# Electronic Supplementary Material (ESI) for Inorganic Chemistry Frontiers.
# This journal is © the Partner Organisations 2022

####################################################################### 
# 
# 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_exp_9113_auto
_database_code_depnum_ccdc_archive 'CCDC 2192860'
loop_
_audit_author_name
_audit_author_address
'Mingjun Xia'
;Technical Institute of Physics and Chemistry, CAS
China
;
_audit_update_record             
;
2022-07-27 deposited with the CCDC.	2022-10-17 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'Bi Cl6 Cs Rb2'
_chemical_formula_weight         725.53

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
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'
Cs Cs -0.3680 2.1192 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Bi Bi -4.1077 10.2566 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           ?
_symmetry_space_group_name_H-M   ?

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, z+1/2'
'-x, y+1/2, -z+1/2'
'x, -y+1/2, -z'
'-x, -y, -z'
'x, y, -z-1/2'
'x, -y-1/2, z-1/2'
'-x, y-1/2, z'

_cell_length_a                   8.1044(4)
_cell_length_b                   12.9295(6)
_cell_length_c                   25.8508(10)
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_volume                     2708.8(2)
_cell_formula_units_Z            8
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    ?
_cell_measurement_theta_min      ?
_cell_measurement_theta_max      ?

_exptl_crystal_description       ?
_exptl_crystal_colour            ?
_exptl_crystal_size_max          ?
_exptl_crystal_size_mid          ?
_exptl_crystal_size_min          ?
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    3.558
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2512
_exptl_absorpt_coefficient_mu    23.936
_exptl_absorpt_correction_type   ?
_exptl_absorpt_correction_T_min  ?
_exptl_absorpt_correction_T_max  ?
_exptl_absorpt_process_details   ?

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  ?
_diffrn_measurement_method       ?
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            15374
_diffrn_reflns_av_R_equivalents  0.0354
_diffrn_reflns_av_sigmaI/netI    0.0350
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_l_min       -36
_diffrn_reflns_limit_l_max       30
_diffrn_reflns_theta_min         2.51
_diffrn_reflns_theta_max         30.85
_reflns_number_total             3551
_reflns_number_gt                2846
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
; 
 Refinement of F² against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0417P)²+15.9372P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    mixed
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         3551
_refine_ls_number_parameters     96
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0495
_refine_ls_R_factor_gt           0.0361
_refine_ls_wR_factor_ref         0.0904
_refine_ls_wR_factor_gt          0.0862
_refine_ls_goodness_of_fit_ref   1.039
_refine_ls_restrained_S_all      1.039
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Cs1 Cs 0.76108(8) 0.08664(4) 0.54998(2) 0.05047(17) Uani 1 1 d . . .
Rb1 Rb 0.19039(9) -0.09342(5) 0.65514(3) 0.03007(16) Uani 1 1 d . . .
Rb2 Rb 0.31539(10) 0.25515(6) 0.66207(3) 0.03651(18) Uani 1 1 d . . .
Bi1 Bi 0.28213(4) 0.2500 0.5000 0.02067(10) Uani 1 2 d S . .
Bi2 Bi 0.75582(5) 0.08114(3) 0.7500 0.02425(10) Uani 1 2 d S . .
Cl1 Cl 0.8998(4) -0.10851(19) 0.7500 0.0365(6) Uani 1 2 d S . .
Cl2 Cl 0.6144(4) 0.27275(19) 0.7500 0.0345(6) Uani 1 2 d S . .
Cl3 Cl 0.5272(3) 0.17456(16) 0.43926(7) 0.0402(5) Uani 1 1 d . . .
Cl4 Cl 0.2724(3) 0.08152(14) 0.55966(8) 0.0478(6) Uani 1 1 d . . .
Cl5 Cl 0.9598(3) 0.13932(18) 0.67229(8) 0.0488(6) Uani 1 1 d . . .
Cl6 Cl 0.5503(3) 0.02172(17) 0.67445(8) 0.0496(6) Uani 1 1 d . . .
Cl7 Cl 0.0497(3) 0.16218(15) 0.43954(8) 0.0440(5) 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
Cs1 Cl7 3.574(2) 5_656 ?
Cs1 Cl4 3.582(2) 5_656 ?
Cs1 Cl5 3.613(2) . ?
Cs1 Cl3 3.616(2) . ?
Cs1 Cl3 3.634(2) 4_556 ?
Cs1 Cl6 3.738(3) . ?
Cs1 Cl7 3.818(2) 1_655 ?
Cs1 Cl4 3.969(3) . ?
Cs1 Cl7 4.011(2) 4_656 ?
Cs1 Cl3 4.116(2) 5_656 ?
Cs1 Bi1 4.5538(6) 5_656 ?
Cs1 Bi1 4.6041(7) . ?
Rb1 Cl7 3.251(2) 5_556 ?
Rb1 Cl6 3.313(2) . ?
Rb1 Cl2 3.393(2) 3_646 ?
Rb1 Cl1 3.406(2) 1_455 ?
Rb1 Cl4 3.413(2) . ?
Rb1 Cl3 3.506(2) 5_656 ?
Rb1 Cl5 3.570(3) 1_455 ?
Rb1 Cl5 3.690(3) 8_655 ?
Rb1 Rb2 4.4619(11) 8_655 ?
Rb1 Rb2 4.5462(11) 8 ?
Rb1 Rb2 4.6227(11) . ?
Rb1 Rb1 4.9044(13) 6_557 ?
Rb2 Cl5 3.259(2) 1_455 ?
Rb2 Cl3 3.261(2) 4_556 ?
Rb2 Cl2 3.330(2) . ?
Rb2 Cl1 3.364(2) 3_656 ?
Rb2 Cl4 3.488(2) . ?
Rb2 Cl7 3.561(2) 4_556 ?
Rb2 Cl6 3.583(3) . ?
Rb2 Cl6 3.628(2) 8_665 ?
Rb2 Bi1 4.1988(7) . ?
Rb2 Rb1 4.4619(11) 8_665 ?
Rb2 Rb2 4.5462(14) 6_557 ?
Rb2 Rb1 4.5462(11) 8_565 ?
Bi1 Cl4 2.6703(18) 4_556 ?
Bi1 Cl4 2.6703(18) . ?
Bi1 Cl7 2.6981(19) . ?
Bi1 Cl7 2.6981(19) 4_556 ?
Bi1 Cl3 2.7133(19) 4_556 ?
Bi1 Cl3 2.7133(19) . ?
Bi1 Rb2 4.1988(7) 4_556 ?
Bi1 Cs1 4.5538(6) 5_656 ?
Bi1 Cs1 4.5538(6) 8_665 ?
Bi1 Cs1 4.6041(7) 4_556 ?
Bi2 Cl6 2.679(2) . ?
Bi2 Cl6 2.679(2) 6_557 ?
Bi2 Cl5 2.708(2) . ?
Bi2 Cl5 2.708(2) 6_557 ?
Bi2 Cl1 2.715(3) . ?
Bi2 Cl2 2.730(3) . ?
Cl1 Rb2 3.364(2) 8_655 ?
Cl1 Rb2 3.364(2) 3_646 ?
Cl1 Rb1 3.406(2) 6_657 ?
Cl1 Rb1 3.406(2) 1_655 ?
Cl2 Rb2 3.330(2) 6_557 ?
Cl2 Rb1 3.393(2) 3_656 ?
Cl2 Rb1 3.393(2) 8_665 ?
Cl3 Rb2 3.261(2) 4_556 ?
Cl3 Rb1 3.506(2) 5_656 ?
Cl3 Cs1 3.634(2) 4_556 ?
Cl3 Cs1 4.116(2) 5_656 ?
Cl4 Cs1 3.582(2) 5_656 ?
Cl5 Rb2 3.259(2) 1_655 ?
Cl5 Rb1 3.570(3) 1_655 ?
Cl5 Rb1 3.690(3) 8_665 ?
Cl6 Rb2 3.628(2) 8_655 ?
Cl7 Rb1 3.251(2) 5_556 ?
Cl7 Rb2 3.561(2) 4_556 ?
Cl7 Cs1 3.574(2) 5_656 ?
Cl7 Cs1 3.818(2) 1_455 ?
Cl7 Cs1 4.011(2) 4_456 ?

