# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2023

####################################################################### 
# 
# 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. 
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data_a
_database_code_depnum_ccdc_archive 'CCDC 2205343'
loop_
_audit_author_name
_audit_author_address
'Dayu dyhuang' 'Changchun Institute of Applied Chemistry'
_audit_update_record             
;
2022-09-04 deposited with the CCDC.	2023-03-21 downloaded from the CCDC.
;
_audit_creation_date             2022-09-04
_audit_creation_method           
;
Olex2 1.2
(compiled 2017.08.10 svn.r3458 for OlexSys, GUI svn.r5381)
;
_shelx_SHELXL_version_number     2016/4
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         '0.17(Cd5.7 Cl36 Rb24)'
_chemical_formula_sum            'Cd0.95 Cl5.99 Rb3.99'
_chemical_formula_weight         660.04
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Cd Cd -0.8075 1.2024 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Rb Rb -0.9393 2.9676 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      trigonal
_space_group_IT_number           167
_space_group_name_H-M_alt        'R -3 c'
_space_group_name_Hall           '-R 3 2"c'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'y, x, -z+1/2'
'x-y, -y, -z+1/2'
'-x, -x+y, -z+1/2'
'x+2/3, y+1/3, z+1/3'
'-y+2/3, x-y+1/3, z+1/3'
'-x+y+2/3, -x+1/3, z+1/3'
'y+2/3, x+1/3, -z+5/6'
'x-y+2/3, -y+1/3, -z+5/6'
'-x+2/3, -x+y+1/3, -z+5/6'
'x+1/3, y+2/3, z+2/3'
'-y+1/3, x-y+2/3, z+2/3'
'-x+y+1/3, -x+2/3, z+2/3'
'y+1/3, x+2/3, -z+7/6'
'x-y+1/3, -y+2/3, -z+7/6'
'-x+1/3, -x+y+2/3, -z+7/6'
'-x, -y, -z'
'y, -x+y, -z'
'x-y, x, -z'
'-y, -x, z-1/2'
'-x+y, y, z-1/2'
'x, x-y, z-1/2'
'-x+2/3, -y+1/3, -z+1/3'
'y+2/3, -x+y+1/3, -z+1/3'
'x-y+2/3, x+1/3, -z+1/3'
'-y+2/3, -x+1/3, z-1/6'
'-x+y+2/3, y+1/3, z-1/6'
'x+2/3, x-y+1/3, z-1/6'
'-x+1/3, -y+2/3, -z+2/3'
'y+1/3, -x+y+2/3, -z+2/3'
'x-y+1/3, x+2/3, -z+2/3'
'-y+1/3, -x+2/3, z+1/6'
'-x+y+1/3, y+2/3, z+1/6'
'x+1/3, x-y+2/3, z+1/6'

_cell_length_a                   12.4538(4)
_cell_length_b                   12.4538(4)
_cell_length_c                   15.6023(7)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_volume                     2095.67(16)
_cell_formula_units_Z            6.012
_cell_measurement_reflns_used    9946
_cell_measurement_temperature    302(2)
_cell_measurement_theta_max      29.60
_cell_measurement_theta_min      2.30
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    16.431
_exptl_absorpt_correction_T_max  ?
_exptl_absorpt_correction_T_min  ?
_exptl_absorpt_correction_type   none
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            ?
_exptl_crystal_density_diffrn    3.144
_exptl_crystal_density_meas      .
_exptl_crystal_density_method    ?
_exptl_crystal_description       ?
_exptl_crystal_F_000             1774
_exptl_crystal_size_max          ?
_exptl_crystal_size_mid          ?
_exptl_crystal_size_min          ?
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.1086
_diffrn_reflns_av_unetI/netI     0.0219
_diffrn_reflns_Laue_measured_fraction_full 0.995
_diffrn_reflns_Laue_measured_fraction_max 0.997
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            33825
_diffrn_reflns_point_group_measured_fraction_full 0.995
_diffrn_reflns_point_group_measured_fraction_max 0.997
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         30.182
_diffrn_reflns_theta_min         3.223
_diffrn_ambient_temperature      302.0
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                642
_reflns_number_total             699
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'SAINT V8.40A (?, 2016)'
_computing_data_collection       ?
_computing_data_reduction        'SAINT V8.40A (?, 2016)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'ShelXT (Sheldrick, 2015)'
_refine_diff_density_max         1.643
_refine_diff_density_min         -2.152
_refine_diff_density_rms         0.174
_refine_ls_extinction_coef       0.0018(2)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2016/4 (Sheldrick 2016)'
_refine_ls_goodness_of_fit_ref   1.080
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_parameters     20
_refine_ls_number_reflns         699
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0332
_refine_ls_R_factor_gt           0.0290
_refine_ls_restrained_S_all      1.080
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0477P)²+23.0178P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0855
_refine_ls_wR_factor_ref         0.0881
_refine_special_details          ?
_olex2_refinement_description    
;
1. Others
 Fixed Sof: Cd1(0.15833)
;
_atom_sites_solution_hydrogens   .
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   ?
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Cd1 Cd 0.666667 0.333333 0.333333 0.0185(2) Uani 0.95 6 d S T P . .
Rb2 Rb 0.37228(5) 0.37228(5) 0.250000 0.0314(2) Uani 1 2 d S T P . .
Rb1 Rb 0.666667 0.333333 0.583333 0.0410(3) Uani 1 6 d S T P . .
Cl1 Cl 0.50816(9) 0.36085(10) 0.43152(7) 0.0281(3) Uani 1 1 d . . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Cd1 Rb2 4.1407(3) 2_655 ?
Cd1 Rb2 4.1407(3) 33_545 ?
Cd1 Rb2 4.1407(3) 3_665 ?
Cd1 Rb2 4.1407(3) 31_655 ?
Cd1 Rb1 3.90058(18) 31_655 ?
Cd1 Rb1 3.90057(18) . ?
Cd1 Cl1 2.6528(10) 32 ?
Cd1 Cl1 2.6528(10) . ?
