al2 6_556 . 2_556 45.335(7) ?
Pd Ca1 Al2 6_556 . 3_665 96.445(10) ?
Pd Ca1 Al2 6_556 . 3_666 45.335(10) ?
Al1 Ca1 Al1 1_565 . 2_555 120.00(2) ?
Al1 Ca1 Al1 1_565 . 3_665 120.00(2) ?
Al1 Ca1 Al1 1_565 . 4_665 68.31(2) ?
Al1 Ca1 Al1 1_565 . 5_565 51.69(2) ?
Al1 Ca1 Al1 1_565 . 6_555 171.69(2) ?
Al1 Ca1 Al2 1_565 . 1_565 49.339(11) ?
Al1 Ca1 Al2 1_565 . 1_566 49.339(11) ?
Al1 Ca1 Al2 1_565 . 2_555 86.728(14) ?
Al1 Ca1 Al2 1_565 . 2_556 86.728(14) ?
Al1 Ca1 Al2 1_565 . 3_665 135.126(8) ?
Al1 Ca1 Al2 1_565 . 3_666 135.126(8) ?
Al1 Ca1 Al1 2_555 . 3_665 120.00(2) ?
Al1 Ca1 Al1 2_555 . 4_665 171.69(2) ?
Al1 Ca1 Al1 2_555 . 5_565 68.31(2) ?
Al1 Ca1 Al1 2_555 . 6_555 51.69(2) ?
Al1 Ca1 Al2 2_555 . 1_565 135.126(10) ?
Al1 Ca1 Al2 2_555 . 1_566 135.126(10) ?
Al1 Ca1 Al2 2_555 . 2_555 49.339(11) ?
Al1 Ca1 Al2 2_555 . 2_556 49.339(11) ?
Al1 Ca1 Al2 2_555 . 3_665 86.728(15) ?
Al1 Ca1 Al2 2_555 . 3_666 86.728(15) ?
Al1 Ca1 Al1 3_665 . 4_665 51.69(2) ?
Al1 Ca1 Al1 3_665 . 5_565 171.69(2) ?
Al1 Ca1 Al1 3_665 . 6_555 68.31(2) ?
Al1 Ca1 Al2 3_665 . 1_565 86.728(15) ?
Al1 Ca1 Al2 3_665 . 1_566 86.728(15) ?
Al1 Ca1 Al2 3_665 . 2_555 135.126(10) ?
Al1 Ca1 Al2 3_665 . 2_556 135.126(10) ?
Al1 Ca1 Al2 3_665 . 3_665 49.339(10) ?
Al1 Ca1 Al2 3_665 . 3_666 49.339(10) ?
Al1 Ca1 Al1 4_665 . 5_565 120.00(2) ?
Al1 Ca1 Al1 4_665 . 6_555 120.00(2) ?
Al1 Ca1 Al2 4_665 . 1_565 49.339(11) ?
Al1 Ca1 Al2 4_665 . 1_566 49.339(11) ?
Al1 Ca1 Al2 4_665 . 2_555 135.126(10) ?
Al1 Ca1 Al2 4_665 . 2_556 135.126(10) ?
Al1 Ca1 Al2 4_665 . 3_665 86.728(15) ?
Al1 Ca1 Al2 4_665 . 3_666 86.728(15) ?
Al1 Ca1 Al1 5_565 . 6_555 120.00(2) ?
Al1 Ca1 Al2 5_565 . 1_565 86.728(14) ?
Al1 Ca1 Al2 5_565 . 1_566 86.728(14) ?
Al1 Ca1 Al2 5_565 . 2_555 49.339(11) ?
Al1 Ca1 Al2 5_565 . 2_556 49.339(11) ?
Al1 Ca1 Al2 5_565 . 3_665 135.126(8) ?
Al1 Ca1 Al2 5_565 . 3_666 135.126(8) ?
Al1 Ca1 Al2 6_555 . 1_565 135.126(10) ?
Al1 Ca1 Al2 6_555 . 1_566 135.126(10) ?
Al1 Ca1 Al2 6_555 . 2_555 86.728(15) ?
Al1 Ca1 Al2 6_555 . 2_556 86.728(15) ?
Al1 Ca1 Al2 6_555 . 3_665 49.339(10) ?
Al1 Ca1 Al2 6_555 . 3_666 49.339(10) ?
Al2 Ca1 Al2 1_565 . 1_566 76.112(12) ?
Al2 Ca1 Al2 1_565 . 2_555 85.987(12) ?
Al2 Ca1 Al2 1_565 . 2_556 133.630(5) ?
Al2 Ca1 Al2 1_565 . 3_665 85.987(9) ?
Al2 Ca1 Al2 1_565 . 3_666 133.630(8) ?
Al2 Ca1 Al2 1_566 . 2_555 133.630(5) ?
Al2 Ca1 Al2 1_566 . 2_556 85.987(12) ?
Al2 Ca1 Al2 1_566 . 3_665 133.630(8) ?
Al2 Ca1 Al2 1_566 . 3_666 85.987(9) ?
Al2 Ca1 Al2 2_555 . 2_556 76.112(12) ?
Al2 Ca1 Al2 2_555 . 3_665 85.987(9) ?
Al2 Ca1 Al2 2_555 . 3_666 133.630(8) ?
Al2 Ca1 Al2 2_556 . 3_665 133.630(8) ?
Al2 Ca1 Al2 2_556 . 3_666 85.987(9) ?
Al2 Ca1 Al2 3_665 . 3_666 76.112(8) ?
Pd Yb2 Pd . . 2_555 120.000(12) ?
Pd Yb2 Pd . . 3_555 120.000(11) ?
Pd Yb2 Pd . . 4_555 180.0(5) ?
Pd Yb2 Pd . . 5_555 60.000(12) ?
Pd Yb2 Pd . . 6_555 60.000(11) ?
Pd Yb2 Al1 . . 1_554 45.963(9) ?
Pd Yb2 Al1 . . . 45.963(9) ?
Pd Yb2 Al1 . . 2_554 90.000(9) ?
Pd Yb2 Al1 . . 2_555 90.000(9) ?
Pd Yb2 Al1 . . 3_554 134.037(16) ?
Pd Yb2 Al1 . . 3_555 134.037(16) ?
Pd Yb2 Al1 . . 4_554 134.037(9) ?
Pd Yb2 Al1 . . 4_555 134.037(9) ?
Pd Yb2 Al1 . . 5_554 90.000(9) ?
Pd Yb2 Al1 . . 5_555 90.000(9) ?
Pd Yb2 Al1 . . 6_554 45.963(16) ?
Pd Yb2 Al1 . . 6_555 45.963(16) ?
Pd Yb2 Pd 2_555 . 3_555 120.000(13) ?
Pd Yb2 Pd 2_555 . 4_555 60.000(12) ?
Pd Yb2 Pd 2_555 . 5_555 180.0(5) ?
Pd Yb2 Pd 2_555 . 6_555 60.000(13) ?
Pd Yb2 Al1 2_555 . 1_554 134.037(9) ?
Pd Yb2 Al1 2_555 . . 134.037(9) ?
Pd Yb2 Al1 2_555 . 2_554 45.963(9) ?
Pd Yb2 Al1 2_555 . 2_555 45.963(9) ?
Pd Yb2 Al1 2_555 . 3_554 90.00(2) ?
Pd Yb2 Al1 2_555 . 3_555 90.00(2) ?
Pd Yb2 Al1 2_555 . 4_554 45.963(9) ?
Pd Yb2 Al1 2_555 . 4_555 45.963(9) ?
Pd Yb2 Al1 2_555 . 5_554 134.037(9) ?
Pd Yb2 Al1 2_555 . 5_555 134.037(9) ?
Pd Yb2 Al1 2_555 . 6_554 90.00(2) ?
Pd Yb2 Al1 2_555 . 6_555 90.00(2) ?
Pd Yb2 Pd 3_555 . 4_555 60.000(11) ?
Pd Yb2 Pd 3_555 . 5_555 60.000(13) ?
Pd Yb2 Pd 3_555 . 6_555 180.0(5) ?
Pd Yb2 Al1 3_555 . 1_554 90.000(10) ?
Pd Yb2 Al1 3_555 . . 90.000(10) ?
Pd Yb2 Al1 3_555 . 2_554 134.037(10) ?
Pd Yb2 Al1 3_555 . 2_555 134.037(10) ?
Pd Yb2 Al1 3_555 . 3_554 45.963(16) ?
Pd Yb2 Al1 3_555 . 3_555 45.963(16) ?
Pd Yb2 Al1 3_555 . 4_554 90.000(10) ?
Pd Yb2 Al1 3_555 . 4_555 90.000(10) ?
Pd Yb2 Al1 3_555 . 5_554 45.963(10) ?
Pd Yb2 Al1 3_555 . 5_555 45.963(10) ?
Pd Yb2 Al1 3_555 . 6_554 134.037(16) ?
Pd Yb2 Al1 3_555 . 6_555 134.037(16) ?
Pd Yb2 Pd 4_555 . 5_555 120.000(12) ?
Pd Yb2 Pd 4_555 . 6_555 120.000(11) ?
Pd Yb2 Al1 4_555 . 1_554 134.037(9) ?
Pd Yb2 Al1 4_555 . . 134.037(9) ?
Pd Yb2 Al1 4_555 . 2_554 90.000(9) ?
Pd Yb2 Al1 4_555 . 2_555 90.000(9) ?
Pd Yb2 Al1 4_555 . 3_554 45.963(16) ?
Pd Yb2 Al1 4_555 . 3_555 45.963(16) ?
Pd Yb2 Al1 4_555 . 4_554 45.963(9) ?
Pd Yb2 Al1 4_555 . 4_555 45.963(9) ?
Pd Yb2 Al1 4_555 . 5_554 90.000(9) ?
Pd Yb2 Al1 4_555 . 5_555 90.000(9) ?
Pd Yb2 Al1 4_555 . 6_554 134.037(16) ?
Pd Yb2 Al1 4_555 . 6_555 134.037(16) ?
Pd Yb2 Pd 5_555 . 6_555 120.000(13) ?
Pd Yb2 Al1 5_555 . 1_554 45.963(9) ?
Pd Yb2 Al1 5_555 . . 45.963(9) ?
Pd Yb2 Al1 5_555 . 2_554 134.037(9) ?
Pd Yb2 Al1 5_555 . 2_555 134.037(9) ?
Pd Yb2 Al1 5_555 . 3_554 90.00(2) ?
Pd Yb2 Al1 5_555 . 3_555 90.00(2) ?
Pd Yb2 Al1 5_555 . 4_554 134.037(9) ?
Pd Yb2 Al1 5_555 . 4_555 134.037(9) ?
Pd Yb2 Al1 5_555 . 5_554 45.963(9) ?
Pd Yb2 Al1 5_555 . 5_555 45.963(9) ?
Pd Yb2 Al1 5_555 . 6_554 90.00(2) ?
Pd Yb2 Al1 5_555 . 6_555 90.00(2) ?
Pd Yb2 Al1 6_555 . 1_554 90.000(10) ?
Pd Yb2 Al1 6_555 . . 90.000(10) ?
Pd Yb2 Al1 6_555 . 2_554 45.963(10) ?
Pd Yb2 Al1 6_555 . 2_555 45.963(10) ?
Pd Yb2 Al1 6_555 . 3_554 134.037(16) ?
Pd Yb2 Al1 6_555 . 3_555 134.037(16) ?
Pd Yb2 Al1 6_555 . 4_554 90.000(10) ?
Pd Yb2 Al1 6_555 . 4_555 90.000(10) ?
Pd Yb2 Al1 6_555 . 5_554 134.037(10) ?
Pd Yb2 Al1 6_555 . 5_555 134.037(10) ?
Pd Yb2 Al1 6_555 . 6_554 45.963(16) ?
Pd Yb2 Al1 6_555 . 6_555 45.963(16) ?
Al1 Yb2 Al1 1_554 . . 73.229(16) ?
Al1 Yb2 Al1 1_554 . 2_554 88.075(11) ?
Al1 Yb2 Al1 1_554 . 2_555 132.677(9) ?
Al1 Yb2 Al1 1_554 . 3_554 88.075(19) ?
Al1 Yb2 Al1 1_554 . 3_555 132.68(2) ?
Al1 Yb2 Al1 1_554 . 4_554 106.771(16) ?
Al1 Yb2 Al1 1_554 . 4_555 180.0(5) ?
Al1 Yb2 Al1 1_554 . 5_554 47.323(9) ?
Al1 Yb2 Al1 1_554 . 5_555 91.925(11) ?
Al1 Yb2 Al1 1_554 . 6_554 47.32(2) ?
Al1 Yb2 Al1 1_554 . 6_555 91.925(19) ?
Al1 Yb2 Al1 . . 2_554 132.677(9) ?
Al1 Yb2 Al1 . . 2_555 88.075(11) ?
Al1 Yb2 Al1 . . 3_554 132.68(2) ?
Al1 Yb2 Al1 . . 3_555 88.075(19) ?
Al1 Yb2 Al1 . . 4_554 180.0(5) ?
Al1 Yb2 Al1 . . 4_555 106.771(16) ?
Al1 Yb2 Al1 . . 5_554 91.925(11) ?
Al1 Yb2 Al1 . . 5_555 47.323(9) ?
Al1 Yb2 Al1 . . 6_554 91.925(19) ?
Al1 Yb2 Al1 . . 6_555 47.32(2) ?
Al1 Yb2 Al1 2_554 . 2_555 73.229(16) ?
Al1 Yb2 Al1 2_554 . 3_554 88.075(19) ?
Al1 Yb2 Al1 2_554 . 3_555 132.68(2) ?