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
Cl7 Cs1 Cl4 63.01(5) 5_656 5_656 ?
Cl7 Cs1 Cl5 84.96(5) 5_656 . ?
Cl4 Cs1 Cl5 147.20(6) 5_656 . ?
Cl7 Cs1 Cl3 124.60(5) 5_656 . ?
Cl4 Cs1 Cl3 61.63(4) 5_656 . ?
Cl5 Cs1 Cl3 150.11(5) . . ?
Cl7 Cs1 Cl3 169.37(5) 5_656 4_556 ?
Cl4 Cs1 Cl3 122.46(5) 5_656 4_556 ?
Cl5 Cs1 Cl3 90.30(5) . 4_556 ?
Cl3 Cs1 Cl3 61.32(5) . 4_556 ?
Cl7 Cs1 Cl6 85.91(5) 5_656 . ?
Cl4 Cs1 Cl6 120.67(5) 5_656 . ?
Cl5 Cs1 Cl6 59.51(5) . . ?
Cl3 Cs1 Cl6 120.82(5) . . ?
Cl3 Cs1 Cl6 83.49(5) 4_556 . ?
Cl7 Cs1 Cl7 91.38(5) 5_656 1_655 ?
Cl4 Cs1 Cl7 67.05(5) 5_656 1_655 ?
Cl5 Cs1 Cl7 109.46(5) . 1_655 ?
Cl3 Cs1 Cl7 69.45(5) . 1_655 ?
Cl3 Cs1 Cl7 99.18(5) 4_556 1_655 ?
Cl6 Cs1 Cl7 168.81(5) . 1_655 ?
Cl7 Cs1 Cl4 114.10(5) 5_656 . ?
Cl4 Cs1 Cl4 87.95(5) 5_656 . ?
Cl5 Cs1 Cl4 113.12(5) . . ?
Cl3 Cs1 Cl4 62.10(5) . . ?
Cl3 Cs1 Cl4 59.26(4) 4_556 . ?
Cl6 Cs1 Cl4 59.07(5) . . ?
Cl7 Cs1 Cl4 131.52(5) 1_655 . ?
Cl7 Cs1 Cl7 118.26(2) 5_656 4_656 ?
Cl4 Cs1 Cl7 126.08(5) 5_656 4_656 ?
Cl5 Cs1 Cl7 61.86(5) . 4_656 ?
Cl3 Cs1 Cl7 96.01(5) . 4_656 ?
Cl3 Cs1 Cl7 67.11(4) 4_556 4_656 ?
Cl6 Cs1 Cl7 112.96(4) . 4_656 ?
Cl7 Cs1 Cl7 59.08(5) 1_655 4_656 ?
Cl4 Cs1 Cl7 126.24(4) . 4_656 ?
Cl7 Cs1 Cl3 59.99(4) 5_656 5_656 ?
Cl4 Cs1 Cl3 60.82(4) 5_656 5_656 ?
Cl5 Cs1 Cl3 110.39(4) . 5_656 ?
Cl3 Cs1 Cl3 90.80(5) . 5_656 ?
Cl3 Cs1 Cl3 113.323(19) 4_556 5_656 ?
Cl6 Cs1 Cl3 59.88(4) . 5_656 ?
Cl7 Cs1 Cl3 127.46(4) 1_655 5_656 ?
Cl4 Cs1 Cl3 54.24(4) . 5_656 ?
Cl7 Cs1 Cl3 172.17(4) 4_656 5_656 ?
Cl7 Cs1 Bi1 36.31(3) 5_656 5_656 ?
Cl4 Cs1 Bi1 35.87(3) 5_656 5_656 ?
Cl5 Cs1 Bi1 117.56(4) . 5_656 ?
Cl3 Cs1 Bi1 92.04(3) . 5_656 ?
Cl3 Cs1 Bi1 142.54(4) 4_556 5_656 ?
Cl6 Cs1 Bi1 89.68(4) . 5_656 ?
Cl7 Cs1 Bi1 94.56(3) 1_655 5_656 ?
Cl4 Cs1 Bi1 85.71(3) . 5_656 ?
Cl7 Cs1 Bi1 146.91(3) 4_656 5_656 ?
Cl3 Cs1 Bi1 36.03(3) 5_656 5_656 ?
Cl7 Cs1 Bi1 142.74(4) 5_656 . ?
Cl4 Cs1 Bi1 89.57(4) 5_656 . ?
Cl5 Cs1 Bi1 122.33(4) . . ?
Cl3 Cs1 Bi1 36.08(3) . . ?
Cl3 Cs1 Bi1 36.09(3) 4_556 . ?
Cl6 Cs1 Bi1 87.67(4) . . ?
Cl7 Cs1 Bi1 100.92(3) 1_655 . ?
Cl4 Cs1 Bi1 35.32(3) . . ?
Cl7 Cs1 Bi1 98.00(3) 4_656 . ?
Cl3 Cs1 Bi1 85.23(3) 5_656 . ?
Bi1 Cs1 Bi1 107.100(13) 5_656 . ?
Cl7 Rb1 Cl6 139.77(6) 5_556 . ?
Cl7 Rb1 Cl2 133.15(6) 5_556 3_646 ?
Cl6 Rb1 Cl2 73.12(6) . 3_646 ?
Cl7 Rb1 Cl1 96.46(6) 5_556 1_455 ?
Cl6 Rb1 Cl1 121.75(6) . 1_455 ?
Cl2 Rb1 Cl1 76.87(6) 3_646 1_455 ?
Cl7 Rb1 Cl4 75.72(6) 5_556 . ?
Cl6 Rb1 Cl4 68.88(6) . . ?
Cl2 Rb1 Cl4 140.34(7) 3_646 . ?
Cl1 Rb1 Cl4 133.89(6) 1_455 . ?
Cl7 Rb1 Cl3 77.58(6) 5_556 5_656 ?
Cl6 Rb1 Cl3 70.40(6) . 5_656 ?
Cl2 Rb1 Cl3 92.64(5) 3_646 5_656 ?
Cl1 Rb1 Cl3 159.30(6) 1_455 5_656 ?
Cl4 Rb1 Cl3 64.40(5) . 5_656 ?
Cl7 Rb1 Cl5 90.61(6) 5_556 1_455 ?
Cl6 Rb1 Cl5 93.64(6) . 1_455 ?
Cl2 Rb1 Cl5 125.75(5) 3_646 1_455 ?
Cl1 Rb1 Cl5 66.22(5) 1_455 1_455 ?
Cl4 Rb1 Cl5 68.48(5) . 1_455 ?
Cl3 Rb1 Cl5 132.87(5) 5_656 1_455 ?
Cl7 Rb1 Cl5 68.71(5) 5_556 8_655 ?
Cl6 Rb1 Cl5 133.87(6) . 8_655 ?
Cl2 Rb1 Cl5 65.76(5) 3_646 8_655 ?
Cl1 Rb1 Cl5 68.39(6) 1_455 8_655 ?
Cl4 Rb1 Cl5 140.50(5) . 8_655 ?
Cl3 Rb1 Cl5 91.07(5) 5_656 8_655 ?
Cl5 Rb1 Cl5 126.99(3) 1_455 8_655 ?
Cl7 Rb1 Rb2 116.59(5) 5_556 8_655 ?
Cl6 Rb1 Rb2 53.18(4) . 8_655 ?
Cl2 Rb1 Rb2 47.82(4) 3_646 8_655 ?
Cl1 Rb1 Rb2 124.53(4) 1_455 8_655 ?
Cl4 Rb1 Rb2 98.34(5) . 8_655 ?
Cl3 Rb1 Rb2 46.42(3) 5_656 8_655 ?
Cl5 Rb1 Rb2 146.60(4) 1_455 8_655 ?
Cl5 Rb1 Rb2 83.13(4) 8_655 8_655 ?
Cl7 Rb1 Rb2 51.11(4) 5_556 8 ?
Cl6 Rb1 Rb2 168.97(4) . 8 ?
Cl2 Rb1 Rb2 99.92(5) 3_646 8 ?
Cl1 Rb1 Rb2 47.42(4) 1_455 8 ?
Cl4 Rb1 Rb2 119.31(5) . 8 ?
Cl3 Rb1 Rb2 119.15(4) 5_656 8 ?
Cl5 Rb1 Rb2 83.46(4) 1_455 8 ?
Cl5 Rb1 Rb2 45.14(4) 8_655 8 ?
Rb2 Rb1 Rb2 128.23(3) 8_655 8 ?
Cl7 Rb1 Rb2 115.28(4) 5_556 . ?
Cl6 Rb1 Rb2 50.44(4) . . ?
Cl2 Rb1 Rb2 111.53(5) 3_646 . ?
Cl1 Rb1 Rb2 100.34(5) 1_455 . ?
Cl4 Rb1 Rb2 48.64(4) . . ?
Cl3 Rb1 Rb2 100.11(4) 5_656 . ?
Cl5 Rb1 Rb2 44.61(4) 1_455 . ?
Cl5 Rb1 Rb2 168.67(4) 8_655 . ?