Cd1 Cl1 2.6528(10) 33_545 ?
Cd1 Cl1 2.6528(10) 2_655 ?
Cd1 Cl1 2.6528(10) 31_655 ?
Cd1 Cl1 2.6528(10) 3_665 ?
Rb2 Cd1 4.1407(3) 4 ?
Rb2 Rb1 4.7135(3) 31_655 ?
Rb2 Rb1 4.6363(7) 13_444 ?
Rb2 Cl1 3.3385(11) 4 ?
Rb2 Cl1 3.4502(11) 12 ?
Rb2 Cl1 3.4839(12) 32 ?
Rb2 Cl1 3.3527(11) 33_545 ?
Rb2 Cl1 3.3527(11) 30_455 ?
Rb2 Cl1 3.4502(11) 15_554 ?
Rb2 Cl1 3.3385(11) . ?
Rb2 Cl1 3.4839(12) 29 ?
Rb1 Cd1 3.90056(18) 16_545 ?
Rb1 Rb2 4.6362(7) 7 ?
Rb1 Rb2 4.7135(2) 21_656 ?
Rb1 Rb2 4.6363(7) 8 ?
Rb1 Rb2 4.6362(7) 9 ?
Rb1 Cl1 3.2095(11) 17 ?
Rb1 Cl1 3.2095(11) . ?
Rb1 Cl1 3.2095(11) 18_655 ?
Rb1 Cl1 3.2096(11) 2_655 ?
Rb1 Cl1 3.2096(11) 3_665 ?
Rb1 Cl1 3.2095(11) 16_545 ?
Cl1 Rb2 3.3526(11) 32 ?
Cl1 Rb2 3.4839(12) 33_545 ?
Cl1 Rb2 3.4501(11) 8 ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
Rb2 Cd1 Rb2 110.616(2) 2_655 3_665 ?
Rb2 Cd1 Rb2 180.0 3_665 33_545 ?
Rb2 Cd1 Rb2 69.382(1) 2_655 33_545 ?
Rb2 Cd1 Rb2 110.616(1) 31_655 33_545 ?
Rb2 Cd1 Rb2 69.383(2) 3_665 31_655 ?
Rb2 Cd1 Rb2 69.384(1) 2_655 31_655 ?
Rb1 Cd1 Rb2 108.301(2) . 2_655 ?
Rb1 Cd1 Rb2 71.699(2) 31_655 2_655 ?
Rb1 Cd1 Rb2 71.700(2) . 31_655 ?
Rb1 Cd1 Rb2 71.699(2) 31_655 3_665 ?
Rb1 Cd1 Rb2 108.300(2) 31_655 31_655 ?
Rb1 Cd1 Rb2 108.300(2) 31_655 33_545 ?
Rb1 Cd1 Rb2 71.700(2) . 33_545 ?
Rb1 Cd1 Rb2 108.301(2) . 3_665 ?
Rb1 Cd1 Rb1 180.0 31_655 . ?
Cl1 Cd1 Rb2 53.90(2) 3_665 31_655 ?
Cl1 Cd1 Rb2 123.25(2) . 3_665 ?
Cl1 Cd1 Rb2 53.91(2) 31_655 2_655 ?
Cl1 Cd1 Rb2 53.90(2) 2_655 33_545 ?
Cl1 Cd1 Rb2 56.75(2) 33_545 2_655 ?
Cl1 Cd1 Rb2 126.09(2) 33_545 31_655 ?
Cl1 Cd1 Rb2 53.60(2) 2_655 2_655 ?
Cl1 Cd1 Rb2 123.25(2) 31_655 33_545 ?
Cl1 Cd1 Rb2 123.25(2) 3_665 2_655 ?
Cl1 Cd1 Rb2 126.10(2) 32 33_545 ?
Cl1 Cd1 Rb2 126.40(2) 32 2_655 ?
Cl1 Cd1 Rb2 53.60(2) 31_655 31_655 ?
Cl1 Cd1 Rb2 126.09(2) . 2_655 ?
Cl1 Cd1 Rb2 56.75(2) 2_655 31_655 ?
Cl1 Cd1 Rb2 56.75(2) 31_655 3_665 ?
Cl1 Cd1 Rb2 123.25(2) 32 31_655 ?
Cl1 Cd1 Rb2 126.40(2) 33_545 3_665 ?
Cl1 Cd1 Rb2 53.60(2) 33_545 33_545 ?
Cl1 Cd1 Rb2 126.09(2) 2_655 3_665 ?
Cl1 Cd1 Rb2 126.40(2) 3_665 33_545 ?
Cl1 Cd1 Rb2 53.60(2) 3_665 3_665 ?
Cl1 Cd1 Rb2 56.75(2) . 33_545 ?
Cl1 Cd1 Rb2 53.91(2) 32 3_665 ?
Cl1 Cd1 Rb2 126.40(2) . 31_655 ?
Cl1 Cd1 Rb1 54.73(2) 3_665 . ?
Cl1 Cd1 Rb1 125.27(2) 31_655 . ?
Cl1 Cd1 Rb1 125.27(2) 3_665 31_655 ?
Cl1 Cd1 Rb1 125.27(2) 32 . ?
Cl1 Cd1 Rb1 54.73(2) 2_655 . ?
Cl1 Cd1 Rb1 54.73(2) . . ?
Cl1 Cd1 Rb1 54.73(2) 32 31_655 ?
Cl1 Cd1 Rb1 54.73(2) 31_655 31_655 ?
Cl1 Cd1 Rb1 125.27(2) 33_545 . ?
Cl1 Cd1 Rb1 54.73(2) 33_545 31_655 ?
Cl1 Cd1 Rb1 125.27(2) 2_655 31_655 ?
Cl1 Cd1 Rb1 125.27(2) . 31_655 ?
Cl1 Cd1 Cl1 90.01(3) 33_545 . ?
Cl1 Cd1 Cl1 90.01(3) 33_545 2_655 ?
Cl1 Cd1 Cl1 90.01(3) 31_655 2_655 ?
Cl1 Cd1 Cl1 89.99(3) 31_655 32 ?