Al1 Yb2 Al1 2_554 . 4_554 47.323(9) ?
Al1 Yb2 Al1 2_554 . 4_555 91.925(11) ?
Al1 Yb2 Al1 2_554 . 5_554 106.771(16) ?
Al1 Yb2 Al1 2_554 . 5_555 180.0(5) ?
Al1 Yb2 Al1 2_554 . 6_554 47.32(2) ?
Al1 Yb2 Al1 2_554 . 6_555 91.925(19) ?
Al1 Yb2 Al1 2_555 . 3_554 132.68(2) ?
Al1 Yb2 Al1 2_555 . 3_555 88.075(19) ?
Al1 Yb2 Al1 2_555 . 4_554 91.925(11) ?
Al1 Yb2 Al1 2_555 . 4_555 47.323(9) ?
Al1 Yb2 Al1 2_555 . 5_554 180.0(5) ?
Al1 Yb2 Al1 2_555 . 5_555 106.771(16) ?
Al1 Yb2 Al1 2_555 . 6_554 91.925(19) ?
Al1 Yb2 Al1 2_555 . 6_555 47.32(2) ?
Al1 Yb2 Al1 3_554 . 3_555 73.229(16) ?
Al1 Yb2 Al1 3_554 . 4_554 47.32(2) ?
Al1 Yb2 Al1 3_554 . 4_555 91.925(19) ?
Al1 Yb2 Al1 3_554 . 5_554 47.32(2) ?
Al1 Yb2 Al1 3_554 . 5_555 91.925(19) ?
Al1 Yb2 Al1 3_554 . 6_554 106.771(16) ?
Al1 Yb2 Al1 3_554 . 6_555 180.0(5) ?
Al1 Yb2 Al1 3_555 . 4_554 91.925(19) ?
Al1 Yb2 Al1 3_555 . 4_555 47.32(2) ?
Al1 Yb2 Al1 3_555 . 5_554 91.925(19) ?
Al1 Yb2 Al1 3_555 . 5_555 47.32(2) ?
Al1 Yb2 Al1 3_555 . 6_554 180.0(5) ?
Al1 Yb2 Al1 3_555 . 6_555 106.771(16) ?
Al1 Yb2 Al1 4_554 . 4_555 73.229(16) ?
Al1 Yb2 Al1 4_554 . 5_554 88.075(11) ?
Al1 Yb2 Al1 4_554 . 5_555 132.677(9) ?
Al1 Yb2 Al1 4_554 . 6_554 88.075(19) ?
Al1 Yb2 Al1 4_554 . 6_555 132.68(2) ?
Al1 Yb2 Al1 4_555 . 5_554 132.677(9) ?
Al1 Yb2 Al1 4_555 . 5_555 88.075(11) ?
Al1 Yb2 Al1 4_555 . 6_554 132.68(2) ?
Al1 Yb2 Al1 4_555 . 6_555 88.075(19) ?
Al1 Yb2 Al1 5_554 . 5_555 73.229(16) ?
Al1 Yb2 Al1 5_554 . 6_554 88.075(19) ?
Al1 Yb2 Al1 5_554 . 6_555 132.68(2) ?
Al1 Yb2 Al1 5_555 . 6_554 132.68(2) ?
Al1 Yb2 Al1 5_555 . 6_555 88.075(19) ?
Al1 Yb2 Al1 6_554 . 6_555 73.229(16) ?
Pd Ca2 Pd . . 2_555 120.000(12) ?
Pd Ca2 Pd . . 3_555 120.000(11) ?
Pd Ca2 Pd . . 4_555 180.0(5) ?
Pd Ca2 Pd . . 5_555 60.000(12) ?
Pd Ca2 Pd . . 6_555 60.000(11) ?
Pd Ca2 Al1 . . 1_554 45.963(9) ?
Pd Ca2 Al1 . . . 45.963(9) ?
Pd Ca2 Al1 . . 2_554 90.000(9) ?
Pd Ca2 Al1 . . 2_555 90.000(9) ?
Pd Ca2 Al1 . . 3_554 134.037(16) ?
Pd Ca2 Al1 . . 3_555 134.037(16) ?
Pd Ca2 Al1 . . 4_554 134.037(9) ?
Pd Ca2 Al1 . . 4_555 134.037(9) ?
Pd Ca2 Al1 . . 5_554 90.000(9) ?
Pd Ca2 Al1 . . 5_555 90.000(9) ?
Pd Ca2 Al1 . . 6_554 45.963(16) ?
Pd Ca2 Al1 . . 6_555 45.963(16) ?
Pd Ca2 Pd 2_555 . 3_555 120.000(13) ?
Pd Ca2 Pd 2_555 . 4_555 60.000(12) ?
Pd Ca2 Pd 2_555 . 5_555 180.0(5) ?
Pd Ca2 Pd 2_555 . 6_555 60.000(13) ?
Pd Ca2 Al1 2_555 . 1_554 134.037(9) ?
Pd Ca2 Al1 2_555 . . 134.037(9) ?
Pd Ca2 Al1 2_555 . 2_554 45.963(9) ?
Pd Ca2 Al1 2_555 . 2_555 45.963(9) ?
Pd Ca2 Al1 2_555 . 3_554 90.00(2) ?
Pd Ca2 Al1 2_555 . 3_555 90.00(2) ?
Pd Ca2 Al1 2_555 . 4_554 45.963(9) ?
Pd Ca2 Al1 2_555 . 4_555 45.963(9) ?
Pd Ca2 Al1 2_555 . 5_554 134.037(9) ?
Pd Ca2 Al1 2_555 . 5_555 134.037(9) ?
Pd Ca2 Al1 2_555 . 6_554 90.00(2) ?
Pd Ca2 Al1 2_555 . 6_555 90.00(2) ?
Pd Ca2 Pd 3_555 . 4_555 60.000(11) ?
Pd Ca2 Pd 3_555 . 5_555 60.000(13) ?
Pd Ca2 Pd 3_555 . 6_555 180.0(5) ?
Pd Ca2 Al1 3_555 . 1_554 90.000(10) ?
Pd Ca2 Al1 3_555 . . 90.000(10) ?
Pd Ca2 Al1 3_555 . 2_554 134.037(10) ?
Pd Ca2 Al1 3_555 . 2_555 134.037(10) ?
Pd Ca2 Al1 3_555 . 3_554 45.963(16) ?
Pd Ca2 Al1 3_555 . 3_555 45.963(16) ?
Pd Ca2 Al1 3_555 . 4_554 90.000(10) ?
Pd Ca2 Al1 3_555 . 4_555 90.000(10) ?
Pd Ca2 Al1 3_555 . 5_554 45.963(10) ?
Pd Ca2 Al1 3_555 . 5_555 45.963(10) ?
Pd Ca2 Al1 3_555 . 6_554 134.037(16) ?
Pd Ca2 Al1 3_555 . 6_555 134.037(16) ?
Pd Ca2 Pd 4_555 . 5_555 120.000(12) ?
Pd Ca2 Pd 4_555 . 6_555 120.000(11) ?
Pd Ca2 Al1 4_555 . 1_554 134.037(9) ?
Pd Ca2 Al1 4_555 . . 134.037(9) ?
Pd Ca2 Al1 4_555 . 2_554 90.000(9) ?
Pd Ca2 Al1 4_555 . 2_555 90.000(9) ?
Pd Ca2 Al1 4_555 . 3_554 45.963(16) ?
Pd Ca2 Al1 4_555 . 3_555 45.963(16) ?
Pd Ca2 Al1 4_555 . 4_554 45.963(9) ?
Pd Ca2 Al1 4_555 . 4_555 45.963(9) ?
Pd Ca2 Al1 4_555 . 5_554 90.000(9) ?
Pd Ca2 Al1 4_555 . 5_555 90.000(9) ?
Pd Ca2 Al1 4_555 . 6_554 134.037(16) ?
Pd Ca2 Al1 4_555 . 6_555 134.037(16) ?
Pd Ca2 Pd 5_555 . 6_555 120.000(13) ?
Pd Ca2 Al1 5_555 . 1_554 45.963(9) ?
Pd Ca2 Al1 5_555 . . 45.963(9) ?
Pd Ca2 Al1 5_555 . 2_554 134.037(9) ?
Pd Ca2 Al1 5_555 . 2_555 134.037(9) ?
Pd Ca2 Al1 5_555 . 3_554 90.00(2) ?
Pd Ca2 Al1 5_555 . 3_555 90.00(2) ?
Pd Ca2 Al1 5_555 . 4_554 134.037(9) ?
Pd Ca2 Al1 5_555 . 4_555 134.037(9) ?
Pd Ca2 Al1 5_555 . 5_554 45.963(9) ?
Pd Ca2 Al1 5_555 . 5_555 45.963(9) ?
Pd Ca2 Al1 5_555 . 6_554 90.00(2) ?
Pd Ca2 Al1 5_555 . 6_555 90.00(2) ?
Pd Ca2 Al1 6_555 . 1_554 90.000(10) ?
Pd Ca2 Al1 6_555 . . 90.000(10) ?
Pd Ca2 Al1 6_555 . 2_554 45.963(10) ?
Pd Ca2 Al1 6_555 . 2_555 45.963(10) ?
Pd Ca2 Al1 6_555 . 3_554 134.037(16) ?
Pd Ca2 Al1 6_555 . 3_555 134.037(16) ?
Pd Ca2 Al1 6_555 . 4_554 90.000(10) ?
Pd Ca2 Al1 6_555 . 4_555 90.000(10) ?
Pd Ca2 Al1 6_555 . 5_554 134.037(10) ?
Pd Ca2 Al1 6_555 . 5_555 134.037(10) ?
Pd Ca2 Al1 6_555 . 6_554 45.963(16) ?
Pd Ca2 Al1 6_555 . 6_555 45.963(16) ?
Al1 Ca2 Al1 1_554 . . 73.229(16) ?
Al1 Ca2 Al1 1_554 . 2_554 88.075(11) ?
Al1 Ca2 Al1 1_554 . 2_555 132.677(9) ?
Al1 Ca2 Al1 1_554 . 3_554 88.075(19) ?
Al1 Ca2 Al1 1_554 . 3_555 132.68(2) ?
Al1 Ca2 Al1 1_554 . 4_554 106.771(16) ?
Al1 Ca2 Al1 1_554 . 4_555 180.0(5) ?
Al1 Ca2 Al1 1_554 . 5_554 47.323(9) ?
Al1 Ca2 Al1 1_554 . 5_555 91.925(11) ?
Al1 Ca2 Al1 1_554 . 6_554 47.32(2) ?
Al1 Ca2 Al1 1_554 . 6_555 91.925(19) ?
Al1 Ca2 Al1 . . 2_554 132.677(9) ?
Al1 Ca2 Al1 . . 2_555 88.075(11) ?
Al1 Ca2 Al1 . . 3_554 132.68(2) ?
Al1 Ca2 Al1 . . 3_555 88.075(19) ?
Al1 Ca2 Al1 . . 4_554 180.0(5) ?
Al1 Ca2 Al1 . . 4_555 106.771(16) ?
Al1 Ca2 Al1 . . 5_554 91.925(11) ?
Al1 Ca2 Al1 . . 5_555 47.323(9) ?
Al1 Ca2 Al1 . . 6_554 91.925(19) ?
Al1 Ca2 Al1 . . 6_555 47.32(2) ?
Al1 Ca2 Al1 2_554 . 2_555 73.229(16) ?
Al1 Ca2 Al1 2_554 . 3_554 88.075(19) ?
Al1 Ca2 Al1 2_554 . 3_555 132.68(2) ?
Al1 Ca2 Al1 2_554 . 4_554 47.323(9) ?
Al1 Ca2 Al1 2_554 . 4_555 91.925(11) ?
Al1 Ca2 Al1 2_554 . 5_554 106.771(16) ?
Al1 Ca2 Al1 2_554 . 5_555 180.0(5) ?
Al1 Ca2 Al1 2_554 . 6_554 47.32(2) ?
Al1 Ca2 Al1 2_554 . 6_555 91.925(19) ?
Al1 Ca2 Al1 2_555 . 3_554 132.68(2) ?
Al1 Ca2 Al1 2_555 . 3_555 88.075(19) ?
Al1 Ca2 Al1 2_555 . 4_554 91.925(11) ?
Al1 Ca2 Al1 2_555 . 4_555 47.323(9) ?
Al1 Ca2 Al1 2_555 . 5_554 180.0(5) ?
Al1 Ca2 Al1 2_555 . 5_555 106.771(16) ?
Al1 Ca2 Al1 2_555 . 6_554 91.925(19) ?
Al1 Ca2 Al1 2_555 . 6_555 47.32(2) ?
Al1 Ca2 Al1 3_554 . 3_555 73.229(16) ?
Al1 Ca2 Al1 3_554 . 4_554 47.32(2) ?
Al1 Ca2 Al1 3_554 . 4_555 91.925(19) ?
Al1 Ca2 Al1 3_554 . 5_554 47.32(2) ?
Al1 Ca2 Al1 3_554 . 5_555 91.925(19) ?
Al1 Ca2 Al1 3_554 . 6_554 106.771(16) ?
Al1 Ca2 Al1 3_554 . 6_555 180.0(5) ?
Al1 Ca2 Al1 3_555 . 4_554 91.925(19) ?
Al1 Ca2 Al1 3_555 . 4_555 47.32(2) ?
Al1 Ca2 Al1 3_555 . 5_554 91.925(19) ?
Al1 Ca2 Al1 3_555 . 5_555 47.32(2) ?
Al1 Ca2 Al1 3_555 . 6_554 180.0(5) ?
Al1 Ca2 Al1 3_555 . 6_555 106.771(16) ?