Rb2 Rb1 Rb2 103.270(17) 8_655 . ?
Rb2 Rb1 Rb2 128.02(2) 8 . ?
Cl7 Rb1 Rb1 138.84(4) 5_556 6_557 ?
Cl6 Rb1 Rb1 81.33(4) . 6_557 ?
Cl2 Rb1 Rb1 43.72(4) 3_646 6_557 ?
Cl1 Rb1 Rb1 43.94(4) 1_455 6_557 ?
Cl4 Rb1 Rb1 136.31(4) . 6_557 ?
Cl3 Rb1 Rb1 134.11(3) 5_656 6_557 ?
Cl5 Rb1 Rb1 82.87(4) 1_455 6_557 ?
Cl5 Rb1 Rb1 83.10(3) 8_655 6_557 ?
Rb2 Rb1 Rb1 87.699(12) 8_655 6_557 ?
Rb2 Rb1 Rb1 87.742(12) 8 6_557 ?
Rb2 Rb1 Rb1 87.779(12) . 6_557 ?
Cl5 Rb2 Cl3 131.21(5) 1_455 4_556 ?
Cl5 Rb2 Cl2 128.29(6) 1_455 . ?
Cl3 Rb2 Cl2 98.41(5) 4_556 . ?
Cl5 Rb2 Cl1 74.19(6) 1_455 3_656 ?
Cl3 Rb2 Cl1 132.04(6) 4_556 3_656 ?
Cl2 Rb2 Cl1 83.11(6) . 3_656 ?
Cl5 Rb2 Cl4 71.19(6) 1_455 . ?
Cl3 Rb2 Cl4 67.81(5) 4_556 . ?
Cl2 Rb2 Cl4 129.39(6) . . ?
Cl1 Rb2 Cl4 142.97(7) 3_656 . ?
Cl5 Rb2 Cl7 70.30(6) 1_455 4_556 ?
Cl3 Rb2 Cl7 69.03(5) 4_556 4_556 ?
Cl2 Rb2 Cl7 157.37(6) . 4_556 ?
Cl1 Rb2 Cl7 91.59(5) 3_656 4_556 ?
Cl4 Rb2 Cl7 64.72(5) . 4_556 ?
Cl5 Rb2 Cl6 94.34(6) 1_455 . ?
Cl3 Rb2 Cl6 91.53(6) 4_556 . ?
Cl2 Rb2 Cl6 67.04(5) . . ?
Cl1 Rb2 Cl6 131.04(5) 3_656 . ?
Cl4 Rb2 Cl6 65.09(5) . . ?
Cl7 Rb2 Cl6 129.80(5) 4_556 . ?
Cl5 Rb2 Cl6 134.00(6) 1_455 8_665 ?
Cl3 Rb2 Cl6 69.40(5) 4_556 8_665 ?
Cl2 Rb2 Cl6 69.92(6) . 8_665 ?
Cl1 Rb2 Cl6 66.30(6) 3_656 8_665 ?
Cl4 Rb2 Cl6 135.09(5) . 8_665 ?
Cl7 Rb2 Cl6 87.78(6) 4_556 8_665 ?
Cl6 Rb2 Cl6 129.26(3) . 8_665 ?
Cl5 Rb2 Bi1 90.97(4) 1_455 . ?
Cl3 Rb2 Bi1 40.25(3) 4_556 . ?
Cl2 Rb2 Bi1 136.79(4) . . ?
Cl1 Rb2 Bi1 130.49(4) 3_656 . ?
Cl4 Rb2 Bi1 39.30(3) . . ?
Cl7 Rb2 Bi1 39.63(3) 4_556 . ?
Cl6 Rb2 Bi1 96.31(4) . . ?
Cl6 Rb2 Bi1 97.03(4) 8_665 . ?
Cl5 Rb2 Rb1 177.26(5) 1_455 8_665 ?
Cl3 Rb2 Rb1 51.16(4) 4_556 8_665 ?
Cl2 Rb2 Rb1 49.02(4) . 8_665 ?
Cl1 Rb2 Rb1 105.22(5) 3_656 8_665 ?
Cl4 Rb2 Rb1 109.97(5) . 8_665 ?
Cl7 Rb2 Rb1 112.43(4) 4_556 8_665 ?
Cl6 Rb2 Rb1 84.04(4) . 8_665 ?
Cl6 Rb2 Rb1 46.96(4) 8_665 8_665 ?
Bi1 Rb2 Rb1 91.406(17) . 8_665 ?
Cl5 Rb2 Rb2 85.35(4) 1_455 6_557 ?
Cl3 Rb2 Rb2 143.44(4) 4_556 6_557 ?
Cl2 Rb2 Rb2 46.96(4) . 6_557 ?
Cl1 Rb2 Rb2 47.49(4) 3_656 6_557 ?
Cl4 Rb2 Rb2 139.36(3) . 6_557 ?
Cl7 Rb2 Rb2 137.54(3) 4_556 6_557 ?
Cl6 Rb2 Rb2 84.88(4) . 6_557 ?
Cl6 Rb2 Rb2 84.94(4) 8_665 6_557 ?
Bi1 Rb2 Rb2 176.209(12) . 6_557 ?
Rb1 Rb2 Rb2 92.301(12) 8_665 6_557 ?
Cl5 Rb2 Rb1 53.39(5) 1_455 8_565 ?
Cl3 Rb2 Rb1 108.84(5) 4_556 8_565 ?
Cl2 Rb2 Rb1 130.81(4) . 8_565 ?
Cl1 Rb2 Rb1 48.21(4) 3_656 8_565 ?
Cl4 Rb2 Rb1 99.05(5) . 8_565 ?
Cl7 Rb2 Rb1 45.28(3) 4_556 8_565 ?
Cl6 Rb2 Rb1 147.72(4) . 8_565 ?
Cl6 Rb2 Rb1 82.23(4) 8_665 8_565 ?
Bi1 Rb2 Rb1 84.815(16) . 8_565 ?
Rb1 Rb2 Rb1 128.23(2) 8_665 8_565 ?
Rb2 Rb2 Rb1 92.258(12) 6_557 8_565 ?
Cl4 Bi1 Cl4 176.62(11) 4_556 . ?
Cl4 Bi1 Cl7 89.32(7) 4_556 . ?
Cl4 Bi1 Cl7 88.32(7) . . ?
Cl4 Bi1 Cl7 88.32(7) 4_556 4_556 ?
Cl4 Bi1 Cl7 89.32(7) . 4_556 ?
Cl7 Bi1 Cl7 91.45(10) . 4_556 ?
Cl4 Bi1 Cl3 93.59(7) 4_556 4_556 ?
Cl4 Bi1 Cl3 88.89(7) . 4_556 ?
Cl7 Bi1 Cl3 175.98(7) . 4_556 ?
Cl7 Bi1 Cl3 91.40(7) 4_556 4_556 ?
Cl4 Bi1 Cl3 88.89(7) 4_556 . ?
Cl4 Bi1 Cl3 93.59(7) . . ?
Cl7 Bi1 Cl3 91.40(7) . . ?
Cl7 Bi1 Cl3 175.98(7) 4_556 . ?
Cl3 Bi1 Cl3 85.89(9) 4_556 . ?
Cl4 Bi1 Rb2 55.84(5) 4_556 4_556 ?
Cl4 Bi1 Rb2 124.42(5) . 4_556 ?
Cl7 Bi1 Rb2 57.33(5) . 4_556 ?
Cl7 Bi1 Rb2 129.01(5) 4_556 4_556 ?
Cl3 Bi1 Rb2 122.42(4) 4_556 4_556 ?
Cl3 Bi1 Rb2 50.94(4) . 4_556 ?
Cl4 Bi1 Rb2 124.42(5) 4_556 . ?
Cl4 Bi1 Rb2 55.84(5) . . ?
Cl7 Bi1 Rb2 129.01(5) . . ?
Cl7 Bi1 Rb2 57.33(5) 4_556 . ?
Cl3 Bi1 Rb2 50.94(4) 4_556 . ?
Cl3 Bi1 Rb2 122.42(4) . . ?
Rb2 Bi1 Rb2 172.64(2) 4_556 . ?
Cl4 Bi1 Cs1 127.85(5) 4_556 5_656 ?
Cl4 Bi1 Cs1 51.82(5) . 5_656 ?
Cl7 Bi1 Cs1 51.66(5) . 5_656 ?
Cl7 Bi1 Cs1 120.86(5) 4_556 5_656 ?
Cl3 Bi1 Cs1 124.34(5) 4_556 5_656 ?
Cl3 Bi1 Cs1 63.16(5) . 5_656 ?
Rb2 Bi1 Cs1 72.945(13) 4_556 5_656 ?
Rb2 Bi1 Cs1 107.648(13) . 5_656 ?
Cl4 Bi1 Cs1 51.82(5) 4_556 8_665 ?
Cl4 Bi1 Cs1 127.85(5) . 8_665 ?
Cl7 Bi1 Cs1 120.86(5) . 8_665 ?
Cl7 Bi1 Cs1 51.66(5) 4_556 8_665 ?