Cl1 Cd1 Cl1 89.99(3) 3_665 . ?
Cl1 Cd1 Cl1 89.99(3) 33_545 32 ?
Cl1 Cd1 Cl1 90.01(3) 32 . ?
Cl1 Cd1 Cl1 90.01(3) 31_655 3_665 ?
Cl1 Cd1 Cl1 180.0 2_655 32 ?
Cl1 Cd1 Cl1 180.0 31_655 . ?
Cl1 Cd1 Cl1 180.0 33_545 3_665 ?
Cl1 Cd1 Cl1 89.99(3) 31_655 33_545 ?
Cl1 Cd1 Cl1 89.99(3) 2_655 . ?
Cl1 Cd1 Cl1 89.99(3) 2_655 3_665 ?
Cl1 Cd1 Cl1 90.01(3) 3_665 32 ?
Cd1 Rb2 Cd1 134.819(17) . 4 ?
Cd1 Rb2 Rb1 112.591(8) 4 13_444 ?
Cd1 Rb2 Rb1 111.062(9) 4 31_655 ?
Cd1 Rb2 Rb1 51.784(4) . 31_655 ?
Cd1 Rb2 Rb1 112.590(8) . 13_444 ?
Rb1 Rb2 Rb1 109.721(7) 13_444 31_655 ?
Cl1 Rb2 Cd1 97.30(2) 29 . ?
Cl1 Rb2 Cd1 97.30(2) 32 4 ?
Cl1 Rb2 Cd1 114.721(18) 12 4 ?
Cl1 Rb2 Cd1 39.553(17) 32 . ?
Cl1 Rb2 Cd1 39.744(17) 30_455 4 ?
Cl1 Rb2 Cd1 39.745(17) 33_545 . ?
Cl1 Rb2 Cd1 39.553(17) 29 4 ?
Cl1 Rb2 Cd1 153.64(2) 30_455 . ?
Cl1 Rb2 Cd1 126.19(2) 4 . ?
Cl1 Rb2 Cd1 39.760(17) . . ?
Cl1 Rb2 Cd1 114.721(18) 15_554 . ?
Cl1 Rb2 Cd1 126.18(2) . 4 ?
Cl1 Rb2 Cd1 97.844(18) 12 . ?
Cl1 Rb2 Cd1 39.759(17) 4 4 ?
Cl1 Rb2 Cd1 153.64(2) 33_545 4 ?
Cl1 Rb2 Cd1 97.844(18) 15_554 4 ?
Cl1 Rb2 Rb1 103.42(2) . 13_444 ?
Cl1 Rb2 Rb1 91.530(18) . 31_655 ?
Cl1 Rb2 Rb1 133.475(19) 12 31_655 ?
Cl1 Rb2 Rb1 103.42(2) 4 13_444 ?
Cl1 Rb2 Rb1 147.601(19) 30_455 31_655 ?
Cl1 Rb2 Rb1 80.47(2) 33_545 13_444 ?
Cl1 Rb2 Rb1 42.914(17) 32 31_655 ?
Cl1 Rb2 Rb1 80.48(2) 30_455 13_444 ?
Cl1 Rb2 Rb1 79.435(18) 4 31_655 ?
Cl1 Rb2 Rb1 43.781(19) 15_554 13_444 ?
Cl1 Rb2 Rb1 78.418(18) 15_554 31_655 ?
Cl1 Rb2 Rb1 43.783(19) 12 13_444 ?
Cl1 Rb2 Rb1 99.59(2) 29 31_655 ?
Cl1 Rb2 Rb1 146.956(17) 29 13_444 ?
Cl1 Rb2 Rb1 146.953(17) 32 13_444 ?
Cl1 Rb2 Rb1 42.890(18) 33_545 31_655 ?
Cl1 Rb2 Cl1 68.05(3) . 12 ?
Cl1 Rb2 Cl1 116.61(3) 4 33_545 ?
Cl1 Rb2 Cl1 134.22(3) 15_554 29 ?
Cl1 Rb2 Cl1 135.157(18) 4 12 ?
Cl1 Rb2 Cl1 135.158(18) . 15_554 ?
Cl1 Rb2 Cl1 90.73(2) 33_545 12 ?
Cl1 Rb2 Cl1 66.69(3) 4 29 ?
Cl1 Rb2 Cl1 75.43(3) 30_455 12 ?
Cl1 Rb2 Cl1 68.21(3) 4 30_455 ?
Cl1 Rb2 Cl1 87.56(4) 15_554 12 ?
Cl1 Rb2 Cl1 75.43(3) 33_545 15_554 ?
Cl1 Rb2 Cl1 90.38(3) . 29 ?
Cl1 Rb2 Cl1 66.69(3) . 32 ?
Cl1 Rb2 Cl1 90.38(3) 4 32 ?
Cl1 Rb2 Cl1 132.512(17) 33_545 29 ?
Cl1 Rb2 Cl1 66.52(3) 33_545 32 ?
Cl1 Rb2 Cl1 116.61(3) . 30_455 ?
Cl1 Rb2 Cl1 132.512(17) 30_455 32 ?
Cl1 Rb2 Cl1 160.95(4) 33_545 30_455 ?
Cl1 Rb2 Cl1 120.860(13) 15_554 32 ?
Cl1 Rb2 Cl1 68.05(3) 4 15_554 ?
Cl1 Rb2 Cl1 134.22(3) 12 32 ?
Cl1 Rb2 Cl1 66.52(3) 30_455 29 ?
Cl1 Rb2 Cl1 66.09(3) 29 32 ?
Cl1 Rb2 Cl1 90.73(2) 30_455 15_554 ?
Cl1 Rb2 Cl1 153.16(4) . 4 ?
Cl1 Rb2 Cl1 68.21(3) . 33_545 ?
Cl1 Rb2 Cl1 120.860(13) 12 29 ?
Cd1 Rb1 Cd1 180.0 . 16_545 ?
Cd1 Rb1 Rb2 90.0 . 8 ?