Al1 Ca2 Al1 4_554 . 4_555 73.229(16) ?
Al1 Ca2 Al1 4_554 . 5_554 88.075(11) ?
Al1 Ca2 Al1 4_554 . 5_555 132.677(9) ?
Al1 Ca2 Al1 4_554 . 6_554 88.075(19) ?
Al1 Ca2 Al1 4_554 . 6_555 132.68(2) ?
Al1 Ca2 Al1 4_555 . 5_554 132.677(9) ?
Al1 Ca2 Al1 4_555 . 5_555 88.075(11) ?
Al1 Ca2 Al1 4_555 . 6_554 132.68(2) ?
Al1 Ca2 Al1 4_555 . 6_555 88.075(19) ?
Al1 Ca2 Al1 5_554 . 5_555 73.229(16) ?
Al1 Ca2 Al1 5_554 . 6_554 88.075(19) ?
Al1 Ca2 Al1 5_554 . 6_555 132.68(2) ?
Al1 Ca2 Al1 5_555 . 6_554 132.68(2) ?
Al1 Ca2 Al1 5_555 . 6_555 88.075(19) ?
Al1 Ca2 Al1 6_554 . 6_555 73.229(16) ?
Yb1 Pd Yb1 4_664 . 4_665 82.788(13) ?
Yb1 Pd Ca1 4_664 . 4_664 0.0(5) ?
Yb1 Pd Ca1 4_664 . 4_665 82.788(13) ?
Yb1 Pd Yb2 4_664 . . 138.606(7) ?
Yb1 Pd Ca2 4_664 . . 138.606(7) ?
Yb1 Pd Pd 4_664 . 5_555 112.030(10) ?
Yb1 Pd Pd 4_664 . 6_555 112.030(9) ?
Yb1 Pd Al1 4_664 . 1_554 67.565(18) ?
Yb1 Pd Al1 4_664 . . 133.78(2) ?
Yb1 Pd Al1 4_664 . 6_554 67.57(2) ?
Yb1 Pd Al1 4_664 . 6_555 133.777(17) ?
Yb1 Pd Al2 4_664 . . 72.131(10) ?
Yb1 Pd Al2 4_664 . 3_665 72.131(8) ?
Yb1 Pd Ca1 4_665 . 4_664 82.788(13) ?
Yb1 Pd Ca1 4_665 . 4_665 0.0(5) ?
Yb1 Pd Yb2 4_665 . . 138.606(7) ?
Yb1 Pd Ca2 4_665 . . 138.606(7) ?
Yb1 Pd Pd 4_665 . 5_555 112.030(10) ?
Yb1 Pd Pd 4_665 . 6_555 112.030(9) ?
Yb1 Pd Al1 4_665 . 1_554 133.78(2) ?
Yb1 Pd Al1 4_665 . . 67.565(18) ?
Yb1 Pd Al1 4_665 . 6_554 133.777(17) ?
Yb1 Pd Al1 4_665 . 6_555 67.57(2) ?
Yb1 Pd Al2 4_665 . . 72.131(10) ?
Yb1 Pd Al2 4_665 . 3_665 72.131(8) ?
Ca1 Pd Ca1 4_664 . 4_665 82.788(13) ?
Ca1 Pd Yb2 4_664 . . 138.606(7) ?
Ca1 Pd Ca2 4_664 . . 138.606(7) ?
Ca1 Pd Pd 4_664 . 5_555 112.030(10) ?
Ca1 Pd Pd 4_664 . 6_555 112.030(9) ?
Ca1 Pd Al1 4_664 . 1_554 67.565(18) ?
Ca1 Pd Al1 4_664 . . 133.78(2) ?
Ca1 Pd Al1 4_664 . 6_554 67.57(2) ?
Ca1 Pd Al1 4_664 . 6_555 133.777(17) ?
Ca1 Pd Al2 4_664 . . 72.131(10) ?
Ca1 Pd Al2 4_664 . 3_665 72.131(8) ?
Ca1 Pd Yb2 4_665 . . 138.606(7) ?
Ca1 Pd Ca2 4_665 . . 138.606(7) ?
Ca1 Pd Pd 4_665 . 5_555 112.030(10) ?
Ca1 Pd Pd 4_665 . 6_555 112.030(9) ?
Ca1 Pd Al1 4_665 . 1_554 133.78(2) ?
Ca1 Pd Al1 4_665 . . 67.565(18) ?
Ca1 Pd Al1 4_665 . 6_554 133.777(17) ?
Ca1 Pd Al1 4_665 . 6_555 67.57(2) ?
Ca1 Pd Al2 4_665 . . 72.131(10) ?
Ca1 Pd Al2 4_665 . 3_665 72.131(8) ?
Yb2 Pd Ca2 . . . 0.0(5) ?
Yb2 Pd Pd . . 5_555 60.000(10) ?
Yb2 Pd Pd . . 6_555 60.000(12) ?
Yb2 Pd Al1 . . 1_554 78.07(2) ?
Yb2 Pd Al1 . . . 78.07(2) ?
Yb2 Pd Al1 . . 6_554 78.067(19) ?
Yb2 Pd Al1 . . 6_555 78.067(19) ?
Yb2 Pd Al2 . . . 114.143(12) ?
Yb2 Pd Al2 . . 3_665 114.143(13) ?
Ca2 Pd Pd . . 5_555 60.000(10) ?
Ca2 Pd Pd . . 6_555 60.000(12) ?
Ca2 Pd Al1 . . 1_554 78.07(2) ?
Ca2 Pd Al1 . . . 78.07(2) ?
Ca2 Pd Al1 . . 6_554 78.067(19) ?
Ca2 Pd Al1 . . 6_555 78.067(19) ?
Ca2 Pd Al2 . . . 114.143(12) ?
Ca2 Pd Al2 . . 3_665 114.143(13) ?
Pd Pd Pd 5_555 . 6_555 120.000(14) ?
Pd Pd Al1 5_555 . 1_554 54.802(6) ?
Pd Pd Al1 5_555 . . 54.802(6) ?
Pd Pd Al1 5_555 . 6_554 111.694(17) ?
Pd Pd Al1 5_555 . 6_555 111.694(17) ?
Pd Pd Al2 5_555 . . 54.143(11) ?
Pd Pd Al2 5_555 . 3_665 174.143(12) ?
Pd Pd Al1 6_555 . 1_554 111.69(2) ?
Pd Pd Al1 6_555 . . 111.69(2) ?
Pd Pd Al1 6_555 . 6_554 54.80(2) ?
Pd Pd Al1 6_555 . 6_555 54.80(2) ?
Pd Pd Al2 6_555 . . 174.143(8) ?
Pd Pd Al2 6_555 . 3_665 54.143(11) ?
Al1 Pd Al1 1_554 . . 108.531(13) ?
Al1 Pd Al1 1_554 . 6_554 66.21(2) ?
Al1 Pd Al1 1_554 . 6_555 156.13(3) ?
Al1 Pd Al2 1_554 . . 65.55(2) ?
Al1 Pd Al2 1_554 . 3_665 125.662(6) ?
Al1 Pd Al1 . . 6_554 156.13(3) ?
Al1 Pd Al1 . . 6_555 66.21(2) ?
Al1 Pd Al2 . . . 65.55(2) ?
Al1 Pd Al2 . . 3_665 125.662(6) ?
Al1 Pd Al1 6_554 . 6_555 108.53(3) ?
Al1 Pd Al2 6_554 . . 125.66(2) ?
Al1 Pd Al2 6_554 . 3_665 65.553(17) ?
Al1 Pd Al2 6_555 . . 125.66(2) ?
Al1 Pd Al2 6_555 . 3_665 65.553(17) ?
Al2 Pd Al2 . . 3_665 131.714(13) ?
Yb1 Al1 Yb1 1_545 . 4_665 111.69(3) ?
Yb1 Al1 Ca1 1_545 . 1_545 0.0(5) ?
Yb1 Al1 Ca1 1_545 . 4_665 111.69(3) ?
Yb1 Al1 Yb2 1_545 . . 116.786(9) ?
Yb1 Al1 Yb2 1_545 . 1_556 116.786(9) ?
Yb1 Al1 Ca2 1_545 . . 116.786(9) ?
Yb1 Al1 Ca2 1_545 . 1_556 116.786(9) ?
Yb1 Al1 Pd 1_545 . . 121.991(18) ?
Yb1 Al1 Pd 1_545 . 1_556 121.991(18) ?
Yb1 Al1 Pd 1_545 . 5_555 64.901(12) ?
Yb1 Al1 Pd 1_545 . 5_556 64.901(12) ?
Yb1 Al1 Al1 1_545 . 4_655 55.844(16) ?
Yb1 Al1 Al1 1_545 . 5_555 64.16(2) ?
Yb1 Al1 Al1 1_545 . 6_555 175.84(4) ?
Yb1 Al1 Al2 1_545 . . 68.425(16) ?
Yb1 Al1 Al2 1_545 . 1_556 68.425(16) ?
Yb1 Al1 Ca1 4_665 . 1_545 111.69(3) ?
Yb1 Al1 Ca1 4_665 . 4_665 0.0(5) ?
Yb1 Al1 Yb2 4_665 . . 116.786(11) ?
Yb1 Al1 Yb2 4_665 . 1_556 116.786(11) ?
Yb1 Al1 Ca2 4_665 . . 116.786(11) ?
Yb1 Al1 Ca2 4_665 . 1_556 116.786(11) ?
Yb1 Al1 Pd 4_665 . . 64.901(11) ?
Yb1 Al1 Pd 4_665 . 1_556 64.901(11) ?
Yb1 Al1 Pd 4_665 . 5_555 121.991(18) ?
Yb1 Al1 Pd 4_665 . 5_556 121.991(18) ?
Yb1 Al1 Al1 4_665 . 4_655 55.844(18) ?
Yb1 Al1 Al1 4_665 . 5_555 175.84(4) ?
Yb1 Al1 Al1 4_665 . 6_555 64.16(2) ?
Yb1 Al1 Al2 4_665 . . 68.425(17) ?
Yb1 Al1 Al2 4_665 . 1_556 68.425(17) ?
Ca1 Al1 Ca1 1_545 . 4_665 111.69(3) ?
Ca1 Al1 Yb2 1_545 . . 116.786(9) ?
Ca1 Al1 Yb2 1_545 . 1_556 116.786(9) ?
Ca1 Al1 Ca2 1_545 . . 116.786(9) ?
Ca1 Al1 Ca2 1_545 . 1_556 116.786(9) ?
Ca1 Al1 Pd 1_545 . . 121.991(18) ?
Ca1 Al1 Pd 1_545 . 1_556 121.991(18) ?
Ca1 Al1 Pd 1_545 . 5_555 64.901(12) ?
Ca1 Al1 Pd 1_545 . 5_556 64.901(12) ?
Ca1 Al1 Al1 1_545 . 4_655 55.844(16) ?
Ca1 Al1 Al1 1_545 . 5_555 64.16(2) ?
Ca1 Al1 Al1 1_545 . 6_555 175.84(4) ?
Ca1 Al1 Al2 1_545 . . 68.425(16) ?
Ca1 Al1 Al2 1_545 . 1_556 68.425(16) ?
Ca1 Al1 Yb2 4_665 . . 116.786(11) ?
Ca1 Al1 Yb2 4_665 . 1_556 116.786(11) ?
Ca1 Al1 Ca2 4_665 . . 116.786(11) ?
Ca1 Al1 Ca2 4_665 . 1_556 116.786(11) ?
Ca1 Al1 Pd 4_665 . . 64.901(11) ?
Ca1 Al1 Pd 4_665 . 1_556 64.901(11) ?
Ca1 Al1 Pd 4_665 . 5_555 121.991(18) ?
Ca1 Al1 Pd 4_665 . 5_556 121.991(18) ?
Ca1 Al1 Al1 4_665 . 4_655 55.844(18) ?
Ca1 Al1 Al1 4_665 . 5_555 175.84(4) ?
Ca1 Al1 Al1 4_665 . 6_555 64.16(2) ?
Ca1 Al1 Al2 4_665 . . 68.425(17) ?
Ca1 Al1 Al2 4_665 . 1_556 68.425(17) ?
Yb2 Al1 Yb2 . . 1_556 73.23(2) ?
Yb2 Al1 Ca2 . . . 0.0(5) ?
Yb2 Al1 Ca2 . . 1_556 73.23(2) ?
Yb2 Al1 Pd . . . 55.970(16) ?
Yb2 Al1 Pd . . 1_556 114.12(3) ?
Yb2 Al1 Pd . . 5_555 55.970(15) ?
Yb2 Al1 Pd . . 5_556 114.12(3) ?
Yb2 Al1 Al1 . . 4_655 143.385(11) ?
Yb2 Al1 Al1 . . 5_555 66.34(2) ?
Yb2 Al1 Al1 . . 6_555 66.34(2) ?
Yb2 Al1 Al2 . . . 94.300(11) ?
Yb2 Al1 Al2 . . 1_556 167.53(2) ?
Yb2 Al1 Ca2 1_556 . . 73.23(2) ?
Yb2 Al1 Ca2 1_556 . 1_556 0.0(5) ?
Yb2 Al1 Pd 1_556 . . 114.12(3) ?
Yb2 Al1 Pd 1_556 . 1_556 55.970(16) ?
Yb2 Al1 Pd 1_556 . 5_555 114.12(3) ?
Yb2 Al1 Pd 1_556 . 5_556 55.970(15) ?
Yb2 Al1 Al1 1_556 . 4_655 143.385(11) ?
Yb2 Al1 Al1 1_556 . 5_555 66.34(2) ?
Yb2 Al1 Al1 1_556 . 6_555 66.34(2) ?
Yb2 Al1 Al2 1_556 . . 167.53(2) ?