Cl3 Bi1 Cs1 63.16(5) 4_556 8_665 ?
Cl3 Bi1 Cs1 124.34(5) . 8_665 ?
Rb2 Bi1 Cs1 107.648(13) 4_556 8_665 ?
Rb2 Bi1 Cs1 72.945(13) . 8_665 ?
Cs1 Bi1 Cs1 171.179(19) 5_656 8_665 ?
Cl4 Bi1 Cs1 59.24(6) 4_556 4_556 ?
Cl4 Bi1 Cs1 124.14(6) . 4_556 ?
Cl7 Bi1 Cs1 128.25(5) . 4_556 ?
Cl7 Bi1 Cs1 123.92(5) 4_556 4_556 ?
Cl3 Bi1 Cs1 51.71(4) 4_556 4_556 ?
Cl3 Bi1 Cs1 52.08(5) . 4_556 ?
Rb2 Bi1 Cs1 70.923(13) 4_556 4_556 ?
Rb2 Bi1 Cs1 102.626(14) . 4_556 ?
Cs1 Bi1 Cs1 115.070(11) 5_656 4_556 ?
Cs1 Bi1 Cs1 72.900(13) 8_665 4_556 ?
Cl4 Bi1 Cs1 124.14(6) 4_556 . ?
Cl4 Bi1 Cs1 59.24(6) . . ?
Cl7 Bi1 Cs1 123.92(5) . . ?
Cl7 Bi1 Cs1 128.25(5) 4_556 . ?
Cl3 Bi1 Cs1 52.08(5) 4_556 . ?
Cl3 Bi1 Cs1 51.71(4) . . ?
Rb2 Bi1 Cs1 102.626(14) 4_556 . ?
Rb2 Bi1 Cs1 70.923(13) . . ?
Cs1 Bi1 Cs1 72.900(13) 5_656 . ?
Cs1 Bi1 Cs1 115.069(11) 8_665 . ?
Cs1 Bi1 Cs1 65.064(17) 4_556 . ?
Cl6 Bi2 Cl6 93.60(11) . 6_557 ?
Cl6 Bi2 Cl5 85.31(8) . . ?
Cl6 Bi2 Cl5 178.90(7) 6_557 . ?
Cl6 Bi2 Cl5 178.90(7) . 6_557 ?
Cl6 Bi2 Cl5 85.31(8) 6_557 6_557 ?
Cl5 Bi2 Cl5 95.77(10) . 6_557 ?
Cl6 Bi2 Cl1 90.46(7) . . ?
Cl6 Bi2 Cl1 90.46(7) 6_557 . ?
Cl5 Bi2 Cl1 89.35(7) . . ?
Cl5 Bi2 Cl1 89.35(7) 6_557 . ?
Cl6 Bi2 Cl2 89.96(7) . . ?
Cl6 Bi2 Cl2 89.96(7) 6_557 . ?
Cl5 Bi2 Cl2 90.24(7) . . ?
Cl5 Bi2 Cl2 90.24(7) 6_557 . ?
Cl1 Bi2 Cl2 179.39(9) . . ?
Bi2 Cl1 Rb2 104.51(8) . 8_655 ?
Bi2 Cl1 Rb2 104.51(8) . 3_646 ?
Rb2 Cl1 Rb2 85.03(7) 8_655 3_646 ?
Bi2 Cl1 Rb1 104.20(6) . 6_657 ?
Rb2 Cl1 Rb1 151.05(8) 8_655 6_657 ?
Rb2 Cl1 Rb1 84.37(3) 3_646 6_657 ?
Bi2 Cl1 Rb1 104.20(6) . 1_655 ?
Rb2 Cl1 Rb1 84.37(3) 8_655 1_655 ?
Rb2 Cl1 Rb1 151.05(8) 3_646 1_655 ?
Rb1 Cl1 Rb1 92.11(8) 6_657 1_655 ?
Bi2 Cl2 Rb2 104.09(6) . . ?
Bi2 Cl2 Rb2 104.09(6) . 6_557 ?
Rb2 Cl2 Rb2 86.09(7) . 6_557 ?
Bi2 Cl2 Rb1 105.49(7) . 3_656 ?
Rb2 Cl2 Rb1 150.17(9) . 3_656 ?
Rb2 Cl2 Rb1 83.16(3) 6_557 3_656 ?
Bi2 Cl2 Rb1 105.49(7) . 8_665 ?
Rb2 Cl2 Rb1 83.16(3) . 8_665 ?
Rb2 Cl2 Rb1 150.17(9) 6_557 8_665 ?
Rb1 Cl2 Rb1 92.57(7) 3_656 8_665 ?
Bi1 Cl3 Rb2 88.81(6) . 4_556 ?
Bi1 Cl3 Rb1 171.18(7) . 5_656 ?
Rb2 Cl3 Rb1 82.41(4) 4_556 5_656 ?
Bi1 Cl3 Cs1 92.22(5) . . ?
Rb2 Cl3 Cs1 177.85(7) 4_556 . ?
Rb1 Cl3 Cs1 96.58(5) 5_656 . ?
Bi1 Cl3 Cs1 91.84(5) . 4_556 ?
Rb2 Cl3 Cs1 95.70(5) 4_556 4_556 ?
Rb1 Cl3 Cs1 88.11(5) 5_656 4_556 ?
Cs1 Cl3 Cs1 86.16(5) . 4_556 ?
Bi1 Cl3 Cs1 80.81(5) . 5_656 ?
Rb2 Cl3 Cs1 89.09(5) 4_556 5_656 ?
Rb1 Cl3 Cs1 99.91(5) 5_656 5_656 ?
Cs1 Cl3 Cs1 89.20(5) . 5_656 ?
Cs1 Cl3 Cs1 171.16(6) 4_556 5_656 ?
Bi1 Cl4 Rb1 164.59(9) . . ?
Bi1 Cl4 Rb2 84.86(5) . . ?
Rb1 Cl4 Rb2 84.10(5) . . ?
Bi1 Cl4 Cs1 92.31(6) . 5_656 ?
Rb1 Cl4 Cs1 98.92(5) . 5_656 ?
Rb2 Cl4 Cs1 176.88(7) . 5_656 ?
Bi1 Cl4 Cs1 85.44(6) . . ?
Rb1 Cl4 Cs1 104.54(6) . . ?
Rb2 Cl4 Cs1 86.42(5) . . ?
Cs1 Cl4 Cs1 92.05(5) 5_656 . ?
Bi2 Cl5 Rb2 136.69(8) . 1_655 ?
Bi2 Cl5 Rb1 100.23(7) . 1_655 ?
Rb2 Cl5 Rb1 85.08(6) 1_655 1_655 ?
Bi2 Cl5 Cs1 108.95(7) . . ?
Rb2 Cl5 Cs1 114.19(6) 1_655 . ?
Rb1 Cl5 Cs1 88.04(5) 1_655 . ?
Bi2 Cl5 Rb1 98.51(7) . 8_665 ?
Rb2 Cl5 Rb1 81.47(5) 1_655 8_665 ?
Rb1 Cl5 Rb1 161.26(6) 1_655 8_665 ?
Cs1 Cl5 Rb1 85.66(6) . 8_665 ?
Bi2 Cl6 Rb1 141.81(9) . . ?
Bi2 Cl6 Rb2 98.85(6) . . ?
Rb1 Cl6 Rb2 84.09(6) . . ?
Bi2 Cl6 Rb2 98.64(7) . 8_655 ?
Rb1 Cl6 Rb2 79.86(5) . 8_655 ?
Rb2 Cl6 Rb2 162.11(7) . 8_655 ?
Bi2 Cl6 Cs1 106.21(7) . . ?
Rb1 Cl6 Cs1 111.93(6) . . ?
Rb2 Cl6 Cs1 88.67(5) . . ?
Rb2 Cl6 Cs1 90.02(6) 8_655 . ?
Bi1 Cl7 Rb1 165.72(8) . 5_556 ?
Bi1 Cl7 Rb2 83.04(6) . 4_556 ?
Rb1 Cl7 Rb2 83.61(5) 5_556 4_556 ?
Bi1 Cl7 Cs1 92.03(6) . 5_656 ?
Rb1 Cl7 Cs1 93.88(5) 5_556 5_656 ?
Rb2 Cl7 Cs1 93.83(6) 4_556 5_656 ?
Bi1 Cl7 Cs1 95.87(6) . 1_455 ?
Rb1 Cl7 Cs1 97.26(6) 5_556 1_455 ?
Rb2 Cl7 Cs1 177.35(7) 4_556 1_455 ?
Cs1 Cl7 Cs1 88.62(5) 5_656 1_455 ?
Bi1 Cl7 Cs1 91.56(5) . 4_456 ?
Rb1 Cl7 Cs1 85.60(5) 5_556 4_456 ?
Rb2 Cl7 Cs1 99.17(5) 4_556 4_456 ?
Cs1 Cl7 Cs1 166.84(7) 5_656 4_456 ?
Cs1 Cl7 Cs1 78.42(5) 1_455 4_456 ?