Cd1 Rb1 Rb2 123.483(3) . 21_656 ?
Cd1 Rb1 Rb2 90.0 16_545 9 ?
Cd1 Rb1 Rb2 90.0 16_545 8 ?
Cd1 Rb1 Rb2 90.0 . 7 ?
Cd1 Rb1 Rb2 56.517(2) 16_545 21_656 ?
Cd1 Rb1 Rb2 90.0 16_545 7 ?
Cd1 Rb1 Rb2 90.0 . 9 ?
Rb2 Rb1 Rb2 146.023(3) 8 21_656 ?
Rb2 Rb1 Rb2 70.278(7) 9 21_656 ?
Rb2 Rb1 Rb2 119.999(1) 7 8 ?
Rb2 Rb1 Rb2 60.540(6) 7 21_656 ?
Rb2 Rb1 Rb2 120.0 9 8 ?
Rb2 Rb1 Rb2 120.0 9 7 ?
Cl1 Rb1 Cd1 137.562(18) 18_655 . ?
Cl1 Rb1 Cd1 137.562(18) 16_545 . ?
Cl1 Rb1 Cd1 137.562(18) 3_665 16_545 ?
Cl1 Rb1 Cd1 42.439(18) 17 16_545 ?
Cl1 Rb1 Cd1 42.439(18) 2_655 . ?
Cl1 Rb1 Cd1 137.562(18) . 16_545 ?
Cl1 Rb1 Cd1 42.438(18) 16_545 16_545 ?
Cl1 Rb1 Cd1 137.561(18) 2_655 16_545 ?
Cl1 Rb1 Cd1 42.438(18) 18_655 16_545 ?
Cl1 Rb1 Cd1 42.438(18) 3_665 . ?
Cl1 Rb1 Cd1 137.562(18) 17 . ?
Cl1 Rb1 Cd1 42.438(18) . . ?
Cl1 Rb1 Rb2 48.054(18) 2_655 9 ?
Cl1 Rb1 Rb2 48.053(18) 17 8 ?
Cl1 Rb1 Rb2 104.723(19) 2_655 8 ?
Cl1 Rb1 Rb2 104.722(19) 3_665 9 ?
Cl1 Rb1 Rb2 162.406(18) . 21_656 ?
Cl1 Rb1 Rb2 48.053(18) 16_545 9 ?
Cl1 Rb1 Rb2 48.054(18) . 8 ?
Cl1 Rb1 Rb2 114.475(19) . 9 ?
Cl1 Rb1 Rb2 90.923(19) 3_665 21_656 ?
Cl1 Rb1 Rb2 114.475(19) 18_655 9 ?
Cl1 Rb1 Rb2 98.940(18) 17 21_656 ?
Cl1 Rb1 Rb2 104.722(19) 17 9 ?
Cl1 Rb1 Rb2 114.475(19) 16_545 8 ?
Cl1 Rb1 Rb2 114.476(19) 2_655 7 ?
Cl1 Rb1 Rb2 104.722(19) 18_655 8 ?
Cl1 Rb1 Rb2 48.055(18) 3_665 7 ?
Cl1 Rb1 Rb2 104.60(2) 2_655 21_656 ?
Cl1 Rb1 Rb2 104.722(19) 16_545 7 ?
Cl1 Rb1 Rb2 45.312(19) 16_545 21_656 ?
Cl1 Rb1 Rb2 104.722(19) . 7 ?
Cl1 Rb1 Rb2 47.65(2) 18_655 21_656 ?
Cl1 Rb1 Rb2 48.053(18) 18_655 7 ?
Cl1 Rb1 Rb2 114.474(19) 17 7 ?
Cl1 Rb1 Rb2 114.476(19) 3_665 8 ?
Cl1 Rb1 Cl1 131.05(4) 3_665 16_545 ?
Cl1 Rb1 Cl1 71.52(3) 2_655 3_665 ?
Cl1 Rb1 Cl1 71.52(3) 16_545 18_655 ?
Cl1 Rb1 Cl1 131.05(4) 2_655 17 ?
Cl1 Rb1 Cl1 150.56(4) 2_655 18_655 ?
Cl1 Rb1 Cl1 71.52(3) 3_665 . ?
Cl1 Rb1 Cl1 71.52(3) 18_655 17 ?
Cl1 Rb1 Cl1 150.56(4) 3_665 17 ?
Cl1 Rb1 Cl1 150.56(4) 16_545 . ?
Cl1 Rb1 Cl1 131.05(4) . 18_655 ?
Cl1 Rb1 Cl1 96.11(4) 3_665 18_655 ?
Cl1 Rb1 Cl1 71.52(3) 16_545 17 ?
Cl1 Rb1 Cl1 96.11(4) 2_655 16_545 ?
Cl1 Rb1 Cl1 96.11(4) . 17 ?
Cl1 Rb1 Cl1 71.52(3) 2_655 . ?
Cd1 Cl1 Rb2 86.64(3) . . ?
Cd1 Cl1 Rb2 83.70(3) . 33_545 ?
Cd1 Cl1 Rb2 86.35(3) . 32 ?
Cd1 Cl1 Rb2 166.10(4) . 8 ?
Cd1 Cl1 Rb1 82.83(3) . . ?
Rb2 Cl1 Rb2 104.57(3) 32 8 ?
Rb2 Cl1 Rb2 89.57(3) . 32 ?
Rb2 Cl1 Rb2 169.74(3) 32 33_545 ?
Rb2 Cl1 Rb2 87.37(3) . 33_545 ?
Rb2 Cl1 Rb2 85.65(2) 8 33_545 ?
Rb2 Cl1 Rb2 101.79(3) . 8 ?
Rb1 Cl1 Rb2 89.43(3) . 33_545 ?
Rb1 Cl1 Rb2 169.28(4) . . ?
Rb1 Cl1 Rb2 91.80(3) . 32 ?
Rb1 Cl1 Rb2 88.16(3) . 8 ?