Yb2 Al1 Al2 1_556 . 1_556 94.300(11) ?
Ca2 Al1 Ca2 . . 1_556 73.23(2) ?
Ca2 Al1 Pd . . . 55.970(16) ?
Ca2 Al1 Pd . . 1_556 114.12(3) ?
Ca2 Al1 Pd . . 5_555 55.970(15) ?
Ca2 Al1 Pd . . 5_556 114.12(3) ?
Ca2 Al1 Al1 . . 4_655 143.385(11) ?
Ca2 Al1 Al1 . . 5_555 66.34(2) ?
Ca2 Al1 Al1 . . 6_555 66.34(2) ?
Ca2 Al1 Al2 . . . 94.300(11) ?
Ca2 Al1 Al2 . . 1_556 167.53(2) ?
Ca2 Al1 Pd 1_556 . . 114.12(3) ?
Ca2 Al1 Pd 1_556 . 1_556 55.970(16) ?
Ca2 Al1 Pd 1_556 . 5_555 114.12(3) ?
Ca2 Al1 Pd 1_556 . 5_556 55.970(15) ?
Ca2 Al1 Al1 1_556 . 4_655 143.385(11) ?
Ca2 Al1 Al1 1_556 . 5_555 66.34(2) ?
Ca2 Al1 Al1 1_556 . 6_555 66.34(2) ?
Ca2 Al1 Al2 1_556 . . 167.53(2) ?
Ca2 Al1 Al2 1_556 . 1_556 94.300(11) ?
Pd Al1 Pd . . 1_556 108.531(13) ?
Pd Al1 Pd . . 5_555 70.397(13) ?
Pd Al1 Pd . . 5_556 169.21(4) ?
Pd Al1 Al1 . . 4_655 95.40(2) ?
Pd Al1 Al1 . . 5_555 116.88(2) ?
Pd Al1 Al1 . . 6_555 56.893(11) ?
Pd Al1 Al2 . . . 56.508(11) ?
Pd Al1 Al2 . . 1_556 132.45(3) ?
Pd Al1 Pd 1_556 . 5_555 169.21(4) ?
Pd Al1 Pd 1_556 . 5_556 70.397(13) ?
Pd Al1 Al1 1_556 . 4_655 95.40(2) ?
Pd Al1 Al1 1_556 . 5_555 116.88(2) ?
Pd Al1 Al1 1_556 . 6_555 56.893(11) ?
Pd Al1 Al2 1_556 . . 132.45(3) ?
Pd Al1 Al2 1_556 . 1_556 56.508(11) ?
Pd Al1 Pd 5_555 . 5_556 108.531(14) ?
Pd Al1 Al1 5_555 . 4_655 95.40(2) ?
Pd Al1 Al1 5_555 . 5_555 56.893(11) ?
Pd Al1 Al1 5_555 . 6_555 116.88(2) ?
Pd Al1 Al2 5_555 . . 56.508(13) ?
Pd Al1 Al2 5_555 . 1_556 132.45(3) ?
Pd Al1 Al1 5_556 . 4_655 95.40(2) ?
Pd Al1 Al1 5_556 . 5_555 56.893(11) ?
Pd Al1 Al1 5_556 . 6_555 116.88(2) ?
Pd Al1 Al2 5_556 . . 132.45(3) ?
Pd Al1 Al2 5_556 . 1_556 56.508(13) ?
Al1 Al1 Al1 4_655 . 5_555 120.00(3) ?
Al1 Al1 Al1 4_655 . 6_555 120.00(3) ?
Al1 Al1 Al2 4_655 . . 49.086(16) ?
Al1 Al1 Al2 4_655 . 1_556 49.086(16) ?
Al1 Al1 Al1 5_555 . 6_555 120.00(4) ?
Al1 Al1 Al2 5_555 . . 109.115(13) ?
Al1 Al1 Al2 5_555 . 1_556 109.115(13) ?
Al1 Al1 Al2 6_555 . . 109.115(12) ?
Al1 Al1 Al2 6_555 . 1_556 109.115(12) ?
Al2 Al1 Al2 . . 1_556 98.17(3) ?
Yb1 Al2 Yb1 1_544 . 1_545 76.112(12) ?
Yb1 Al2 Yb1 1_544 . 4_664 103.888(12) ?
Yb1 Al2 Yb1 1_544 . 4_665 180.0(5) ?
Yb1 Al2 Ca1 1_544 . 1_544 0.0(5) ?
Yb1 Al2 Ca1 1_544 . 1_545 76.112(12) ?
Yb1 Al2 Ca1 1_544 . 4_664 103.888(12) ?
Yb1 Al2 Ca1 1_544 . 4_665 180.0(5) ?
Yb1 Al2 Pd 1_544 . . 117.467(9) ?
Yb1 Al2 Pd 1_544 . 2_655 117.467(9) ?
Yb1 Al2 Pd 1_544 . 4_655 62.533(9) ?
Yb1 Al2 Pd 1_544 . 5_555 62.533(9) ?
Yb1 Al2 Al1 1_544 . 1_554 62.236(9) ?
Yb1 Al2 Al1 1_544 . . 117.764(12) ?
Yb1 Al2 Al1 1_544 . 4_654 62.236(12) ?
Yb1 Al2 Al1 1_544 . 4_655 117.764(9) ?
Yb1 Al2 Yb1 1_545 . 4_664 180.0(5) ?
Yb1 Al2 Yb1 1_545 . 4_665 103.888(12) ?
Yb1 Al2 Ca1 1_545 . 1_544 76.112(12) ?
Yb1 Al2 Ca1 1_545 . 1_545 0.0(5) ?
Yb1 Al2 Ca1 1_545 . 4_664 180.0(5) ?
Yb1 Al2 Ca1 1_545 . 4_665 103.888(12) ?
Yb1 Al2 Pd 1_545 . . 117.467(9) ?
Yb1 Al2 Pd 1_545 . 2_655 117.467(9) ?
Yb1 Al2 Pd 1_545 . 4_655 62.533(9) ?
Yb1 Al2 Pd 1_545 . 5_555 62.533(9) ?
Yb1 Al2 Al1 1_545 . 1_554 117.764(12) ?
Yb1 Al2 Al1 1_545 . . 62.236(9) ?
Yb1 Al2 Al1 1_545 . 4_654 117.764(9) ?
Yb1 Al2 Al1 1_545 . 4_655 62.236(12) ?
Yb1 Al2 Yb1 4_664 . 4_665 76.112(12) ?
Yb1 Al2 Ca1 4_664 . 1_544 103.888(12) ?
Yb1 Al2 Ca1 4_664 . 1_545 180.0(5) ?
Yb1 Al2 Ca1 4_664 . 4_664 0.0(5) ?
Yb1 Al2 Ca1 4_664 . 4_665 76.112(12) ?
Yb1 Al2 Pd 4_664 . . 62.533(9) ?
Yb1 Al2 Pd 4_664 . 2_655 62.533(9) ?
Yb1 Al2 Pd 4_664 . 4_655 117.467(9) ?
Yb1 Al2 Pd 4_664 . 5_555 117.467(9) ?
Yb1 Al2 Al1 4_664 . 1_554 62.236(12) ?
Yb1 Al2 Al1 4_664 . . 117.764(9) ?
Yb1 Al2 Al1 4_664 . 4_654 62.236(9) ?
Yb1 Al2 Al1 4_664 . 4_655 117.764(12) ?
Yb1 Al2 Ca1 4_665 . 1_544 180.0(5) ?
Yb1 Al2 Ca1 4_665 . 1_545 103.888(12) ?
Yb1 Al2 Ca1 4_665 . 4_664 76.112(12) ?
Yb1 Al2 Ca1 4_665 . 4_665 0.0(5) ?
Yb1 Al2 Pd 4_665 . . 62.533(9) ?
Yb1 Al2 Pd 4_665 . 2_655 62.533(9) ?
Yb1 Al2 Pd 4_665 . 4_655 117.467(9) ?
Yb1 Al2 Pd 4_665 . 5_555 117.467(9) ?
Yb1 Al2 Al1 4_665 . 1_554 117.764(9) ?
Yb1 Al2 Al1 4_665 . . 62.236(12) ?
Yb1 Al2 Al1 4_665 . 4_654 117.764(12) ?
Yb1 Al2 Al1 4_665 . 4_655 62.236(9) ?
Ca1 Al2 Ca1 1_544 . 1_545 76.112(12) ?
Ca1 Al2 Ca1 1_544 . 4_664 103.888(12) ?
Ca1 Al2 Ca1 1_544 . 4_665 180.0(5) ?
Ca1 Al2 Pd 1_544 . . 117.467(9) ?
Ca1 Al2 Pd 1_544 . 2_655 117.467(9) ?
Ca1 Al2 Pd 1_544 . 4_655 62.533(9) ?
Ca1 Al2 Pd 1_544 . 5_555 62.533(9) ?
Ca1 Al2 Al1 1_544 . 1_554 62.236(9) ?
Ca1 Al2 Al1 1_544 . . 117.764(12) ?
Ca1 Al2 Al1 1_544 . 4_654 62.236(12) ?
Ca1 Al2 Al1 1_544 . 4_655 117.764(9) ?
Ca1 Al2 Ca1 1_545 . 4_664 180.0(5) ?
Ca1 Al2 Ca1 1_545 . 4_665 103.888(12) ?
Ca1 Al2 Pd 1_545 . . 117.467(9) ?
Ca1 Al2 Pd 1_545 . 2_655 117.467(9) ?
Ca1 Al2 Pd 1_545 . 4_655 62.533(9) ?
Ca1 Al2 Pd 1_545 . 5_555 62.533(9) ?
Ca1 Al2 Al1 1_545 . 1_554 117.764(12) ?
Ca1 Al2 Al1 1_545 . . 62.236(9) ?
Ca1 Al2 Al1 1_545 . 4_654 117.764(9) ?
Ca1 Al2 Al1 1_545 . 4_655 62.236(12) ?
Ca1 Al2 Ca1 4_664 . 4_665 76.112(12) ?
Ca1 Al2 Pd 4_664 . . 62.533(9) ?
Ca1 Al2 Pd 4_664 . 2_655 62.533(9) ?
Ca1 Al2 Pd 4_664 . 4_655 117.467(9) ?
Ca1 Al2 Pd 4_664 . 5_555 117.467(9) ?
Ca1 Al2 Al1 4_664 . 1_554 62.236(12) ?
Ca1 Al2 Al1 4_664 . . 117.764(9) ?
Ca1 Al2 Al1 4_664 . 4_654 62.236(9) ?
Ca1 Al2 Al1 4_664 . 4_655 117.764(12) ?
Ca1 Al2 Pd 4_665 . . 62.533(9) ?
Ca1 Al2 Pd 4_665 . 2_655 62.533(9) ?
Ca1 Al2 Pd 4_665 . 4_655 117.467(9) ?
Ca1 Al2 Pd 4_665 . 5_555 117.467(9) ?
Ca1 Al2 Al1 4_665 . 1_554 117.764(9) ?
Ca1 Al2 Al1 4_665 . . 62.236(12) ?
Ca1 Al2 Al1 4_665 . 4_654 117.764(12) ?
Ca1 Al2 Al1 4_665 . 4_655 62.236(9) ?
Pd Al2 Pd . . 2_655 108.286(14) ?
Pd Al2 Pd . . 4_655 180.0(5) ?
Pd Al2 Pd . . 5_555 71.714(14) ?
Pd Al2 Al1 . . 1_554 57.940(12) ?
Pd Al2 Al1 . . . 57.940(12) ?
Pd Al2 Al1 . . 4_654 122.060(12) ?
Pd Al2 Al1 . . 4_655 122.060(12) ?
Pd Al2 Pd 2_655 . 4_655 71.714(14) ?
Pd Al2 Pd 2_655 . 5_555 180.0(5) ?
Pd Al2 Al1 2_655 . 1_554 122.060(13) ?
Pd Al2 Al1 2_655 . . 122.060(13) ?
Pd Al2 Al1 2_655 . 4_654 57.940(13) ?
Pd Al2 Al1 2_655 . 4_655 57.940(13) ?
Pd Al2 Pd 4_655 . 5_555 108.286(14) ?
Pd Al2 Al1 4_655 . 1_554 122.060(12) ?
Pd Al2 Al1 4_655 . . 122.060(12) ?
Pd Al2 Al1 4_655 . 4_654 57.940(12) ?
Pd Al2 Al1 4_655 . 4_655 57.940(12) ?
Pd Al2 Al1 5_555 . 1_554 57.940(13) ?
Pd Al2 Al1 5_555 . . 57.940(13) ?
Pd Al2 Al1 5_555 . 4_654 122.060(13) ?
Pd Al2 Al1 5_555 . 4_655 122.060(13) ?
Al1 Al2 Al1 1_554 . . 98.17(2) ?
Al1 Al2 Al1 1_554 . 4_654 81.83(2) ?
Al1 Al2 Al1 1_554 . 4_655 180.0(5) ?
Al1 Al2 Al1 . . 4_654 180.0(5) ?
Al1 Al2 Al1 . . 4_655 81.83(2) ?
Al1 Al2 Al1 4_654 . 4_655 98.17(2) ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion
_geom_torsion_publ_flag
? ? ? ? ? ? ? ? ? ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_D
_geom_hbond_site_symmetry_H
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_publ_flag
? ? ? ? ? ? ? ? ? ? ?