_diffrn_measured_fraction_theta_max 0.816
_diffrn_reflns_theta_full        30.85
_diffrn_measured_fraction_theta_full 0.816
_refine_diff_density_max         4.124
_refine_diff_density_min         -2.093
_refine_diff_density_rms         0.284
####################################################################### 
# 
# 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_exp_9105
_database_code_depnum_ccdc_archive 'CCDC 2192861'
loop_
_audit_author_name
_audit_author_address
'Mingjun Xia'
;Technical Institute of Physics and Chemistry, CAS
China
;
_audit_update_record             
;
2022-07-27 deposited with the CCDC.	2022-10-17 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'Bi Cl6 Cs Rb2'
_chemical_formula_weight         725.53

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
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'
Cs Cs -0.3680 2.1192 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Bi Bi -4.1077 10.2566 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           ?
_symmetry_space_group_name_H-M   ?

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, z+1/2'
'-x, y+1/2, -z+1/2'
'x, -y+1/2, -z'
'-x, -y, -z'
'x, y, -z-1/2'
'x, -y-1/2, z-1/2'
'-x, y-1/2, z'

_cell_length_a                   8.0294(3)
_cell_length_b                   12.7822(5)
_cell_length_c                   25.7036(8)
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_volume                     2638.05(16)
_cell_formula_units_Z            8
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    ?
_cell_measurement_theta_min      ?
_cell_measurement_theta_max      ?

_exptl_crystal_description       ?
_exptl_crystal_colour            ?
_exptl_crystal_size_max          ?
_exptl_crystal_size_mid          ?
_exptl_crystal_size_min          ?
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    3.654
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2512
_exptl_absorpt_coefficient_mu    24.578
_exptl_absorpt_correction_type   ?
_exptl_absorpt_correction_T_min  ?
_exptl_absorpt_correction_T_max  ?
_exptl_absorpt_process_details   ?

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  ?
_diffrn_measurement_method       ?
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            14787
_diffrn_reflns_av_R_equivalents  0.0502
_diffrn_reflns_av_sigmaI/netI    0.0401
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_h_max       8
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_l_min       -29
_diffrn_reflns_limit_l_max       32
_diffrn_reflns_theta_min         2.54
_diffrn_reflns_theta_max         26.37
_reflns_number_total             2752
_reflns_number_gt                2458
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
; 
 Refinement of F² against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0434P)²+42.1224P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    mixed
_refine_ls_extinction_method     SHELXL
_refine_ls_extinction_coef       0.00033(4)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_number_reflns         2752
_refine_ls_number_parameters     97
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0401
_refine_ls_R_factor_gt           0.0351
_refine_ls_wR_factor_ref         0.0908
_refine_ls_wR_factor_gt          0.0885
_refine_ls_goodness_of_fit_ref   1.037
_refine_ls_restrained_S_all      1.037
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Cs1 Cs 0.76344(7) 0.08740(4) 0.54989(2) 0.01639(16) Uani 1 1 d . . .
Rb1 Rb 0.18798(9) -0.09316(6) 0.65597(3) 0.00598(18) Uani 1 1 d . . .
Rb2 Rb 0.31775(9) 0.25467(6) 0.66154(3) 0.00982(18) Uani 1 1 d . . .
Bi1 Bi 0.28459(5) 0.2500 0.5000 0.00435(13) Uani 1 2 d S . .
Bi2 Bi 0.75591(5) 0.08055(3) 0.7500 0.00718(14) Uani 1 2 d S . .
Cl1 Cl 0.8984(4) -0.1117(2) 0.7500 0.0109(5) Uani 1 2 d S . .
Cl2 Cl 0.6143(3) 0.2740(2) 0.7500 0.0102(5) Uani 1 2 d S . .
Cl3 Cl 0.5321(2) 0.17446(16) 0.43892(7) 0.0123(4) Uani 1 1 d . . .
Cl4 Cl 0.2729(3) 0.07979(15) 0.56008(8) 0.0157(4) Uani 1 1 d . . .
Cl5 Cl 0.9633(3) 0.13795(18) 0.67174(8) 0.0197(5) Uani 1 1 d . . .
Cl6 Cl 0.5483(3) 0.02220(17) 0.67374(8) 0.0196(5) Uani 1 1 d . . .
Cl7 Cl 0.0497(2) 0.16138(16) 0.43936(8) 0.0128(4) 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
Cs1 Cl7 3.527(2) 5_656 ?
Cs1 Cl4 3.555(2) 5_656 ?
Cs1 Cl3 3.578(2) 4_556 ?
Cs1 Cl5 3.578(2) . ?
Cs1 Cl3 3.581(2) . ?
Cs1 Cl6 3.717(2) . ?
Cs1 Cl7 3.775(2) 1_655 ?
Cs1 Cl4 3.949(2) . ?
Cs1 Cl7 3.959(2) 4_656 ?
Cs1 Cl4 4.100(2) 1_655 ?
Cs1 Cl3 4.113(2) 5_656 ?
Cs1 Bi1 4.5158(6) 5_656 ?
Rb1 Cl7 3.226(2) 5_556 ?
Rb1 Cl6 3.279(2) . ?
Rb1 Cl2 3.353(2) 3_646 ?
Rb1 Cl1 3.362(2) 1_455 ?
Rb1 Cl4 3.380(2) . ?
Rb1 Cl3 3.476(2) 5_656 ?
Rb1 Cl5 3.485(3) 1_455 ?
Rb1 Cl5 3.668(3) 8_655 ?
Rb1 Rb2 4.4219(10) 8_655 ?
Rb1 Rb2 4.5048(10) 8 ?
Rb1 Rb2 4.5688(11) . ?
Rb1 Rb1 4.8336(14) 6_557 ?
Rb2 Cl5 3.224(2) 1_455 ?
Rb2 Cl3 3.233(2) 4_556 ?
Rb2 Cl2 3.301(2) . ?
Rb2 Cl1 3.332(2) 3_656 ?
Rb2 Cl4 3.454(2) . ?
Rb2 Cl6 3.515(2) . ?
Rb2 Cl7 3.537(2) 4_556 ?
Rb2 Cl6 3.599(2) 8_665 ?
Rb2 Bi1 4.1611(7) . ?
Rb2 Rb1 4.4219(11) 8_665 ?
Rb2 Rb1 4.5048(10) 8_565 ?
Rb2 Rb2 4.5475(15) 6_557 ?
Bi1 Cl4 2.670(2) 4_556 ?
Bi1 Cl4 2.670(2) . ?
Bi1 Cl7 2.6963(19) . ?
Bi1 Cl7 2.6963(19) 4_556 ?
Bi1 Cl3 2.710(2) 4_556 ?
Bi1 Cl3 2.710(2) . ?
Bi1 Rb2 4.1611(7) 4_556 ?
Bi1 Cs1 4.5158(6) 5_656 ?
Bi1 Cs1 4.5158(6) 8_665 ?
Bi1 Cs1 4.5549(6) 4_556 ?
Bi2 Cl6 2.679(2) . ?
Bi2 Cl6 2.679(2) 6_557 ?
Bi2 Cl1 2.710(3) . ?
Bi2 Cl5 2.712(2) 6_557 ?
Bi2 Cl5 2.712(2) . ?
Bi2 Cl2 2.722(3) . ?
Cl1 Rb2 3.332(2) 8_655 ?
Cl1 Rb2 3.332(2) 3_646 ?
Cl1 Rb1 3.362(2) 6_657 ?
Cl1 Rb1 3.362(2) 1_655 ?
Cl2 Rb2 3.301(2) 6_557 ?
Cl2 Rb1 3.353(2) 3_656 ?
Cl2 Rb1 3.353(2) 8_665 ?
Cl3 Rb2 3.233(2) 4_556 ?
Cl3 Rb1 3.476(2) 5_656 ?
Cl3 Cs1 3.578(2) 4_556 ?
Cl3 Cs1 4.113(2) 5_656 ?
Cl4 Cs1 3.555(2) 5_656 ?
Cl4 Cs1 4.100(2) 1_455 ?
Cl5 Rb2 3.224(2) 1_655 ?
Cl5 Rb1 3.485(3) 1_655 ?
Cl5 Rb1 3.668(3) 8_665 ?
Cl6 Rb2 3.599(2) 8_655 ?
Cl7 Rb1 3.226(2) 5_556 ?
Cl7 Cs1 3.527(2) 5_656 ?
Cl7 Rb2 3.537(2) 4_556 ?
Cl7 Cs1 3.775(2) 1_455 ?
Cl7 Cs1 3.959(2) 4_456 ?