_olex2_submission_special_instructions 'No special instructions were received'
####################################################################### 
# 
# 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_b
_database_code_depnum_ccdc_archive 'CCDC 2205344'
loop_
_audit_author_name
_audit_author_address
'Dayu dyhuang' 'Changchun Institute of Applied Chemistry'
_audit_update_record             
;
2022-09-04 deposited with the CCDC.	2023-03-21 downloaded from the CCDC.
;
_audit_creation_date             2022-09-04
_audit_creation_method           
;
Olex2 1.2
(compiled 2017.08.10 svn.r3458 for OlexSys, GUI svn.r5381)
;
_shelx_SHELXL_version_number     2016/4
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         '0.17(Cd6 Cl36 Rb24)'
_chemical_formula_sum            'Cd Cl6 Rb4'
_chemical_formula_weight         666.85
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Cd Cd -0.8075 1.2024 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Rb Rb -0.9393 2.9676 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      trigonal
_space_group_IT_number           167
_space_group_name_H-M_alt        'R -3 c'
_space_group_name_Hall           '-R 3 2"c'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'y, x, -z+1/2'
'x-y, -y, -z+1/2'
'-x, -x+y, -z+1/2'
'x+2/3, y+1/3, z+1/3'
'-y+2/3, x-y+1/3, z+1/3'
'-x+y+2/3, -x+1/3, z+1/3'
'y+2/3, x+1/3, -z+5/6'
'x-y+2/3, -y+1/3, -z+5/6'
'-x+2/3, -x+y+1/3, -z+5/6'
'x+1/3, y+2/3, z+2/3'
'-y+1/3, x-y+2/3, z+2/3'
'-x+y+1/3, -x+2/3, z+2/3'
'y+1/3, x+2/3, -z+7/6'
'x-y+1/3, -y+2/3, -z+7/6'
'-x+1/3, -x+y+2/3, -z+7/6'
'-x, -y, -z'
'y, -x+y, -z'
'x-y, x, -z'
'-y, -x, z-1/2'
'-x+y, y, z-1/2'
'x, x-y, z-1/2'
'-x+2/3, -y+1/3, -z+1/3'
'y+2/3, -x+y+1/3, -z+1/3'
'x-y+2/3, x+1/3, -z+1/3'
'-y+2/3, -x+1/3, z-1/6'
'-x+y+2/3, y+1/3, z-1/6'
'x+2/3, x-y+1/3, z-1/6'
'-x+1/3, -y+2/3, -z+2/3'
'y+1/3, -x+y+2/3, -z+2/3'
'x-y+1/3, x+2/3, -z+2/3'
'-y+1/3, -x+2/3, z+1/6'
'-x+y+1/3, y+2/3, z+1/6'
'x+1/3, x-y+2/3, z+1/6'

_cell_length_a                   12.483(5)
_cell_length_b                   12.483(5)
_cell_length_c                   15.640(8)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_volume                     2110.5(18)
_cell_formula_units_Z            6.0012
_cell_measurement_reflns_used    9219
_cell_measurement_temperature    302(2)
_cell_measurement_theta_max      29.784
_cell_measurement_theta_min      3.211
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    16.389
_exptl_absorpt_correction_T_max  ?
_exptl_absorpt_correction_T_min  ?
_exptl_absorpt_correction_type   none
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            ?
_exptl_crystal_density_diffrn    3.149
_exptl_crystal_density_meas      .
_exptl_crystal_density_method    ?
_exptl_crystal_description       ?
_exptl_crystal_F_000             1788
_exptl_crystal_size_max          ?
_exptl_crystal_size_mid          ?
_exptl_crystal_size_min          ?
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0964
_diffrn_reflns_av_unetI/netI     0.0245
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.997
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            25128
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.997
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         30.068
_diffrn_reflns_theta_min         3.215
_diffrn_ambient_temperature      302.0
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'Bruker P4'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                642
_reflns_number_total             697
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'SAINT V8.40A (?, 2016)'
_computing_data_collection       ?
_computing_data_reduction        'SAINT V8.40A (?, 2016)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'ShelXT (Sheldrick, 2015)'
_refine_diff_density_max         1.084
_refine_diff_density_min         -1.996
_refine_diff_density_rms         0.224
_refine_ls_extinction_coef       0.0035(3)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2016/4 (Sheldrick 2016)'
_refine_ls_goodness_of_fit_ref   1.072
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_parameters     20
_refine_ls_number_reflns         697
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0359
_refine_ls_R_factor_gt           0.0323
_refine_ls_restrained_S_all      1.072
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0579P)²+10.8081P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0863
_refine_ls_wR_factor_ref         0.0891
_refine_special_details          ?
_olex2_refinement_description    
;
;
_atom_sites_solution_hydrogens   .
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   ?
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Cd1 Cd 0.666667 0.333333 0.833333 0.0191(2) Uani 1 6 d S T P . .
Rb1 Rb 0.333333 0.29441(5) 0.916667 0.0301(2) Uani 1 2 d S T P . .
Rb2 Rb 0.666667 0.333333 0.583333 0.0400(3) Uani 1 6 d S T P . .
Cl1 Cl 0.48061(8) 0.30584(9) 0.73517(7) 0.0265(3) Uani 1 1 d . . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Cd1 Rb1 4.1503(14) 2_655 ?
Cd1 Rb1 4.1504(14) 3_665 ?
Cd1 Rb1 4.1503(14) 32_556 ?
Cd1 Rb1 4.1504(14) 33_546 ?
Cd1 Rb2 3.9100(19) . ?
Cd1 Rb2 3.9100(19) 31_656 ?
Cd1 Cl1 2.6593(12) 3_665 ?
Cd1 Cl1 2.6593(12) 32_556 ?
Cd1 Cl1 2.6593(12) 2_655 ?
Cd1 Cl1 2.6593(12) 33_546 ?
Cd1 Cl1 2.6593(12) 31_656 ?
Cd1 Cl1 2.6593(12) . ?
Rb1 Cd1 4.1504(14) 10_446 ?
Rb1 Rb1 4.7245(14) 21_557 ?
Rb1 Rb2 4.6468(18) 7_455 ?