####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_I_CCDC11
_database_code_depnum_ccdc_archive 'CCDC 1880786'
loop_
_audit_author_name
_audit_author_address
'Oliver Janka'
;WWU Muenster
Germany
;
_audit_update_record             
;
2019-04-17 deposited with the CCDC.	2019-10-14 downloaded from the CCDC.
;
#=======================================================================

# 5. CHEMICAL DATA

_chemical_name_systematic        
; ?
;
_chemical_name_common            ?
_chemical_formula_moiety         ?
_chemical_formula_structural     ?
_chemical_formula_analytical     ?
_chemical_formula_iupac          ?
_chemical_formula_sum            'Al3 Pd2 Yb1'
_chemical_formula_weight         466.8
_chemical_melting_point          ?
_chemical_compound_source        ?
_chemical_absolute_configuration .

#=======================================================================

# 6. CRYSTAL DATA

_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_H-M   'P 6/m m m'
_symmetry_space_group_name_Hall  '-P 6;-2'
_symmetry_Int_Tables_number      191

loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -y,x-y,z
3 -x+y,-x,z
4 -x,-y,z
5 y,-x+y,z
6 x-y,x,z
7 y,x,-z
8 x-y,-y,-z
9 -x,-x+y,-z
10 -y,-x,-z
11 -x+y,y,-z
12 x,x-y,-z
13 -x,-y,-z
14 y,-x+y,-z
15 x-y,x,-z
16 x,y,-z
17 -y,x-y,-z
18 -x+y,-x,-z
19 -y,-x,z
20 -x+y,y,z
21 x,x-y,z
22 y,x,z
23 x-y,-y,z
24 -x,-x+y,z

_cell_length_a                   9.2956(7)
_cell_length_b                   9.2956(7)
_cell_length_c                   4.2016(3)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_volume                     314.41(4)

loop_
_twin_individual_id
_twin_individual_mass_fraction_refined
_twin_individual_twin_matrix_11
_twin_individual_twin_matrix_12
_twin_individual_twin_matrix_13
_twin_individual_twin_matrix_21
_twin_individual_twin_matrix_22
_twin_individual_twin_matrix_23
_twin_individual_twin_matrix_31
_twin_individual_twin_matrix_32
_twin_individual_twin_matrix_33
? ? ? ? ? ? ? ? ? ? ?

_cell_formula_units_Z            3

_cell_measurement_reflns_used    9042
_cell_measurement_theta_min      2.54
_cell_measurement_theta_max      36.51
_cell_measurement_temperature    300
_cell_special_details            
; ?
;

_exptl_crystal_density_diffrn    7.40
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_F_000             603

_exptl_absorpt_coefficient_mu    31.0
_exptl_crystal_description       plate
_exptl_crystal_size_max          0.120
_exptl_crystal_size_mid          0.075
_exptl_crystal_size_min          0.025
_exptl_crystal_size_rad          ?
_exptl_crystal_colour            silver
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   ?
_exptl_absorpt_correction_T_min  0.1130
_exptl_absorpt_correction_T_max  0.4913
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
? ? ? ?

#=======================================================================

# 7. EXPERIMENTAL DATA

_exptl_special_details           ?

_diffrn_ambient_temperature      300
_diffrn_source                   ?
_diffrn_source_power             ?
_diffrn_source_voltage           ?
_diffrn_source_current           ?
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_source         'X-ray tube'
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'Stoe StadiVari'
_diffrn_detector                 ?
_diffrn_detector_area_resol_mean ?
_diffrn_measurement_method       '??integration method??'
_diffrn_measurement_specimen_support ?

_diffrn_reflns_number            4478
_diffrn_reflns_theta_min         2.53
_diffrn_reflns_theta_max         35.69
_diffrn_reflns_theta_full        35.69
_diffrn_measured_fraction_theta_max 1
_diffrn_measured_fraction_theta_full 1
_diffrn_reflns_av_R_equivalents  0.0282
_diffrn_reflns_av_unetI/netI     0.0042
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_l_min       -6
_diffrn_reflns_limit_l_max       6
_diffrn_reflns_reduction_process ?

_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
loop_
_diffrn_standard_refln_index_h
_diffrn_standard_refln_index_k
_diffrn_standard_refln_index_l
? ? ?

_diffrn_radiation_probe          X-ray

#=======================================================================

# 8. REFINEMENT DATA

_refine_special_details          
; ?
;

_reflns_number_total             332
_reflns_number_gt                324
_reflns_threshold_expression     I>3σ(I)

_refine_ls_structure_factor_coef Fsqd
_refine_ls_R_factor_gt           0.0166
_refine_ls_wR_factor_gt          0.0383
_refine_ls_R_factor_all          0.0176
_refine_ls_wR_factor_ref         0.0388
_refine_ls_goodness_of_fit_ref   1.61
_refine_ls_goodness_of_fit_gt    1.62
_refine_ls_restrained_S_gt       ?
_refine_ls_restrained_S_all      ?
_refine_ls_number_reflns         332
_refine_ls_number_parameters     17
_refine_ls_number_restraints     0
_refine_ls_number_constraints    0
_refine_ls_weighting_scheme      sigma
_refine_ls_weighting_details     w=1/(σ²(I)+0.0004I²)
_refine_ls_hydrogen_treatment    ?
_refine_ls_shift/su_max          0.0002
_refine_ls_shift/su_mean         0.0000
_refine_diff_density_max         1.48
_refine_diff_density_min         -2.55
_refine_ls_extinction_method     
'B-C type 1 Lorentzian isotropic (Becker & Coppens, 1974)'
_refine_ls_extinction_coef       890(40)
_refine_ls_abs_structure_details ?
_refine_ls_abs_structure_Flack   ?
_refine_ls_abs_structure_Rogers  ?

loop_
_atom_type_symbol
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Al 0.0645 0.0514 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Pd -0.9988 1.0072 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'
Yb -0.3850 5.5486 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1'

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    ?
_computing_structure_refinement  ?
_computing_molecular_graphics    ?
_computing_publication_material  ?

loop_
_restr_distance_atom_site_label_1
_restr_distance_site_symmetry_1
_restr_distance_atom_site_label_2
_restr_distance_site_symmetry_2
_restr_distance_target
_restr_distance_target_weight_param
? ? ? ? ? ?

loop_
_restr_angle_atom_site_label_1
_restr_angle_site_symmetry_1
_restr_angle_atom_site_label_2
_restr_angle_site_symmetry_2
_restr_angle_atom_site_label_3
_restr_angle_site_symmetry_3
_restr_angle_target
_restr_angle_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_torsion_atom_site_label_1
_restr_torsion_site_symmetry_1
_restr_torsion_atom_site_label_2
_restr_torsion_site_symmetry_2
_restr_torsion_atom_site_label_3
_restr_torsion_site_symmetry_3
_restr_torsion_atom_site_label_4
_restr_torsion_site_symmetry_4
_restr_torsion_angle_target
_restr_torsion_weight_param
? ? ? ? ? ? ? ? ? ?

loop_
_restr_equal_distance_atom_site_label_1
_restr_equal_distance_site_symmetry_1
_restr_equal_distance_atom_site_label_2
_restr_equal_distance_site_symmetry_2
_restr_equal_distance_class_class_id
_restr_equal_distance_class_target_weight_param
? ? ? ? ? ?

loop_
_restr_equal_angle_atom_site_label_1
_restr_equal_angle_site_symmetry_1
_restr_equal_angle_atom_site_label_2
_restr_equal_angle_site_symmetry_2
_restr_equal_angle_atom_site_label_3
_restr_equal_angle_site_symmetry_3
_restr_equal_angle_class_class_id
_restr_equal_angle_class_target_weight_param
? ? ? ? ? ? ? ?

loop_
_restr_equal_torsion_atom_site_label_1
_restr_equal_torsion_site_symmetry_1
_restr_equal_torsion_atom_site_label_2
_restr_equal_torsion_site_symmetry_2
_restr_equal_torsion_atom_site_label_3
_restr_equal_torsion_site_symmetry_3
_restr_equal_torsion_atom_site_label_4
_restr_equal_torsion_site_symmetry_4
_restr_equal_torsion_class_class_id
_restr_equal_torsion_class_target_weight_param
? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 9. ATOMIC COORDINATES AND DISPLACEMENT PARAMETERS

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_adp_type
_atom_site_U_iso_or_equiv
_atom_site_site_symmetry_multiplicity
_atom_site_occupancy
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Yb1 Yb 0.333333 0.666667 0.5 Uani 0.01574(8) 2 1 d . . .
Yb2 Yb 0 0 0 Uani 0.01849(11) 1 1 d . . .
Pd Pd 0.185995(19) 0.37199(4) 0 Uani 0.01457(10) 6 1 d . . .
Al1 Al 0.30440(15) 0 0.5 Uani 0.0161(3) 6 1 d . . .
Al2 Al 0.5 0 0 Uani 0.0160(5) 3 1 d . . .


loop_
_jana_atom_site_ADP_C_label
_jana_atom_site_ADP_C_type_symbol
_jana_atom_site_ADP_C_111
_jana_atom_site_ADP_C_112
_jana_atom_site_ADP_C_113
_jana_atom_site_ADP_C_122
_jana_atom_site_ADP_C_123
_jana_atom_site_ADP_C_133
_jana_atom_site_ADP_C_222
_jana_atom_site_ADP_C_223
_jana_atom_site_ADP_C_233
_jana_atom_site_ADP_C_333
? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_D_label
_jana_atom_site_ADP_D_type_symbol
_jana_atom_site_ADP_D_1111
_jana_atom_site_ADP_D_1112
_jana_atom_site_ADP_D_1113
_jana_atom_site_ADP_D_1122
_jana_atom_site_ADP_D_1123
_jana_atom_site_ADP_D_1133
_jana_atom_site_ADP_D_1222
_jana_atom_site_ADP_D_1223
_jana_atom_site_ADP_D_1233
_jana_atom_site_ADP_D_1333
_jana_atom_site_ADP_D_2222
_jana_atom_site_ADP_D_2223
_jana_atom_site_ADP_D_2233
_jana_atom_site_ADP_D_2333
_jana_atom_site_ADP_D_3333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_E_label
_jana_atom_site_ADP_E_type_symbol
_jana_atom_site_ADP_E_11111
_jana_atom_site_ADP_E_11112
_jana_atom_site_ADP_E_11113
_jana_atom_site_ADP_E_11122
_jana_atom_site_ADP_E_11123
_jana_atom_site_ADP_E_11133
_jana_atom_site_ADP_E_11222
_jana_atom_site_ADP_E_11223
_jana_atom_site_ADP_E_11233
_jana_atom_site_ADP_E_11333
_jana_atom_site_ADP_E_12222
_jana_atom_site_ADP_E_12223
_jana_atom_site_ADP_E_12233
_jana_atom_site_ADP_E_12333
_jana_atom_site_ADP_E_13333
_jana_atom_site_ADP_E_22222
_jana_atom_site_ADP_E_22223
_jana_atom_site_ADP_E_22233
_jana_atom_site_ADP_E_22333
_jana_atom_site_ADP_E_23333
_jana_atom_site_ADP_E_33333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?

loop_
_jana_atom_site_ADP_F_label
_jana_atom_site_ADP_F_type_symbol
_jana_atom_site_ADP_F_111111
_jana_atom_site_ADP_F_111112
_jana_atom_site_ADP_F_111113
_jana_atom_site_ADP_F_111122
_jana_atom_site_ADP_F_111123
_jana_atom_site_ADP_F_111133
_jana_atom_site_ADP_F_111222
_jana_atom_site_ADP_F_111223
_jana_atom_site_ADP_F_111233
_jana_atom_site_ADP_F_111333
_jana_atom_site_ADP_F_112222
_jana_atom_site_ADP_F_112223
_jana_atom_site_ADP_F_112233
_jana_atom_site_ADP_F_112333
_jana_atom_site_ADP_F_113333
_jana_atom_site_ADP_F_122222
_jana_atom_site_ADP_F_122223
_jana_atom_site_ADP_F_122233
_jana_atom_site_ADP_F_122333
_jana_atom_site_ADP_F_123333
_jana_atom_site_ADP_F_133333
_jana_atom_site_ADP_F_222222
_jana_atom_site_ADP_F_222223
_jana_atom_site_ADP_F_222233
_jana_atom_site_ADP_F_222333
_jana_atom_site_ADP_F_223333
_jana_atom_site_ADP_F_233333
_jana_atom_site_ADP_F_333333
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?