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
Cl7 Cs1 Cl4 63.59(5) 5_656 5_656 ?
Cl7 Cs1 Cl3 169.03(5) 5_656 4_556 ?
Cl4 Cs1 Cl3 122.19(5) 5_656 4_556 ?
Cl7 Cs1 Cl5 84.46(5) 5_656 . ?
Cl4 Cs1 Cl5 147.27(5) 5_656 . ?
Cl3 Cs1 Cl5 90.51(5) 4_556 . ?
Cl7 Cs1 Cl3 124.28(5) 5_656 . ?
Cl4 Cs1 Cl3 60.73(5) 5_656 . ?
Cl3 Cs1 Cl3 61.98(6) 4_556 . ?
Cl5 Cs1 Cl3 150.89(5) . . ?
Cl7 Cs1 Cl6 85.90(5) 5_656 . ?
Cl4 Cs1 Cl6 120.54(5) 5_656 . ?
Cl3 Cs1 Cl6 83.14(5) 4_556 . ?
Cl5 Cs1 Cl6 59.95(5) . . ?
Cl3 Cs1 Cl6 120.71(5) . . ?
Cl7 Cs1 Cl7 91.48(5) 5_656 1_655 ?
Cl4 Cs1 Cl7 66.55(5) 5_656 1_655 ?
Cl3 Cs1 Cl7 99.41(5) 4_556 1_655 ?
Cl5 Cs1 Cl7 109.91(5) . 1_655 ?
Cl3 Cs1 Cl7 68.81(4) . 1_655 ?
Cl6 Cs1 Cl7 169.70(5) . 1_655 ?
Cl7 Cs1 Cl4 113.39(5) 5_656 . ?
Cl4 Cs1 Cl4 87.49(5) 5_656 . ?
Cl3 Cs1 Cl4 59.85(4) 4_556 . ?
Cl5 Cs1 Cl4 113.19(5) . . ?
Cl3 Cs1 Cl4 62.81(5) . . ?
Cl6 Cs1 Cl4 58.27(5) . . ?
Cl7 Cs1 Cl4 131.56(4) 1_655 . ?
Cl7 Cs1 Cl7 118.614(18) 5_656 4_656 ?
Cl4 Cs1 Cl7 126.20(5) 5_656 4_656 ?
Cl3 Cs1 Cl7 66.78(4) 4_556 4_656 ?
Cl5 Cs1 Cl7 62.10(5) . 4_656 ?
Cl3 Cs1 Cl7 96.01(5) . 4_656 ?
Cl6 Cs1 Cl7 113.08(4) . 4_656 ?
Cl7 Cs1 Cl7 59.72(5) 1_655 4_656 ?
Cl4 Cs1 Cl7 126.48(4) . 4_656 ?
Cl7 Cs1 Cl4 63.20(4) 5_656 1_655 ?
Cl4 Cs1 Cl4 96.79(5) 5_656 1_655 ?
Cl3 Cs1 Cl4 122.22(4) 4_556 1_655 ?
Cl5 Cs1 Cl4 60.06(5) . 1_655 ?
Cl3 Cs1 Cl4 125.15(5) . 1_655 ?
Cl6 Cs1 Cl4 113.81(5) . 1_655 ?
Cl7 Cs1 Cl4 56.39(4) 1_655 1_655 ?
Cl4 Cs1 Cl4 172.04(6) . 1_655 ?
Cl7 Cs1 Cl4 55.63(4) 4_656 1_655 ?
Cl7 Cs1 Cl3 60.41(4) 5_656 5_656 ?
Cl4 Cs1 Cl3 61.26(5) 5_656 5_656 ?
Cl3 Cs1 Cl3 112.782(17) 4_556 5_656 ?
Cl5 Cs1 Cl3 110.15(4) . 5_656 ?
Cl3 Cs1 Cl3 90.53(5) . 5_656 ?
Cl6 Cs1 Cl3 59.30(4) . 5_656 ?
Cl7 Cs1 Cl3 127.43(4) 1_655 5_656 ?
Cl4 Cs1 Cl3 53.12(4) . 5_656 ?
Cl7 Cs1 Cl3 171.99(4) 4_656 5_656 ?
Cl4 Cs1 Cl3 123.49(4) 1_655 5_656 ?
Cl7 Cs1 Bi1 36.63(3) 5_656 5_656 ?
Cl4 Cs1 Bi1 36.22(3) 5_656 5_656 ?
Cl3 Cs1 Bi1 142.28(4) 4_556 5_656 ?
Cl5 Cs1 Bi1 117.34(4) . 5_656 ?
Cl3 Cs1 Bi1 91.51(3) . 5_656 ?
Cl6 Cs1 Bi1 89.39(4) . 5_656 ?
Cl7 Cs1 Bi1 94.45(3) 1_655 5_656 ?
Cl4 Cs1 Bi1 84.84(3) . 5_656 ?
Cl7 Cs1 Bi1 147.58(3) 4_656 5_656 ?
Cl4 Cs1 Bi1 94.63(3) 1_655 5_656 ?
Cl3 Cs1 Bi1 36.23(3) 5_656 5_656 ?
Cl7 Rb1 Cl6 138.53(6) 5_556 . ?
Cl7 Rb1 Cl2 133.69(6) 5_556 3_646 ?
Cl6 Rb1 Cl2 73.11(6) . 3_646 ?
Cl7 Rb1 Cl1 96.77(5) 5_556 1_455 ?
Cl6 Rb1 Cl1 122.80(6) . 1_455 ?
Cl2 Rb1 Cl1 76.93(6) 3_646 1_455 ?
Cl7 Rb1 Cl4 75.06(5) 5_556 . ?
Cl6 Rb1 Cl4 68.26(5) . . ?
Cl2 Rb1 Cl4 139.57(6) 3_646 . ?
Cl1 Rb1 Cl4 135.20(6) 1_455 . ?
Cl7 Rb1 Cl3 76.62(5) 5_556 5_656 ?
Cl6 Rb1 Cl3 70.23(5) . 5_656 ?
Cl2 Rb1 Cl3 92.76(5) 3_646 5_656 ?
Cl1 Rb1 Cl3 158.54(6) 1_455 5_656 ?
Cl4 Rb1 Cl3 63.48(5) . 5_656 ?
Cl7 Rb1 Cl5 90.64(6) 5_556 1_455 ?
Cl6 Rb1 Cl5 93.40(6) . 1_455 ?
Cl2 Rb1 Cl5 126.19(5) 3_646 1_455 ?
Cl1 Rb1 Cl5 67.54(6) 1_455 1_455 ?
Cl4 Rb1 Cl5 68.58(5) . 1_455 ?
Cl3 Rb1 Cl5 132.05(5) 5_656 1_455 ?
Cl7 Rb1 Cl5 68.58(5) 5_556 8_655 ?
Cl6 Rb1 Cl5 134.28(6) . 8_655 ?
Cl2 Rb1 Cl5 66.59(6) 3_646 8_655 ?
Cl1 Rb1 Cl5 68.01(6) 1_455 8_655 ?
Cl4 Rb1 Cl5 139.48(5) . 8_655 ?
Cl3 Rb1 Cl5 90.66(5) 5_656 8_655 ?
Cl5 Rb1 Cl5 127.59(3) 1_455 8_655 ?
Cl7 Rb1 Rb2 115.89(4) 5_556 8_655 ?
Cl6 Rb1 Rb2 53.24(4) . 8_655 ?
Cl2 Rb1 Rb2 47.86(4) 3_646 8_655 ?
Cl1 Rb1 Rb2 124.51(4) 1_455 8_655 ?
Cl4 Rb1 Rb2 97.49(4) . 8_655 ?
Cl3 Rb1 Rb2 46.44(3) 5_656 8_655 ?
Cl5 Rb1 Rb2 146.48(4) 1_455 8_655 ?
Cl5 Rb1 Rb2 83.19(4) 8_655 8_655 ?
Cl7 Rb1 Rb2 51.26(4) 5_556 8 ?
Cl6 Rb1 Rb2 170.07(4) . 8 ?
Cl2 Rb1 Rb2 100.68(5) 3_646 8 ?
Cl1 Rb1 Rb2 47.42(4) 1_455 8 ?
Cl4 Rb1 Rb2 119.16(4) . 8 ?
Cl3 Rb1 Rb2 118.43(4) 5_656 8 ?
Cl5 Rb1 Rb2 84.01(4) 1_455 8 ?
Cl5 Rb1 Rb2 45.04(4) 8_655 8 ?
Rb2 Rb1 Rb2 128.18(3) 8_655 8 ?
Cl7 Rb1 Rb2 114.94(4) 5_556 . ?
Cl6 Rb1 Rb2 49.97(4) . . ?
Cl2 Rb1 Rb2 111.23(5) 3_646 . ?
Cl1 Rb1 Rb2 101.75(5) 1_455 . ?
Cl4 Rb1 Rb2 48.73(4) . . ?
Cl3 Rb1 Rb2 99.52(4) 5_656 . ?
Cl5 Rb1 Rb2 44.73(4) 1_455 . ?
Cl5 Rb1 Rb2 169.73(4) 8_655 . ?
Rb2 Rb1 Rb2 102.847(17) 8_655 . ?
Rb2 Rb1 Rb2 128.66(2) 8 . ?
Cl7 Rb1 Rb1 139.43(4) 5_556 6_557 ?