Rb1 Cl1 3.3460(16) . ?
Rb1 Cl1 3.4579(14) 4_556 ?
Rb1 Cl1 3.4919(16) 35_545 ?
Rb1 Cl1 3.3606(15) 34 ?
Rb1 Cl1 3.3607(15) 32_556 ?
Rb1 Cl1 3.4579(15) 8 ?
Rb1 Cl1 3.3461(16) 12_556 ?
Rb1 Cl1 3.4918(16) 33_546 ?
Rb2 Cd1 3.9100(19) 16_545 ?
Rb2 Rb1 4.6468(18) 14_654 ?
Rb2 Rb1 4.7246(14) 26_556 ?
Rb2 Rb1 4.6468(18) 15_554 ?
Rb2 Rb1 4.6468(18) 13_544 ?
Rb2 Cl1 3.2177(14) . ?
Rb2 Cl1 3.2177(14) 17 ?
Rb2 Cl1 3.2177(14) 3_665 ?
Rb2 Cl1 3.2177(14) 16_545 ?
Rb2 Cl1 3.2177(14) 18_655 ?
Rb2 Cl1 3.2177(14) 2_655 ?
Cl1 Rb1 3.3607(15) 33_546 ?
Cl1 Rb1 3.4918(16) 32_556 ?
Cl1 Rb1 3.4579(14) 15_554 ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
Rb1 Cd1 Rb1 180.0 2_655 32_556 ?
Rb1 Cd1 Rb1 69.385(10) 32_556 3_665 ?
Rb1 Cd1 Rb1 110.615(10) 2_655 3_665 ?
Rb1 Cd1 Rb1 180.0 33_546 3_665 ?
Rb1 Cd1 Rb1 110.615(10) 32_556 33_546 ?
Rb1 Cd1 Rb1 69.385(11) 2_655 33_546 ?
Rb2 Cd1 Rb1 71.697(11) 31_656 2_655 ?
Rb2 Cd1 Rb1 108.303(11) . 2_655 ?
Rb2 Cd1 Rb1 108.303(11) 31_656 33_546 ?
Rb2 Cd1 Rb1 71.696(11) . 32_556 ?
Rb2 Cd1 Rb1 71.697(10) . 33_546 ?
Rb2 Cd1 Rb1 108.303(10) . 3_665 ?
Rb2 Cd1 Rb1 71.697(11) 31_656 3_665 ?
Rb2 Cd1 Rb1 108.304(11) 31_656 32_556 ?
Rb2 Cd1 Rb2 180.0 . 31_656 ?
Cl1 Cd1 Rb1 53.91(2) . 33_546 ?
Cl1 Cd1 Rb1 53.59(3) 32_556 32_556 ?
Cl1 Cd1 Rb1 56.74(2) 31_656 2_655 ?
Cl1 Cd1 Rb1 126.41(3) 33_546 3_665 ?
Cl1 Cd1 Rb1 53.59(3) 2_655 2_655 ?
Cl1 Cd1 Rb1 56.74(2) 2_655 33_546 ?
Cl1 Cd1 Rb1 53.91(2) 33_546 2_655 ?
Cl1 Cd1 Rb1 53.91(2) 31_656 3_665 ?
Cl1 Cd1 Rb1 123.26(2) . 2_655 ?
Cl1 Cd1 Rb1 53.59(3) 3_665 3_665 ?
Cl1 Cd1 Rb1 126.09(2) 3_665 2_655 ?
Cl1 Cd1 Rb1 126.09(2) 31_656 33_546 ?
Cl1 Cd1 Rb1 126.41(3) 32_556 2_655 ?
Cl1 Cd1 Rb1 53.59(3) 33_546 33_546 ?
Cl1 Cd1 Rb1 123.26(2) 31_656 32_556 ?
Cl1 Cd1 Rb1 126.41(3) 3_665 33_546 ?
Cl1 Cd1 Rb1 126.41(3) 2_655 32_556 ?
Cl1 Cd1 Rb1 123.26(2) 2_655 3_665 ?
Cl1 Cd1 Rb1 126.09(2) 33_546 32_556 ?
Cl1 Cd1 Rb1 126.09(2) . 3_665 ?
Cl1 Cd1 Rb1 56.74(2) . 32_556 ?
Cl1 Cd1 Rb1 56.74(2) 32_556 3_665 ?
Cl1 Cd1 Rb1 53.91(2) 3_665 32_556 ?
Cl1 Cd1 Rb1 123.26(2) 32_556 33_546 ?
Cl1 Cd1 Rb2 125.26(3) . 31_656 ?
Cl1 Cd1 Rb2 54.74(3) 31_656 31_656 ?
Cl1 Cd1 Rb2 54.74(3) . . ?
Cl1 Cd1 Rb2 125.26(3) 3_665 31_656 ?
Cl1 Cd1 Rb2 54.74(3) 33_546 31_656 ?
Cl1 Cd1 Rb2 54.74(3) 32_556 31_656 ?
Cl1 Cd1 Rb2 54.74(3) 3_665 . ?
Cl1 Cd1 Rb2 125.26(3) 31_656 . ?
Cl1 Cd1 Rb2 125.26(3) 2_655 31_656 ?
Cl1 Cd1 Rb2 54.74(3) 2_655 . ?
Cl1 Cd1 Rb2 125.26(3) 33_546 . ?
Cl1 Cd1 Rb2 125.26(3) 32_556 . ?
Cl1 Cd1 Cl1 180.0 2_655 32_556 ?
Cl1 Cd1 Cl1 90.00(4) 2_655 33_546 ?
Cl1 Cd1 Cl1 90.00(4) 31_656 33_546 ?
Cl1 Cd1 Cl1 90.00(4) 31_656 3_665 ?
Cl1 Cd1 Cl1 90.00(4) . 32_556 ?
Cl1 Cd1 Cl1 90.00(4) 2_655 3_665 ?
Cl1 Cd1 Cl1 90.00(4) 3_665 32_556 ?
Cl1 Cd1 Cl1 180.00(4) 31_656 . ?