#=======================================================================

# 10. MOLECULAR GEOMETRY


loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Yb1 Pd . . 3.1687(5) ?
Yb1 Pd . 1_556 3.1687(5) ?
Yb1 Pd . 2_665 3.1687(5) ?
Yb1 Pd . 2_666 3.1687(5) ?
Yb1 Pd . 3_565 3.1687(4) ?
Yb1 Pd . 3_566 3.1687(4) ?
Yb1 Al1 . 1_565 3.2414(9) ?
Yb1 Al1 . 2_555 3.2414(11) ?
Yb1 Al1 . 3_665 3.2414(16) ?
Yb1 Al1 . 4_665 3.2414(11) ?
Yb1 Al1 . 5_565 3.2414(9) ?
Yb1 Al1 . 6_555 3.2414(16) ?
Yb1 Al2 . 1_565 3.4079(5) ?
Yb1 Al2 . 1_566 3.4079(5) ?
Yb1 Al2 . 2_555 3.4079(5) ?
Yb1 Al2 . 2_556 3.4079(5) ?
Yb1 Al2 . 3_665 3.4079(2) ?
Yb1 Al2 . 3_666 3.4079(2) ?
Yb2 Pd . . 2.9946(7) ?
Yb2 Pd . 2_555 2.9946(7) ?
Yb2 Pd . 3_555 2.9946(4) ?
Yb2 Pd . 4_555 2.9946(7) ?
Yb2 Pd . 5_555 2.9946(7) ?
Yb2 Pd . 6_555 2.9946(4) ?
Yb2 Al1 . 1_554 3.5242(11) ?
Yb2 Al1 . . 3.5242(11) ?
Yb2 Al1 . 2_554 3.5242(11) ?
Yb2 Al1 . 2_555 3.5242(11) ?
Yb2 Al1 . 3_554 3.5242(9) ?
Yb2 Al1 . 3_555 3.5242(9) ?
Yb2 Al1 . 4_554 3.5242(11) ?
Yb2 Al1 . 4_555 3.5242(11) ?
Yb2 Al1 . 5_554 3.5242(11) ?
Yb2 Al1 . 5_555 3.5242(11) ?
Yb2 Al1 . 6_554 3.5242(9) ?
Yb2 Al1 . 6_555 3.5242(9) ?
Pd Pd . 5_555 2.9946(6) ?
Pd Pd . 6_555 2.9946(7) ?
Pd Al1 . 2_554 2.5906(3) ?
Pd Al1 . 2_555 2.5906(3) ?
Pd Al1 . 6_554 2.5906(10) ?
Pd Al1 . 6_555 2.5906(10) ?
Pd Al2 . 2_555 2.5421(4) ?
Pd Al2 . 3_665 2.5421(5) ?
Al1 Al1 . 4_655 3.636(2) ?
Al1 Al1 . 5_555 2.8296(11) ?
Al1 Al1 . 6_555 2.8296(17) ?
Al1 Al2 . . 2.7783(9) ?
Al1 Al2 . 1_556 2.7783(9) ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
Pd Yb1 Pd . . 1_556 83.055(9) ?
Pd Yb1 Pd . . 2_665 80.833(9) ?
Pd Yb1 Pd . . 2_666 136.036(10) ?
Pd Yb1 Pd . . 3_565 80.833(8) ?
Pd Yb1 Pd . . 3_566 136.036(8) ?
Pd Yb1 Al1 . . 1_565 128.299(13) ?
Pd Yb1 Al1 . . 2_555 47.658(10) ?
Pd Yb1 Al1 . . 3_665 93.083(17) ?
Pd Yb1 Al1 . . 4_665 128.299(12) ?
Pd Yb1 Al1 . . 5_565 93.083(16) ?
Pd Yb1 Al1 . . 6_555 47.658(12) ?
Pd Yb1 Al2 . . 1_565 100.415(8) ?
Pd Yb1 Al2 . . 1_566 176.529(4) ?
Pd Yb1 Al2 . . 2_555 45.297(6) ?
Pd Yb1 Al2 . . 2_556 96.543(7) ?
Pd Yb1 Al2 . . 3_665 45.297(6) ?
Pd Yb1 Al2 . . 3_666 96.543(8) ?
Pd Yb1 Pd 1_556 . 2_665 136.036(10) ?
Pd Yb1 Pd 1_556 . 2_666 80.833(9) ?
Pd Yb1 Pd 1_556 . 3_565 136.036(8) ?
Pd Yb1 Pd 1_556 . 3_566 80.833(8) ?
Pd Yb1 Al1 1_556 . 1_565 128.299(13) ?
Pd Yb1 Al1 1_556 . 2_555 47.658(10) ?
Pd Yb1 Al1 1_556 . 3_665 93.083(17) ?
Pd Yb1 Al1 1_556 . 4_665 128.299(12) ?
Pd Yb1 Al1 1_556 . 5_565 93.083(16) ?
Pd Yb1 Al1 1_556 . 6_555 47.658(12) ?
Pd Yb1 Al2 1_556 . 1_565 176.529(4) ?
Pd Yb1 Al2 1_556 . 1_566 100.415(8) ?
Pd Yb1 Al2 1_556 . 2_555 96.543(7) ?
Pd Yb1 Al2 1_556 . 2_556 45.297(6) ?
Pd Yb1 Al2 1_556 . 3_665 96.543(8) ?
Pd Yb1 Al2 1_556 . 3_666 45.297(6) ?
Pd Yb1 Pd 2_665 . 2_666 83.055(9) ?
Pd Yb1 Pd 2_665 . 3_565 80.833(10) ?
Pd Yb1 Pd 2_665 . 3_566 136.036(9) ?
Pd Yb1 Al1 2_665 . 1_565 93.083(17) ?
Pd Yb1 Al1 2_665 . 2_555 128.299(12) ?
Pd Yb1 Al1 2_665 . 3_665 47.658(12) ?
Pd Yb1 Al1 2_665 . 4_665 47.658(11) ?
Pd Yb1 Al1 2_665 . 5_565 128.299(13) ?
Pd Yb1 Al1 2_665 . 6_555 93.083(18) ?
Pd Yb1 Al2 2_665 . 1_565 45.297(8) ?
Pd Yb1 Al2 2_665 . 1_566 96.543(8) ?
Pd Yb1 Al2 2_665 . 2_555 100.415(8) ?
Pd Yb1 Al2 2_665 . 2_556 176.529(4) ?
Pd Yb1 Al2 2_665 . 3_665 45.297(9) ?
Pd Yb1 Al2 2_665 . 3_666 96.543(9) ?
Pd Yb1 Pd 2_666 . 3_565 136.036(9) ?
Pd Yb1 Pd 2_666 . 3_566 80.833(10) ?
Pd Yb1 Al1 2_666 . 1_565 93.083(17) ?
Pd Yb1 Al1 2_666 . 2_555 128.299(12) ?
Pd Yb1 Al1 2_666 . 3_665 47.658(12) ?
Pd Yb1 Al1 2_666 . 4_665 47.658(11) ?
Pd Yb1 Al1 2_666 . 5_565 128.299(13) ?
Pd Yb1 Al1 2_666 . 6_555 93.083(18) ?
Pd Yb1 Al2 2_666 . 1_565 96.543(8) ?
Pd Yb1 Al2 2_666 . 1_566 45.297(8) ?
Pd Yb1 Al2 2_666 . 2_555 176.529(4) ?
Pd Yb1 Al2 2_666 . 2_556 100.415(8) ?
Pd Yb1 Al2 2_666 . 3_665 96.543(9) ?
Pd Yb1 Al2 2_666 . 3_666 45.297(9) ?
Pd Yb1 Pd 3_565 . 3_566 83.055(8) ?
Pd Yb1 Al1 3_565 . 1_565 47.658(9) ?
Pd Yb1 Al1 3_565 . 2_555 93.083(16) ?
Pd Yb1 Al1 3_565 . 3_665 128.299(13) ?
Pd Yb1 Al1 3_565 . 4_665 93.083(16) ?
Pd Yb1 Al1 3_565 . 5_565 47.658(11) ?
Pd Yb1 Al1 3_565 . 6_555 128.299(12) ?
Pd Yb1 Al2 3_565 . 1_565 45.297(7) ?
Pd Yb1 Al2 3_565 . 1_566 96.543(6) ?
Pd Yb1 Al2 3_565 . 2_555 45.297(6) ?
Pd Yb1 Al2 3_565 . 2_556 96.543(8) ?
Pd Yb1 Al2 3_565 . 3_665 100.415(6) ?
Pd Yb1 Al2 3_565 . 3_666 176.529(4) ?
Pd Yb1 Al1 3_566 . 1_565 47.658(9) ?
Pd Yb1 Al1 3_566 . 2_555 93.083(16) ?
Pd Yb1 Al1 3_566 . 3_665 128.299(13) ?
Pd Yb1 Al1 3_566 . 4_665 93.083(16) ?
Pd Yb1 Al1 3_566 . 5_565 47.658(11) ?
Pd Yb1 Al1 3_566 . 6_555 128.299(12) ?
Pd Yb1 Al2 3_566 . 1_565 96.543(6) ?
Pd Yb1 Al2 3_566 . 1_566 45.297(7) ?
Pd Yb1 Al2 3_566 . 2_555 96.543(8) ?
Pd Yb1 Al2 3_566 . 2_556 45.297(6) ?
Pd Yb1 Al2 3_566 . 3_665 176.529(4) ?
Pd Yb1 Al2 3_566 . 3_666 100.415(6) ?
Al1 Yb1 Al1 1_565 . 2_555 120.00(3) ?
Al1 Yb1 Al1 1_565 . 3_665 120.00(3) ?
Al1 Yb1 Al1 1_565 . 4_665 68.24(3) ?
Al1 Yb1 Al1 1_565 . 5_565 51.76(3) ?
Al1 Yb1 Al1 1_565 . 6_555 171.76(3) ?
Al1 Yb1 Al2 1_565 . 1_565 49.318(12) ?
Al1 Yb1 Al2 1_565 . 1_566 49.318(12) ?
Al1 Yb1 Al2 1_565 . 2_555 86.757(16) ?
Al1 Yb1 Al2 1_565 . 2_556 86.757(16) ?
Al1 Yb1 Al2 1_565 . 3_665 135.108(10) ?
Al1 Yb1 Al2 1_565 . 3_666 135.108(10) ?
Al1 Yb1 Al1 2_555 . 3_665 120.00(3) ?
Al1 Yb1 Al1 2_555 . 4_665 171.76(3) ?
Al1 Yb1 Al1 2_555 . 5_565 68.24(3) ?
Al1 Yb1 Al1 2_555 . 6_555 51.76(3) ?
Al1 Yb1 Al2 2_555 . 1_565 135.108(10) ?
Al1 Yb1 Al2 2_555 . 1_566 135.108(10) ?
Al1 Yb1 Al2 2_555 . 2_555 49.318(12) ?
Al1 Yb1 Al2 2_555 . 2_556 49.318(12) ?
Al1 Yb1 Al2 2_555 . 3_665 86.757(17) ?
Al1 Yb1 Al2 2_555 . 3_666 86.757(17) ?
Al1 Yb1 Al1 3_665 . 4_665 51.76(3) ?
Al1 Yb1 Al1 3_665 . 5_565 171.76(3) ?
Al1 Yb1 Al1 3_665 . 6_555 68.24(3) ?
Al1 Yb1 Al2 3_665 . 1_565 86.757(18) ?
Al1 Yb1 Al2 3_665 . 1_566 86.757(18) ?
Al1 Yb1 Al2 3_665 . 2_555 135.107(11) ?
Al1 Yb1 Al2 3_665 . 2_556 135.107(11) ?
Al1 Yb1 Al2 3_665 . 3_665 49.318(13) ?
Al1 Yb1 Al2 3_665 . 3_666 49.318(13) ?
Al1 Yb1 Al1 4_665 . 5_565 120.00(3) ?
Al1 Yb1 Al1 4_665 . 6_555 120.00(3) ?
Al1 Yb1 Al2 4_665 . 1_565 49.318(12) ?
Al1 Yb1 Al2 4_665 . 1_566 49.318(12) ?
Al1 Yb1 Al2 4_665 . 2_555 135.108(10) ?
Al1 Yb1 Al2 4_665 . 2_556 135.108(10) ?
Al1 Yb1 Al2 4_665 . 3_665 86.757(17) ?
Al1 Yb1 Al2 4_665 . 3_666 86.757(17) ?
Al1 Yb1 Al1 5_565 . 6_555 120.00(3) ?
Al1 Yb1 Al2 5_565 . 1_565 86.757(16) ?
Al1 Yb1 Al2 5_565 . 1_566 86.757(16) ?
Al1 Yb1 Al2 5_565 . 2_555 49.318(12) ?
Al1 Yb1 Al2 5_565 . 2_556 49.318(12) ?
Al1 Yb1 Al2 5_565 . 3_665 135.108(10) ?
Al1 Yb1 Al2 5_565 . 3_666 135.108(10) ?
Al1 Yb1 Al2 6_555 . 1_565 135.107(11) ?
Al1 Yb1 Al2 6_555 . 1_566 135.107(11) ?
Al1 Yb1 Al2 6_555 . 2_555 86.757(18) ?
Al1 Yb1 Al2 6_555 . 2_556 86.757(18) ?
Al1 Yb1 Al2 6_555 . 3_665 49.318(13) ?
Al1 Yb1 Al2 6_555 . 3_666 49.318(13) ?
Al2 Yb1 Al2 1_565 . 1_566 76.114(7) ?
Al2 Yb1 Al2 1_565 . 2_555 85.986(7) ?