Cl6 Rb1 Rb1 81.99(4) . 6_557 ?
Cl2 Rb1 Rb1 43.89(4) 3_646 6_557 ?
Cl1 Rb1 Rb1 44.04(4) 1_455 6_557 ?
Cl4 Rb1 Rb1 136.82(4) . 6_557 ?
Cl3 Rb1 Rb1 134.57(3) 5_656 6_557 ?
Cl5 Rb1 Rb1 83.32(4) 1_455 6_557 ?
Cl5 Rb1 Rb1 83.66(3) 8_655 6_557 ?
Rb2 Rb1 Rb1 88.146(13) 8_655 6_557 ?
Rb2 Rb1 Rb1 88.181(12) 8 6_557 ?
Rb2 Rb1 Rb1 88.206(12) . 6_557 ?
Cl5 Rb2 Cl3 131.65(6) 1_455 4_556 ?
Cl5 Rb2 Cl2 127.97(6) 1_455 . ?
Cl3 Rb2 Cl2 98.35(5) 4_556 . ?
Cl5 Rb2 Cl1 73.86(6) 1_455 3_656 ?
Cl3 Rb2 Cl1 132.74(6) 4_556 3_656 ?
Cl2 Rb2 Cl1 82.37(6) . 3_656 ?
Cl5 Rb2 Cl4 70.72(5) 1_455 . ?
Cl3 Rb2 Cl4 68.52(5) 4_556 . ?
Cl2 Rb2 Cl4 130.08(6) . . ?
Cl1 Rb2 Cl4 142.45(6) 3_656 . ?
Cl5 Rb2 Cl6 93.81(6) 1_455 . ?
Cl3 Rb2 Cl6 91.59(6) 4_556 . ?
Cl2 Rb2 Cl6 67.79(6) . . ?
Cl1 Rb2 Cl6 130.31(5) 3_656 . ?
Cl4 Rb2 Cl6 64.86(5) . . ?
Cl5 Rb2 Cl7 70.30(5) 1_455 4_556 ?
Cl3 Rb2 Cl7 69.71(5) 4_556 4_556 ?
Cl2 Rb2 Cl7 157.09(6) . 4_556 ?
Cl1 Rb2 Cl7 91.60(5) 3_656 4_556 ?
Cl4 Rb2 Cl7 65.11(5) . 4_556 ?
Cl6 Rb2 Cl7 129.97(5) . 4_556 ?
Cl5 Rb2 Cl6 134.15(6) 1_455 8_665 ?
Cl3 Rb2 Cl6 69.16(5) 4_556 8_665 ?
Cl2 Rb2 Cl6 69.71(6) . 8_665 ?
Cl1 Rb2 Cl6 66.98(6) 3_656 8_665 ?
Cl4 Rb2 Cl6 135.41(5) . 8_665 ?
Cl6 Rb2 Cl6 129.66(3) . 8_665 ?
Cl7 Rb2 Cl6 87.57(5) 4_556 8_665 ?
Cl5 Rb2 Bi1 91.03(4) 1_455 . ?
Cl3 Rb2 Bi1 40.63(4) 4_556 . ?
Cl2 Rb2 Bi1 137.26(4) . . ?
Cl1 Rb2 Bi1 130.92(4) 3_656 . ?
Cl4 Rb2 Bi1 39.70(3) . . ?
Cl6 Rb2 Bi1 96.35(4) . . ?
Cl7 Rb2 Bi1 39.98(3) 4_556 . ?
Cl6 Rb2 Bi1 96.88(4) 8_665 . ?
Cl5 Rb2 Rb1 176.79(5) 1_455 8_665 ?
Cl3 Rb2 Rb1 51.18(4) 4_556 8_665 ?
Cl2 Rb2 Rb1 48.86(4) . 8_665 ?
Cl1 Rb2 Rb1 105.31(5) 3_656 8_665 ?
Cl4 Rb2 Rb1 110.73(4) . 8_665 ?
Cl6 Rb2 Rb1 84.38(4) . 8_665 ?
Cl7 Rb2 Rb1 112.89(4) 4_556 8_665 ?
Cl6 Rb2 Rb1 46.89(4) 8_665 8_665 ?
Bi1 Rb2 Rb1 91.803(17) . 8_665 ?
Cl5 Rb2 Rb1 53.61(5) 1_455 8_565 ?
Cl3 Rb2 Rb1 109.48(4) 4_556 8_565 ?
Cl2 Rb2 Rb1 129.76(5) . 8_565 ?
Cl1 Rb2 Rb1 47.99(4) 3_656 8_565 ?
Cl4 Rb2 Rb1 99.29(4) . 8_565 ?
Cl6 Rb2 Rb1 147.41(4) . 8_565 ?
Cl7 Rb2 Rb1 45.35(3) 4_556 8_565 ?
Cl6 Rb2 Rb1 82.06(4) 8_665 8_565 ?
Bi1 Rb2 Rb1 85.229(16) . 8_565 ?
Rb1 Rb2 Rb1 128.18(3) 8_665 8_565 ?
Cl5 Rb2 Rb2 85.33(4) 1_455 6_557 ?
Cl3 Rb2 Rb2 143.01(4) 4_556 6_557 ?
Cl2 Rb2 Rb2 46.47(4) . 6_557 ?
Cl1 Rb2 Rb2 46.96(4) 3_656 6_557 ?
Cl4 Rb2 Rb2 139.03(4) . 6_557 ?
Cl6 Rb2 Rb2 84.88(4) . 6_557 ?
Cl7 Rb2 Rb2 137.16(3) 4_556 6_557 ?
Cl6 Rb2 Rb2 85.00(4) 8_665 6_557 ?
Bi1 Rb2 Rb2 176.240(12) . 6_557 ?
Rb1 Rb2 Rb2 91.854(13) 8_665 6_557 ?
Rb1 Rb2 Rb2 91.820(12) 8_565 6_557 ?
Cl4 Bi1 Cl4 175.95(10) 4_556 . ?
Cl4 Bi1 Cl7 89.04(7) 4_556 . ?
Cl4 Bi1 Cl7 88.13(6) . . ?
Cl4 Bi1 Cl7 88.13(6) 4_556 4_556 ?
Cl4 Bi1 Cl7 89.04(6) . 4_556 ?
Cl7 Bi1 Cl7 91.22(9) . 4_556 ?
Cl4 Bi1 Cl3 94.05(7) 4_556 4_556 ?
Cl4 Bi1 Cl3 88.92(6) . 4_556 ?
Cl7 Bi1 Cl3 175.86(6) . 4_556 ?
Cl7 Bi1 Cl3 91.63(6) 4_556 4_556 ?
Cl4 Bi1 Cl3 88.92(6) 4_556 . ?
Cl4 Bi1 Cl3 94.05(7) . . ?
Cl7 Bi1 Cl3 91.63(6) . . ?
Cl7 Bi1 Cl3 175.86(6) 4_556 . ?
Cl3 Bi1 Cl3 85.69(8) 4_556 . ?
Cl4 Bi1 Rb2 55.72(5) 4_556 4_556 ?
Cl4 Bi1 Rb2 124.59(5) . 4_556 ?
Cl7 Bi1 Rb2 57.44(5) . 4_556 ?
Cl7 Bi1 Rb2 128.88(5) 4_556 4_556 ?
Cl3 Bi1 Rb2 122.42(4) 4_556 4_556 ?
Cl3 Bi1 Rb2 50.95(4) . 4_556 ?
Cl4 Bi1 Rb2 124.59(5) 4_556 . ?
Cl4 Bi1 Rb2 55.72(5) . . ?
Cl7 Bi1 Rb2 128.88(5) . . ?
Cl7 Bi1 Rb2 57.44(5) 4_556 . ?
Cl3 Bi1 Rb2 50.95(4) 4_556 . ?
Cl3 Bi1 Rb2 122.42(4) . . ?
Rb2 Bi1 Rb2 172.66(2) 4_556 . ?
Cl4 Bi1 Cs1 127.67(5) 4_556 5_656 ?
Cl4 Bi1 Cs1 51.90(5) . 5_656 ?
Cl7 Bi1 Cs1 51.31(4) . 5_656 ?
Cl7 Bi1 Cs1 120.37(4) 4_556 5_656 ?
Cl3 Bi1 Cs1 124.56(5) 4_556 5_656 ?
Cl3 Bi1 Cs1 63.76(5) . 5_656 ?
Rb2 Bi1 Cs1 73.046(13) 4_556 5_656 ?
Rb2 Bi1 Cs1 107.610(13) . 5_656 ?
Cl4 Bi1 Cs1 51.90(5) 4_556 8_665 ?
Cl4 Bi1 Cs1 127.67(5) . 8_665 ?
Cl7 Bi1 Cs1 120.37(4) . 8_665 ?
Cl7 Bi1 Cs1 51.31(4) 4_556 8_665 ?
Cl3 Bi1 Cs1 63.76(4) 4_556 8_665 ?
Cl3 Bi1 Cs1 124.56(5) . 8_665 ?
Rb2 Bi1 Cs1 107.610(13) 4_556 8_665 ?
Rb2 Bi1 Cs1 73.046(13) . 8_665 ?
Cs1 Bi1 Cs1 170.201(18) 5_656 8_665 ?
Cl4 Bi1 Cs1 59.67(5) 4_556 4_556 ?
Cl4 Bi1 Cs1 124.37(5) . 4_556 ?