Cl1 Cd1 Cl1 180.0 33_546 3_665 ?
Cl1 Cd1 Cl1 90.00(4) 31_656 32_556 ?
Cl1 Cd1 Cl1 90.00(4) 2_655 . ?
Cl1 Cd1 Cl1 90.00(4) 31_656 2_655 ?
Cl1 Cd1 Cl1 90.00(4) 33_546 32_556 ?
Cl1 Cd1 Cl1 90.00(4) 33_546 . ?
Cl1 Cd1 Cl1 90.00(4) . 3_665 ?
Cd1 Rb1 Cd1 134.815(15) 10_446 . ?
Cd1 Rb1 Rb1 161.268(9) . 21_557 ?
Cd1 Rb1 Rb1 55.306(6) 10_446 21_557 ?
Cd1 Rb1 Rb2 112.593(8) . 7_455 ?
Cd1 Rb1 Rb2 112.591(8) 10_446 7_455 ?
Rb2 Rb1 Rb1 60.543(8) 7_455 21_557 ?
Cl1 Rb1 Cd1 97.288(19) 33_546 10_446 ?
Cl1 Rb1 Cd1 97.285(19) 35_545 . ?
Cl1 Rb1 Cd1 97.83(2) 4_556 . ?
Cl1 Rb1 Cd1 39.561(16) 35_545 10_446 ?
Cl1 Rb1 Cd1 39.749(17) 32_556 . ?
Cl1 Rb1 Cd1 39.747(17) 34 10_446 ?
Cl1 Rb1 Cd1 39.557(17) 33_546 . ?
Cl1 Rb1 Cd1 153.64(2) 32_556 10_446 ?
Cl1 Rb1 Cd1 126.18(2) . 10_446 ?
Cl1 Rb1 Cd1 39.764(17) 12_556 10_446 ?
Cl1 Rb1 Cd1 97.83(2) 8 10_446 ?
Cl1 Rb1 Cd1 126.185(19) 12_556 . ?
Cl1 Rb1 Cd1 114.728(18) 4_556 10_446 ?
Cl1 Rb1 Cd1 39.764(17) . . ?
Cl1 Rb1 Cd1 153.64(2) 34 . ?
Cl1 Rb1 Cd1 114.729(18) 8 . ?
Cl1 Rb1 Rb1 47.58(2) 12_556 21_557 ?
Cl1 Rb1 Rb1 88.05(3) 4_556 21_557 ?
Cl1 Rb1 Rb1 94.846(15) 35_545 21_557 ?
Cl1 Rb1 Rb1 154.518(16) . 21_557 ?
Cl1 Rb1 Rb1 137.74(2) 33_546 21_557 ?
Cl1 Rb1 Rb1 122.90(2) 32_556 21_557 ?
Cl1 Rb1 Rb1 47.47(2) 8 21_557 ?
Cl1 Rb1 Rb1 45.09(2) 34 21_557 ?
Cl1 Rb1 Rb2 103.417(19) 12_556 7_455 ?
Cl1 Rb1 Rb2 43.80(2) 4_556 7_455 ?
Cl1 Rb1 Rb2 146.967(15) 35_545 7_455 ?
Cl1 Rb1 Rb2 103.419(19) . 7_455 ?
Cl1 Rb1 Rb2 146.966(16) 33_546 7_455 ?
Cl1 Rb1 Rb2 80.473(18) 34 7_455 ?
Cl1 Rb1 Rb2 43.80(2) 8 7_455 ?
Cl1 Rb1 Rb2 80.471(18) 32_556 7_455 ?
Cl1 Rb1 Cl1 135.17(2) 12_556 4_556 ?
Cl1 Rb1 Cl1 90.37(3) . 35_545 ?
Cl1 Rb1 Cl1 120.863(18) 8 33_546 ?
Cl1 Rb1 Cl1 68.02(4) . 4_556 ?
Cl1 Rb1 Cl1 120.862(18) 4_556 35_545 ?
Cl1 Rb1 Cl1 75.44(3) 34 4_556 ?
Cl1 Rb1 Cl1 66.69(3) . 33_546 ?
Cl1 Rb1 Cl1 90.72(2) 32_556 4_556 ?
Cl1 Rb1 Cl1 132.505(15) 32_556 35_545 ?
Cl1 Rb1 Cl1 87.59(5) 8 4_556 ?
Cl1 Rb1 Cl1 153.16(4) 12_556 . ?
Cl1 Rb1 Cl1 90.38(3) 12_556 33_546 ?
Cl1 Rb1 Cl1 75.44(3) 32_556 8 ?
Cl1 Rb1 Cl1 116.61(3) . 34 ?
Cl1 Rb1 Cl1 132.505(15) 34 33_546 ?
Cl1 Rb1 Cl1 116.61(3) 12_556 32_556 ?
Cl1 Rb1 Cl1 66.54(3) 34 35_545 ?
Cl1 Rb1 Cl1 68.21(3) . 32_556 ?
Cl1 Rb1 Cl1 134.21(3) 8 35_545 ?
Cl1 Rb1 Cl1 66.70(3) 12_556 35_545 ?
Cl1 Rb1 Cl1 68.21(3) 12_556 34 ?
Cl1 Rb1 Cl1 160.94(4) 34 32_556 ?
Cl1 Rb1 Cl1 66.54(3) 32_556 33_546 ?
Cl1 Rb1 Cl1 68.02(4) 12_556 8 ?
Cl1 Rb1 Cl1 134.21(3) 4_556 33_546 ?
Cl1 Rb1 Cl1 135.17(2) . 8 ?
Cl1 Rb1 Cl1 90.72(2) 34 8 ?
Cl1 Rb1 Cl1 66.07(3) 33_546 35_545 ?
Cd1 Rb2 Cd1 180.0 16_545 . ?
Cd1 Rb2 Rb1 90.0 16_545 15_554 ?
Cd1 Rb2 Rb1 56.515(16) 16_545 26_556 ?
Cd1 Rb2 Rb1 90.0 . 13_544 ?