Al2 Yb1 Al2 1_565 . 2_556 133.630(3) ?
Al2 Yb1 Al2 1_565 . 3_665 85.986(5) ?
Al2 Yb1 Al2 1_565 . 3_666 133.630(5) ?
Al2 Yb1 Al2 1_566 . 2_555 133.630(3) ?
Al2 Yb1 Al2 1_566 . 2_556 85.986(7) ?
Al2 Yb1 Al2 1_566 . 3_665 133.630(5) ?
Al2 Yb1 Al2 1_566 . 3_666 85.986(5) ?
Al2 Yb1 Al2 2_555 . 2_556 76.114(7) ?
Al2 Yb1 Al2 2_555 . 3_665 85.986(5) ?
Al2 Yb1 Al2 2_555 . 3_666 133.630(5) ?
Al2 Yb1 Al2 2_556 . 3_665 133.630(5) ?
Al2 Yb1 Al2 2_556 . 3_666 85.986(5) ?
Al2 Yb1 Al2 3_665 . 3_666 76.114(4) ?
Pd Yb2 Pd . . 2_555 120.000(11) ?
Pd Yb2 Pd . . 3_555 120.000(9) ?
Pd Yb2 Pd . . 4_555 180.0(5) ?
Pd Yb2 Pd . . 5_555 60.000(11) ?
Pd Yb2 Pd . . 6_555 60.000(9) ?
Pd Yb2 Al1 . . 1_554 90.000(6) ?
Pd Yb2 Al1 . . . 90.000(6) ?
Pd Yb2 Al1 . . 2_554 45.946(10) ?
Pd Yb2 Al1 . . 2_555 45.946(10) ?
Pd Yb2 Al1 . . 3_554 134.05(2) ?
Pd Yb2 Al1 . . 3_555 134.05(2) ?
Pd Yb2 Al1 . . 4_554 90.000(6) ?
Pd Yb2 Al1 . . 4_555 90.000(6) ?
Pd Yb2 Al1 . . 5_554 134.054(10) ?
Pd Yb2 Al1 . . 5_555 134.054(10) ?
Pd Yb2 Al1 . . 6_554 45.95(2) ?
Pd Yb2 Al1 . . 6_555 45.95(2) ?
Pd Yb2 Pd 2_555 . 3_555 120.000(11) ?
Pd Yb2 Pd 2_555 . 4_555 60.000(11) ?
Pd Yb2 Pd 2_555 . 5_555 180.0(5) ?
Pd Yb2 Pd 2_555 . 6_555 60.000(11) ?
Pd Yb2 Al1 2_555 . 1_554 134.054(11) ?
Pd Yb2 Al1 2_555 . . 134.054(11) ?
Pd Yb2 Al1 2_555 . 2_554 90.000(8) ?
Pd Yb2 Al1 2_555 . 2_555 90.000(8) ?
Pd Yb2 Al1 2_555 . 3_554 45.95(2) ?
Pd Yb2 Al1 2_555 . 3_555 45.95(2) ?
Pd Yb2 Al1 2_555 . 4_554 45.946(11) ?
Pd Yb2 Al1 2_555 . 4_555 45.946(11) ?
Pd Yb2 Al1 2_555 . 5_554 90.000(8) ?
Pd Yb2 Al1 2_555 . 5_555 90.000(8) ?
Pd Yb2 Al1 2_555 . 6_554 134.05(2) ?
Pd Yb2 Al1 2_555 . 6_555 134.05(2) ?
Pd Yb2 Pd 3_555 . 4_555 60.000(9) ?
Pd Yb2 Pd 3_555 . 5_555 60.000(11) ?
Pd Yb2 Pd 3_555 . 6_555 180.0(5) ?
Pd Yb2 Al1 3_555 . 1_554 45.946(10) ?
Pd Yb2 Al1 3_555 . . 45.946(10) ?
Pd Yb2 Al1 3_555 . 2_554 134.054(10) ?
Pd Yb2 Al1 3_555 . 2_555 134.054(10) ?
Pd Yb2 Al1 3_555 . 3_554 90.00(3) ?
Pd Yb2 Al1 3_555 . 3_555 90.00(3) ?
Pd Yb2 Al1 3_555 . 4_554 134.054(10) ?
Pd Yb2 Al1 3_555 . 4_555 134.054(10) ?
Pd Yb2 Al1 3_555 . 5_554 45.946(10) ?
Pd Yb2 Al1 3_555 . 5_555 45.946(10) ?
Pd Yb2 Al1 3_555 . 6_554 90.00(3) ?
Pd Yb2 Al1 3_555 . 6_555 90.00(3) ?
Pd Yb2 Pd 4_555 . 5_555 120.000(11) ?
Pd Yb2 Pd 4_555 . 6_555 120.000(9) ?
Pd Yb2 Al1 4_555 . 1_554 90.000(6) ?
Pd Yb2 Al1 4_555 . . 90.000(6) ?
Pd Yb2 Al1 4_555 . 2_554 134.054(10) ?
Pd Yb2 Al1 4_555 . 2_555 134.054(10) ?
Pd Yb2 Al1 4_555 . 3_554 45.95(2) ?
Pd Yb2 Al1 4_555 . 3_555 45.95(2) ?
Pd Yb2 Al1 4_555 . 4_554 90.000(6) ?
Pd Yb2 Al1 4_555 . 4_555 90.000(6) ?
Pd Yb2 Al1 4_555 . 5_554 45.946(10) ?
Pd Yb2 Al1 4_555 . 5_555 45.946(10) ?
Pd Yb2 Al1 4_555 . 6_554 134.05(2) ?
Pd Yb2 Al1 4_555 . 6_555 134.05(2) ?
Pd Yb2 Pd 5_555 . 6_555 120.000(11) ?
Pd Yb2 Al1 5_555 . 1_554 45.946(11) ?
Pd Yb2 Al1 5_555 . . 45.946(11) ?
Pd Yb2 Al1 5_555 . 2_554 90.000(8) ?
Pd Yb2 Al1 5_555 . 2_555 90.000(8) ?
Pd Yb2 Al1 5_555 . 3_554 134.05(2) ?
Pd Yb2 Al1 5_555 . 3_555 134.05(2) ?
Pd Yb2 Al1 5_555 . 4_554 134.054(11) ?
Pd Yb2 Al1 5_555 . 4_555 134.054(11) ?
Pd Yb2 Al1 5_555 . 5_554 90.000(8) ?
Pd Yb2 Al1 5_555 . 5_555 90.000(8) ?
Pd Yb2 Al1 5_555 . 6_554 45.95(2) ?
Pd Yb2 Al1 5_555 . 6_555 45.95(2) ?
Pd Yb2 Al1 6_555 . 1_554 134.054(10) ?
Pd Yb2 Al1 6_555 . . 134.054(10) ?
Pd Yb2 Al1 6_555 . 2_554 45.946(10) ?
Pd Yb2 Al1 6_555 . 2_555 45.946(10) ?
Pd Yb2 Al1 6_555 . 3_554 90.00(3) ?
Pd Yb2 Al1 6_555 . 3_555 90.00(3) ?
Pd Yb2 Al1 6_555 . 4_554 45.946(10) ?
Pd Yb2 Al1 6_555 . 4_555 45.946(10) ?
Pd Yb2 Al1 6_555 . 5_554 134.054(10) ?
Pd Yb2 Al1 6_555 . 5_555 134.054(10) ?
Pd Yb2 Al1 6_555 . 6_554 90.00(3) ?
Pd Yb2 Al1 6_555 . 6_555 90.00(3) ?
Al1 Yb2 Al1 1_554 . . 73.183(19) ?
Al1 Yb2 Al1 1_554 . 2_554 88.108(14) ?
Al1 Yb2 Al1 1_554 . 2_555 132.662(8) ?
Al1 Yb2 Al1 1_554 . 3_554 88.11(2) ?
Al1 Yb2 Al1 1_554 . 3_555 132.66(3) ?
Al1 Yb2 Al1 1_554 . 4_554 106.817(19) ?
Al1 Yb2 Al1 1_554 . 4_555 180.0(5) ?
Al1 Yb2 Al1 1_554 . 5_554 47.338(8) ?
Al1 Yb2 Al1 1_554 . 5_555 91.892(14) ?
Al1 Yb2 Al1 1_554 . 6_554 47.34(3) ?
Al1 Yb2 Al1 1_554 . 6_555 91.89(2) ?
Al1 Yb2 Al1 . . 2_554 132.662(8) ?
Al1 Yb2 Al1 . . 2_555 88.108(14) ?
Al1 Yb2 Al1 . . 3_554 132.66(3) ?
Al1 Yb2 Al1 . . 3_555 88.11(2) ?
Al1 Yb2 Al1 . . 4_554 180.0(5) ?
Al1 Yb2 Al1 . . 4_555 106.817(19) ?
Al1 Yb2 Al1 . . 5_554 91.892(14) ?
Al1 Yb2 Al1 . . 5_555 47.338(8) ?
Al1 Yb2 Al1 . . 6_554 91.89(2) ?
Al1 Yb2 Al1 . . 6_555 47.34(3) ?
Al1 Yb2 Al1 2_554 . 2_555 73.183(19) ?
Al1 Yb2 Al1 2_554 . 3_554 88.11(2) ?
Al1 Yb2 Al1 2_554 . 3_555 132.66(3) ?
Al1 Yb2 Al1 2_554 . 4_554 47.338(8) ?
Al1 Yb2 Al1 2_554 . 4_555 91.892(14) ?
Al1 Yb2 Al1 2_554 . 5_554 106.817(19) ?
Al1 Yb2 Al1 2_554 . 5_555 180.0(5) ?
Al1 Yb2 Al1 2_554 . 6_554 47.34(3) ?
Al1 Yb2 Al1 2_554 . 6_555 91.89(2) ?
Al1 Yb2 Al1 2_555 . 3_554 132.66(3) ?
Al1 Yb2 Al1 2_555 . 3_555 88.11(2) ?
Al1 Yb2 Al1 2_555 . 4_554 91.892(14) ?
Al1 Yb2 Al1 2_555 . 4_555 47.338(8) ?
Al1 Yb2 Al1 2_555 . 5_554 180.0(5) ?
Al1 Yb2 Al1 2_555 . 5_555 106.817(19) ?
Al1 Yb2 Al1 2_555 . 6_554 91.89(2) ?
Al1 Yb2 Al1 2_555 . 6_555 47.34(3) ?
Al1 Yb2 Al1 3_554 . 3_555 73.183(15) ?
Al1 Yb2 Al1 3_554 . 4_554 47.34(3) ?
Al1 Yb2 Al1 3_554 . 4_555 91.89(2) ?
Al1 Yb2 Al1 3_554 . 5_554 47.34(3) ?
Al1 Yb2 Al1 3_554 . 5_555 91.89(2) ?
Al1 Yb2 Al1 3_554 . 6_554 106.817(15) ?
Al1 Yb2 Al1 3_554 . 6_555 180.0(5) ?
Al1 Yb2 Al1 3_555 . 4_554 91.89(2) ?
Al1 Yb2 Al1 3_555 . 4_555 47.34(3) ?
Al1 Yb2 Al1 3_555 . 5_554 91.89(2) ?
Al1 Yb2 Al1 3_555 . 5_555 47.34(3) ?
Al1 Yb2 Al1 3_555 . 6_554 180.0(5) ?
Al1 Yb2 Al1 3_555 . 6_555 106.817(15) ?
Al1 Yb2 Al1 4_554 . 4_555 73.183(19) ?
Al1 Yb2 Al1 4_554 . 5_554 88.108(14) ?
Al1 Yb2 Al1 4_554 . 5_555 132.662(8) ?
Al1 Yb2 Al1 4_554 . 6_554 88.11(2) ?
Al1 Yb2 Al1 4_554 . 6_555 132.66(3) ?
Al1 Yb2 Al1 4_555 . 5_554 132.662(8) ?
Al1 Yb2 Al1 4_555 . 5_555 88.108(14) ?
Al1 Yb2 Al1 4_555 . 6_554 132.66(3) ?
Al1 Yb2 Al1 4_555 . 6_555 88.11(2) ?
Al1 Yb2 Al1 5_554 . 5_555 73.183(19) ?
Al1 Yb2 Al1 5_554 . 6_554 88.11(2) ?
Al1 Yb2 Al1 5_554 . 6_555 132.66(3) ?
Al1 Yb2 Al1 5_555 . 6_554 132.66(3) ?
Al1 Yb2 Al1 5_555 . 6_555 88.11(2) ?
Al1 Yb2 Al1 6_554 . 6_555 73.183(15) ?
Yb1 Pd Yb1 1_554 . . 83.055(10) ?
Yb1 Pd Yb2 1_554 . . 138.472(5) ?
Yb1 Pd Pd 1_554 . 5_555 111.982(7) ?
Yb1 Pd Pd 1_554 . 6_555 111.982(9) ?
Yb1 Pd Al1 1_554 . 2_554 67.64(2) ?
Yb1 Pd Al1 1_554 . 2_555 134.02(3) ?
Yb1 Pd Al1 1_554 . 6_554 67.64(3) ?
Yb1 Pd Al1 1_554 . 6_555 134.02(2) ?
Yb1 Pd Al2 1_554 . 2_555 72.333(9) ?
Yb1 Pd Al2 1_554 . 3_665 72.334(6) ?
Yb1 Pd Yb2 . . . 138.472(5) ?
Yb1 Pd Pd . . 5_555 111.982(7) ?
Yb1 Pd Pd . . 6_555 111.982(9) ?
Yb1 Pd Al1 . . 2_554 134.02(3) ?
Yb1 Pd Al1 . . 2_555 67.64(2) ?
Yb1 Pd Al1 . . 6_554 134.02(2) ?
Yb1 Pd Al1 . . 6_555 67.64(3) ?
Yb1 Pd Al2 . . 2_555 72.333(9) ?
Yb1 Pd Al2 . . 3_665 72.334(6) ?
Yb2 Pd Pd . . 5_555 60.000(11) ?