Cl7 Bi1 Cs1 128.27(4) . 4_556 ?
Cl7 Bi1 Cs1 124.16(4) 4_556 4_556 ?
Cl3 Bi1 Cs1 51.80(4) 4_556 4_556 ?
Cl3 Bi1 Cs1 51.72(5) . 4_556 ?
Rb2 Bi1 Cs1 70.828(13) 4_556 4_556 ?
Rb2 Bi1 Cs1 102.731(14) . 4_556 ?
Cs1 Bi1 Cs1 115.335(11) 5_656 4_556 ?
Cs1 Bi1 Cs1 73.517(12) 8_665 4_556 ?
Cl4 Bi1 Cs1 124.37(5) 4_556 . ?
Cl4 Bi1 Cs1 59.67(5) . . ?
Cl7 Bi1 Cs1 124.16(4) . . ?
Cl7 Bi1 Cs1 128.27(4) 4_556 . ?
Cl3 Bi1 Cs1 51.72(4) 4_556 . ?
Cl3 Bi1 Cs1 51.80(4) . . ?
Rb2 Bi1 Cs1 102.731(14) 4_556 . ?
Rb2 Bi1 Cs1 70.828(13) . . ?
Cs1 Bi1 Cs1 73.517(12) 5_656 . ?
Cs1 Bi1 Cs1 115.335(11) 8_665 . ?
Cs1 Bi1 Cs1 64.845(16) 4_556 . ?
Cl6 Bi2 Cl6 94.04(10) . 6_557 ?
Cl6 Bi2 Cl1 90.59(7) . . ?
Cl6 Bi2 Cl1 90.59(7) 6_557 . ?
Cl6 Bi2 Cl5 179.13(7) . 6_557 ?
Cl6 Bi2 Cl5 85.11(7) 6_557 6_557 ?
Cl1 Bi2 Cl5 89.20(7) . 6_557 ?
Cl6 Bi2 Cl5 85.11(7) . . ?
Cl6 Bi2 Cl5 179.13(7) 6_557 . ?
Cl1 Bi2 Cl5 89.20(7) . . ?
Cl5 Bi2 Cl5 95.73(10) 6_557 . ?
Cl6 Bi2 Cl2 89.59(6) . . ?
Cl6 Bi2 Cl2 89.59(6) 6_557 . ?
Cl1 Bi2 Cl2 179.74(9) . . ?
Cl5 Bi2 Cl2 90.62(7) 6_557 . ?
Cl5 Bi2 Cl2 90.62(7) . . ?
Bi2 Cl1 Rb2 104.19(7) . 8_655 ?
Bi2 Cl1 Rb2 104.19(7) . 3_646 ?
Rb2 Cl1 Rb2 86.07(7) 8_655 3_646 ?
Bi2 Cl1 Rb1 103.19(7) . 6_657 ?
Rb2 Cl1 Rb1 152.48(9) 8_655 6_657 ?
Rb2 Cl1 Rb1 84.59(3) 3_646 6_657 ?
Bi2 Cl1 Rb1 103.19(7) . 1_655 ?
Rb2 Cl1 Rb1 84.59(3) 8_655 1_655 ?
Rb2 Cl1 Rb1 152.48(9) 3_646 1_655 ?
Rb1 Cl1 Rb1 91.91(7) 6_657 1_655 ?
Bi2 Cl2 Rb2 103.50(7) . . ?
Bi2 Cl2 Rb2 103.50(7) . 6_557 ?
Rb2 Cl2 Rb2 87.06(7) . 6_557 ?
Bi2 Cl2 Rb1 105.19(7) . 3_656 ?
Rb2 Cl2 Rb1 151.13(9) . 3_656 ?
Rb2 Cl2 Rb1 83.28(3) 6_557 3_656 ?
Bi2 Cl2 Rb1 105.19(7) . 8_665 ?
Rb2 Cl2 Rb1 83.28(3) . 8_665 ?
Rb2 Cl2 Rb1 151.13(9) 6_557 8_665 ?
Rb1 Cl2 Rb1 92.22(7) 3_656 8_665 ?
Bi1 Cl3 Rb2 88.42(5) . 4_556 ?
Bi1 Cl3 Rb1 170.79(7) . 5_656 ?
Rb2 Cl3 Rb1 82.38(5) 4_556 5_656 ?
Bi1 Cl3 Cs1 91.78(5) . 4_556 ?
Rb2 Cl3 Cs1 95.87(5) 4_556 4_556 ?
Rb1 Cl3 Cs1 88.57(5) 5_656 4_556 ?
Bi1 Cl3 Cs1 91.70(5) . . ?
Rb2 Cl3 Cs1 178.08(7) 4_556 . ?
Rb1 Cl3 Cs1 97.50(5) 5_656 . ?
Cs1 Cl3 Cs1 86.05(5) 4_556 . ?
Bi1 Cl3 Cs1 80.00(5) . 5_656 ?
Rb2 Cl3 Cs1 88.67(5) 4_556 5_656 ?
Rb1 Cl3 Cs1 100.30(5) 5_656 5_656 ?
Cs1 Cl3 Cs1 170.53(6) 4_556 5_656 ?
Cs1 Cl3 Cs1 89.47(5) . 5_656 ?
Bi1 Cl4 Rb1 164.12(8) . . ?
Bi1 Cl4 Rb2 84.58(5) . . ?
Rb1 Cl4 Rb2 83.90(5) . . ?
Bi1 Cl4 Cs1 91.89(6) . 5_656 ?
Rb1 Cl4 Cs1 99.79(5) . 5_656 ?
Rb2 Cl4 Cs1 176.27(7) . 5_656 ?
Bi1 Cl4 Cs1 84.63(6) . . ?
Rb1 Cl4 Cs1 105.40(6) . . ?
Rb2 Cl4 Cs1 85.98(5) . . ?
Cs1 Cl4 Cs1 92.51(5) 5_656 . ?
Bi1 Cl4 Cs1 88.79(6) . 1_455 ?
Rb1 Cl4 Cs1 82.01(5) . 1_455 ?
Rb2 Cl4 Cs1 97.87(5) . 1_455 ?
Cs1 Cl4 Cs1 83.21(5) 5_656 1_455 ?
Cs1 Cl4 Cs1 172.04(6) . 1_455 ?
Bi2 Cl5 Rb2 136.67(8) . 1_655 ?
Bi2 Cl5 Rb1 100.07(7) . 1_655 ?
Rb2 Cl5 Rb1 85.75(6) 1_655 1_655 ?
Bi2 Cl5 Cs1 108.96(7) . . ?
Rb2 Cl5 Cs1 114.10(6) 1_655 . ?
Rb1 Cl5 Cs1 88.70(5) 1_655 . ?
Bi2 Cl5 Rb1 97.59(7) . 8_665 ?
Rb2 Cl5 Rb1 81.36(5) 1_655 8_665 ?
Rb1 Cl5 Rb1 162.35(7) 1_655 8_665 ?
Cs1 Cl5 Rb1 85.64(5) . 8_665 ?
Bi2 Cl6 Rb1 140.91(8) . . ?
Bi2 Cl6 Rb2 99.07(6) . . ?
Rb1 Cl6 Rb2 84.44(6) . . ?
Bi2 Cl6 Rb2 98.18(7) . 8_655 ?
Rb1 Cl6 Rb2 79.88(5) . 8_655 ?
Rb2 Cl6 Rb2 162.37(7) . 8_655 ?
Bi2 Cl6 Cs1 105.96(7) . . ?
Rb1 Cl6 Cs1 113.06(6) . . ?
Rb2 Cl6 Cs1 88.78(5) . . ?
Rb2 Cl6 Cs1 89.97(5) 8_655 . ?
Bi1 Cl7 Rb1 165.12(8) . 5_556 ?
Bi1 Cl7 Cs1 92.06(5) . 5_656 ?
Rb1 Cl7 Cs1 93.87(5) 5_556 5_656 ?
Bi1 Cl7 Rb2 82.57(5) . 4_556 ?
Rb1 Cl7 Rb2 83.40(5) 5_556 4_556 ?
Cs1 Cl7 Rb2 94.13(5) 5_656 4_556 ?
Bi1 Cl7 Cs1 95.51(6) . 1_455 ?
Rb1 Cl7 Cs1 98.27(5) 5_556 1_455 ?
Cs1 Cl7 Cs1 88.52(5) 5_656 1_455 ?
Rb2 Cl7 Cs1 176.77(7) 4_556 1_455 ?
Bi1 Cl7 Cs1 91.43(5) . 4_456 ?
Rb1 Cl7 Cs1 85.92(5) 5_556 4_456 ?
Cs1 Cl7 Cs1 166.63(6) 5_656 4_456 ?
Rb2 Cl7 Cs1 99.11(5) 4_556 4_456 ?
Cs1 Cl7 Cs1 78.30(4) 1_455 4_456 ?

_diffrn_measured_fraction_theta_max 1.000
_diffrn_reflns_theta_full        26.37
_diffrn_measured_fraction_theta_full 1.000
_refine_diff_density_max         5.670
_refine_diff_density_min         -1.650
_refine_diff_density_rms         0.325