Cd1 Rb2 Rb1 90.0 . 15_554 ?
Cd1 Rb2 Rb1 90.0 16_545 14_654 ?
Cd1 Rb2 Rb1 123.485(16) . 26_556 ?
Cd1 Rb2 Rb1 90.0 . 14_654 ?
Cd1 Rb2 Rb1 90.0 16_545 13_544 ?
Rb1 Rb2 Rb1 146.022(16) 15_554 26_556 ?
Rb1 Rb2 Rb1 60.543(8) 13_544 26_556 ?
Rb1 Rb2 Rb1 120.0 14_654 15_554 ?
Rb1 Rb2 Rb1 70.276(8) 14_654 26_556 ?
Rb1 Rb2 Rb1 120.0 13_544 15_554 ?
Rb1 Rb2 Rb1 120.0 13_544 14_654 ?
Cl1 Rb2 Cd1 137.56(2) 3_665 16_545 ?
Cl1 Rb2 Cd1 137.56(2) 2_655 16_545 ?
Cl1 Rb2 Cd1 137.56(2) 18_655 . ?
Cl1 Rb2 Cd1 42.44(2) . . ?
Cl1 Rb2 Cd1 42.44(2) 16_545 16_545 ?
Cl1 Rb2 Cd1 137.56(2) 17 . ?
Cl1 Rb2 Cd1 42.44(2) 2_655 . ?
Cl1 Rb2 Cd1 137.56(2) 16_545 . ?
Cl1 Rb2 Cd1 42.44(2) 3_665 . ?
Cl1 Rb2 Cd1 42.44(2) 18_655 16_545 ?
Cl1 Rb2 Cd1 137.56(2) . 16_545 ?
Cl1 Rb2 Cd1 42.44(2) 17 16_545 ?
Cl1 Rb2 Rb1 48.05(2) 16_545 13_544 ?
Cl1 Rb2 Rb1 48.05(2) . 15_554 ?
Cl1 Rb2 Rb1 104.727(17) 16_545 15_554 ?
Cl1 Rb2 Rb1 104.727(17) 18_655 13_544 ?
Cl1 Rb2 Rb1 98.94(4) 17 26_556 ?
Cl1 Rb2 Rb1 48.05(2) 2_655 13_544 ?
Cl1 Rb2 Rb1 48.05(2) 17 15_554 ?
Cl1 Rb2 Rb1 114.47(2) 17 13_544 ?
Cl1 Rb2 Rb1 45.31(2) 18_655 26_556 ?
Cl1 Rb2 Rb1 114.471(19) 3_665 13_544 ?
Cl1 Rb2 Rb1 162.412(16) . 26_556 ?
Cl1 Rb2 Rb1 104.727(17) . 13_544 ?
Cl1 Rb2 Rb1 114.47(2) 2_655 15_554 ?
Cl1 Rb2 Rb1 114.470(19) 16_545 14_654 ?
Cl1 Rb2 Rb1 104.728(17) 3_665 15_554 ?
Cl1 Rb2 Rb1 48.05(2) 18_655 14_654 ?
Cl1 Rb2 Rb1 47.65(2) 16_545 26_556 ?
Cl1 Rb2 Rb1 104.728(18) 2_655 14_654 ?
Cl1 Rb2 Rb1 90.93(3) 2_655 26_556 ?
Cl1 Rb2 Rb1 104.727(18) 17 14_654 ?
Cl1 Rb2 Rb1 104.60(3) 3_665 26_556 ?
Cl1 Rb2 Rb1 48.05(2) 3_665 14_654 ?
Cl1 Rb2 Rb1 114.470(19) . 14_654 ?
Cl1 Rb2 Rb1 114.47(2) 18_655 15_554 ?
Cl1 Rb2 Cl1 131.06(4) 18_655 2_655 ?
Cl1 Rb2 Cl1 71.52(4) 16_545 18_655 ?
Cl1 Rb2 Cl1 71.52(4) 2_655 3_665 ?
Cl1 Rb2 Cl1 131.06(4) 16_545 . ?
Cl1 Rb2 Cl1 150.54(3) 16_545 3_665 ?
Cl1 Rb2 Cl1 71.52(4) 18_655 17 ?
Cl1 Rb2 Cl1 71.52(4) 3_665 . ?
Cl1 Rb2 Cl1 150.55(3) 18_655 . ?
Cl1 Rb2 Cl1 150.54(3) 2_655 17 ?
Cl1 Rb2 Cl1 131.06(4) 17 3_665 ?
Cl1 Rb2 Cl1 96.11(5) 18_655 3_665 ?
Cl1 Rb2 Cl1 71.52(4) 2_655 . ?
Cl1 Rb2 Cl1 96.11(5) 16_545 2_655 ?
Cl1 Rb2 Cl1 96.11(5) 17 . ?
Cl1 Rb2 Cl1 71.52(4) 16_545 17 ?
Cd1 Cl1 Rb1 86.64(4) . . ?
Cd1 Cl1 Rb1 83.70(2) . 32_556 ?
Cd1 Cl1 Rb1 86.34(3) . 33_546 ?
Cd1 Cl1 Rb1 166.09(4) . 15_554 ?
Cd1 Cl1 Rb2 82.83(4) . . ?
Rb1 Cl1 Rb1 104.56(3) 33_546 15_554 ?
Rb1 Cl1 Rb1 89.57(2) . 33_546 ?
Rb1 Cl1 Rb1 169.74(3) 33_546 32_556 ?
Rb1 Cl1 Rb1 87.39(2) . 32_556 ?
Rb1 Cl1 Rb1 85.66(2) 15_554 32_556 ?
Rb1 Cl1 Rb1 101.81(4) . 15_554 ?
Rb2 Cl1 Rb1 89.43(2) . 32_556 ?
Rb2 Cl1 Rb1 169.27(3) . . ?
Rb2 Cl1 Rb1 91.78(2) . 33_546 ?
Rb2 Cl1 Rb1 88.15(4) . 15_554 ?

_olex2_submission_special_instructions 'No special instructions were received'