Yb2 Pd Pd . . 6_555 60.000(8) ?
Yb2 Pd Al1 . . 2_554 77.88(3) ?
Yb2 Pd Al1 . . 2_555 77.88(3) ?
Yb2 Pd Al1 . . 6_554 77.88(3) ?
Yb2 Pd Al1 . . 6_555 77.88(3) ?
Yb2 Pd Al2 . . 2_555 113.914(8) ?
Yb2 Pd Al2 . . 3_665 113.914(13) ?
Pd Pd Pd 5_555 . 6_555 120.000(14) ?
Pd Pd Al1 5_555 . 2_554 111.59(3) ?
Pd Pd Al1 5_555 . 2_555 111.59(3) ?
Pd Pd Al1 5_555 . 6_554 54.69(3) ?
Pd Pd Al1 5_555 . 6_555 54.69(3) ?
Pd Pd Al2 5_555 . 2_555 173.914(10) ?
Pd Pd Al2 5_555 . 3_665 53.914(9) ?
Pd Pd Al1 6_555 . 2_554 54.691(5) ?
Pd Pd Al1 6_555 . 2_555 54.691(5) ?
Pd Pd Al1 6_555 . 6_554 111.59(2) ?
Pd Pd Al1 6_555 . 6_555 111.59(2) ?
Pd Pd Al2 6_555 . 2_555 53.914(9) ?
Pd Pd Al2 6_555 . 3_665 173.914(16) ?
Al1 Pd Al1 2_554 . 2_555 108.376(11) ?
Al1 Pd Al1 2_554 . 6_554 66.20(3) ?
Al1 Pd Al1 2_554 . 6_555 155.75(4) ?
Al1 Pd Al2 2_554 . 2_555 65.54(3) ?
Al1 Pd Al2 2_554 . 3_665 125.760(5) ?
Al1 Pd Al1 2_555 . 6_554 155.75(4) ?
Al1 Pd Al1 2_555 . 6_555 66.20(3) ?
Al1 Pd Al2 2_555 . 2_555 65.54(3) ?
Al1 Pd Al2 2_555 . 3_665 125.760(5) ?
Al1 Pd Al1 6_554 . 6_555 108.38(4) ?
Al1 Pd Al2 6_554 . 2_555 125.76(3) ?
Al1 Pd Al2 6_554 . 3_665 65.54(2) ?
Al1 Pd Al2 6_555 . 2_555 125.76(3) ?
Al1 Pd Al2 6_555 . 3_665 65.54(2) ?
Al2 Pd Al2 2_555 . 3_665 132.171(14) ?
Yb1 Al1 Yb1 1_545 . 4_665 111.76(4) ?
Yb1 Al1 Yb2 1_545 . . 116.768(10) ?
Yb1 Al1 Yb2 1_545 . 1_556 116.768(10) ?
Yb1 Al1 Pd 1_545 . 3_555 64.701(14) ?
Yb1 Al1 Pd 1_545 . 3_556 64.701(14) ?
Yb1 Al1 Pd 1_545 . 5_555 121.98(3) ?
Yb1 Al1 Pd 1_545 . 5_556 121.98(3) ?
Yb1 Al1 Al1 1_545 . 4_655 55.88(2) ?
Yb1 Al1 Al1 1_545 . 5_555 64.12(2) ?
Yb1 Al1 Al1 1_545 . 6_555 175.88(5) ?
Yb1 Al1 Al2 1_545 . . 68.46(2) ?
Yb1 Al1 Al2 1_545 . 1_556 68.46(2) ?
Yb1 Al1 Yb2 4_665 . . 116.768(11) ?
Yb1 Al1 Yb2 4_665 . 1_556 116.768(11) ?
Yb1 Al1 Pd 4_665 . 3_555 121.98(2) ?
Yb1 Al1 Pd 4_665 . 3_556 121.98(2) ?
Yb1 Al1 Pd 4_665 . 5_555 64.701(13) ?
Yb1 Al1 Pd 4_665 . 5_556 64.701(13) ?
Yb1 Al1 Al1 4_665 . 4_655 55.88(2) ?
Yb1 Al1 Al1 4_665 . 5_555 175.88(5) ?
Yb1 Al1 Al1 4_665 . 6_555 64.12(2) ?
Yb1 Al1 Al2 4_665 . . 68.46(2) ?
Yb1 Al1 Al2 4_665 . 1_556 68.46(2) ?
Yb2 Al1 Yb2 . . 1_556 73.18(3) ?
Yb2 Al1 Pd . . 3_555 56.18(2) ?
Yb2 Al1 Pd . . 3_556 114.22(4) ?
Yb2 Al1 Pd . . 5_555 56.18(2) ?
Yb2 Al1 Pd . . 5_556 114.22(4) ?
Yb2 Al1 Al1 . . 4_655 143.409(13) ?
Yb2 Al1 Al1 . . 5_555 66.33(3) ?
Yb2 Al1 Al1 . . 6_555 66.33(3) ?
Yb2 Al1 Al2 . . . 94.284(10) ?
Yb2 Al1 Al2 . . 1_556 167.47(3) ?
Yb2 Al1 Pd 1_556 . 3_555 114.22(4) ?
Yb2 Al1 Pd 1_556 . 3_556 56.18(2) ?
Yb2 Al1 Pd 1_556 . 5_555 114.22(4) ?
Yb2 Al1 Pd 1_556 . 5_556 56.18(2) ?
Yb2 Al1 Al1 1_556 . 4_655 143.409(13) ?
Yb2 Al1 Al1 1_556 . 5_555 66.33(3) ?
Yb2 Al1 Al1 1_556 . 6_555 66.33(3) ?
Yb2 Al1 Al2 1_556 . . 167.47(3) ?
Yb2 Al1 Al2 1_556 . 1_556 94.284(10) ?
Pd Al1 Pd 3_555 . 3_556 108.376(11) ?
Pd Al1 Pd 3_555 . 5_555 70.617(10) ?
Pd Al1 Pd 3_555 . 5_556 169.54(6) ?
Pd Al1 Al1 3_555 . 4_655 95.23(3) ?
Pd Al1 Al1 3_555 . 5_555 56.898(13) ?
Pd Al1 Al1 3_555 . 6_555 117.06(3) ?
Pd Al1 Al2 3_555 . . 56.392(14) ?
Pd Al1 Al2 3_555 . 1_556 132.29(4) ?
Pd Al1 Pd 3_556 . 5_555 169.54(6) ?
Pd Al1 Pd 3_556 . 5_556 70.617(10) ?
Pd Al1 Al1 3_556 . 4_655 95.23(3) ?
Pd Al1 Al1 3_556 . 5_555 56.898(13) ?
Pd Al1 Al1 3_556 . 6_555 117.06(3) ?
Pd Al1 Al2 3_556 . . 132.29(4) ?
Pd Al1 Al2 3_556 . 1_556 56.392(14) ?
Pd Al1 Pd 5_555 . 5_556 108.376(14) ?
Pd Al1 Al1 5_555 . 4_655 95.23(3) ?
Pd Al1 Al1 5_555 . 5_555 117.06(3) ?
Pd Al1 Al1 5_555 . 6_555 56.898(15) ?
Pd Al1 Al2 5_555 . . 56.392(14) ?
Pd Al1 Al2 5_555 . 1_556 132.29(4) ?
Pd Al1 Al1 5_556 . 4_655 95.23(3) ?
Pd Al1 Al1 5_556 . 5_555 117.06(3) ?
Pd Al1 Al1 5_556 . 6_555 56.898(15) ?
Pd Al1 Al2 5_556 . . 132.29(4) ?
Pd Al1 Al2 5_556 . 1_556 56.392(14) ?
Al1 Al1 Al1 4_655 . 5_555 120.00(3) ?
Al1 Al1 Al1 4_655 . 6_555 120.00(3) ?
Al1 Al1 Al2 4_655 . . 49.12(2) ?
Al1 Al1 Al2 4_655 . 1_556 49.12(2) ?
Al1 Al1 Al1 5_555 . 6_555 120.00(6) ?
Al1 Al1 Al2 5_555 . . 109.099(16) ?
Al1 Al1 Al2 5_555 . 1_556 109.099(16) ?
Al1 Al1 Al2 6_555 . . 109.099(16) ?
Al1 Al1 Al2 6_555 . 1_556 109.099(16) ?
Al2 Al1 Al2 . . 1_556 98.25(4) ?
Yb1 Al2 Yb1 1_544 . 1_545 76.114(7) ?
Yb1 Al2 Yb1 1_544 . 4_664 103.886(7) ?
Yb1 Al2 Yb1 1_544 . 4_665 180.0(5) ?
Yb1 Al2 Pd 1_544 . 2_655 62.369(6) ?
Yb1 Al2 Pd 1_544 . 3_555 62.369(7) ?
Yb1 Al2 Pd 1_544 . 5_555 117.631(6) ?
Yb1 Al2 Pd 1_544 . 6_655 117.631(7) ?
Yb1 Al2 Al1 1_544 . 1_554 62.218(10) ?
Yb1 Al2 Al1 1_544 . . 117.782(11) ?
Yb1 Al2 Al1 1_544 . 4_654 62.218(11) ?
Yb1 Al2 Al1 1_544 . 4_655 117.782(10) ?
Yb1 Al2 Yb1 1_545 . 4_664 180.0(5) ?
Yb1 Al2 Yb1 1_545 . 4_665 103.886(7) ?
Yb1 Al2 Pd 1_545 . 2_655 62.369(6) ?
Yb1 Al2 Pd 1_545 . 3_555 62.369(7) ?
Yb1 Al2 Pd 1_545 . 5_555 117.631(6) ?
Yb1 Al2 Pd 1_545 . 6_655 117.631(7) ?
Yb1 Al2 Al1 1_545 . 1_554 117.782(11) ?
Yb1 Al2 Al1 1_545 . . 62.218(10) ?
Yb1 Al2 Al1 1_545 . 4_654 117.782(10) ?
Yb1 Al2 Al1 1_545 . 4_655 62.218(11) ?
Yb1 Al2 Yb1 4_664 . 4_665 76.114(7) ?
Yb1 Al2 Pd 4_664 . 2_655 117.631(6) ?
Yb1 Al2 Pd 4_664 . 3_555 117.631(7) ?
Yb1 Al2 Pd 4_664 . 5_555 62.369(6) ?
Yb1 Al2 Pd 4_664 . 6_655 62.369(7) ?
Yb1 Al2 Al1 4_664 . 1_554 62.218(11) ?
Yb1 Al2 Al1 4_664 . . 117.782(10) ?
Yb1 Al2 Al1 4_664 . 4_654 62.218(10) ?
Yb1 Al2 Al1 4_664 . 4_655 117.782(11) ?
Yb1 Al2 Pd 4_665 . 2_655 117.631(6) ?
Yb1 Al2 Pd 4_665 . 3_555 117.631(7) ?
Yb1 Al2 Pd 4_665 . 5_555 62.369(6) ?
Yb1 Al2 Pd 4_665 . 6_655 62.369(7) ?
Yb1 Al2 Al1 4_665 . 1_554 117.782(10) ?
Yb1 Al2 Al1 4_665 . . 62.218(11) ?
Yb1 Al2 Al1 4_665 . 4_654 117.782(11) ?
Yb1 Al2 Al1 4_665 . 4_655 62.218(10) ?
Pd Al2 Pd 2_655 . 3_555 107.829(11) ?
Pd Al2 Pd 2_655 . 5_555 180.0(5) ?
Pd Al2 Pd 2_655 . 6_655 72.171(11) ?
Pd Al2 Al1 2_655 . 1_554 121.928(16) ?
Pd Al2 Al1 2_655 . . 121.928(16) ?
Pd Al2 Al1 2_655 . 4_654 58.072(16) ?
Pd Al2 Al1 2_655 . 4_655 58.072(16) ?
Pd Al2 Pd 3_555 . 5_555 72.171(11) ?
Pd Al2 Pd 3_555 . 6_655 180.0(5) ?
Pd Al2 Al1 3_555 . 1_554 58.072(16) ?
Pd Al2 Al1 3_555 . . 58.072(16) ?
Pd Al2 Al1 3_555 . 4_654 121.928(16) ?
Pd Al2 Al1 3_555 . 4_655 121.928(16) ?
Pd Al2 Pd 5_555 . 6_655 107.829(11) ?
Pd Al2 Al1 5_555 . 1_554 58.072(16) ?
Pd Al2 Al1 5_555 . . 58.072(16) ?
Pd Al2 Al1 5_555 . 4_654 121.928(16) ?
Pd Al2 Al1 5_555 . 4_655 121.928(16) ?
Pd Al2 Al1 6_655 . 1_554 121.928(16) ?
Pd Al2 Al1 6_655 . . 121.928(16) ?
Pd Al2 Al1 6_655 . 4_654 58.072(16) ?
Pd Al2 Al1 6_655 . 4_655 58.072(16) ?
Al1 Al2 Al1 1_554 . . 98.25(3) ?
Al1 Al2 Al1 1_554 . 4_654 81.75(3) ?
Al1 Al2 Al1 1_554 . 4_655 180.0(5) ?
Al1 Al2 Al1 . . 4_654 180.0(5) ?
Al1 Al2 Al1 . . 4_655 81.75(3) ?
Al1 Al2 Al1 4_654 . 4_655 98.25(3) ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion
_geom_torsion_publ_flag
? ? ? ? ? ? ? ? ? ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_D
_geom_hbond_site_symmetry_H
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_publ_flag
? ? ? ? ? ? ? ? ? ? ?


