# Supplementary Information (SI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2024

####################################################################### 
# 
# 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_mo_80Z_300K_0m
_database_code_depnum_ccdc_archive 'CCDC 2323926'
loop_
_audit_author_name
_audit_author_address
'Lirong Zhang'
;Inner  Mongolia Normal University
China
;
_audit_update_record             
;
2024-01-08 deposited with the CCDC.	2024-08-12 downloaded from the CCDC.
;
_audit_creation_date             2023-12-27
_audit_creation_method           
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_chemical_formula_moiety         '0.5(Rb16 Sb8 Se28 Zn8)'
_chemical_formula_sum            'Rb8 Sb4 Se14 Zn4'
_chemical_formula_weight         2537.79
loop_
_atom_type_symbol
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_Cromer_Mann_a1
_atom_type_scat_Cromer_Mann_a2
_atom_type_scat_Cromer_Mann_a3
_atom_type_scat_Cromer_Mann_a4
_atom_type_scat_Cromer_Mann_b1
_atom_type_scat_Cromer_Mann_b2
_atom_type_scat_Cromer_Mann_b3
_atom_type_scat_Cromer_Mann_b4
_atom_type_scat_Cromer_Mann_c
_atom_type_scat_source
_atom_type_scat_dispersion_source
Sb -0.60640 1.48759 19.64180 19.04550 5.03710 2.68270 5.30340 0.46070 27.90740
75.28250 4.59089994431
'International Tables Volume C Table 6.1.1.4 (pp. 500-502)'
'Henke, Gullikson and Davis, At. Data and Nucl. Data Tables, 1993, 54, 2'
Zn 0.31207 1.46666 14.07430 7.03180 5.16520 2.41000 3.26550 0.23330 10.31630
58.70970 1.30410003662
'International Tables Volume C Table 6.1.1.4 (pp. 500-502)'
'Henke, Gullikson and Davis, At. Data and Nucl. Data Tables, 1993, 54, 2'
Rb -0.94509 2.97843 17.17840 9.64350 5.13990 1.52920 1.78880 17.31510 0.27480
164.93401 3.48729991913
'International Tables Volume C Table 6.1.1.4 (pp. 500-502)'
'Henke, Gullikson and Davis, At. Data and Nucl. Data Tables, 1993, 54, 2'
Se -0.08110 2.30834 17.00060 5.81960 3.97310 4.35430 2.40980 0.27260 15.23720
43.81630 2.84089994431
'International Tables Volume C Table 6.1.1.4 (pp. 500-502)'
'Henke, Gullikson and Davis, At. Data and Nucl. Data Tables, 1993, 54, 2'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 1 21/c 1'
_space_group_name_Hall           '-P 2ybc'
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -x,y+1/2,-z+1/2
3 -x,-y,-z
4 x,-y-1/2,z-1/2

_symmetry_Int_Tables_number      14
_cell_length_a                   12.4440(7)
_cell_length_b                   9.2235(5)
_cell_length_c                   17.0951(12)
_cell_angle_alpha                90
_cell_angle_beta                 107.306(3)
_cell_angle_gamma                90
_cell_volume                     1873.3(2)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    8113
_cell_measurement_temperature    280.0
_cell_measurement_theta_max      ?
_cell_measurement_theta_min      ?
_exptl_absorpt_coefficient_mu    29.282
_exptl_absorpt_correction_T_max  0.7464
_exptl_absorpt_correction_T_min  0.2258
_exptl_absorpt_correction_type   ?
_exptl_absorpt_process_details   ?
_exptl_crystal_colour            colourless
_exptl_crystal_colour_lustre     .
_exptl_crystal_colour_modifier   .
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    4.4988
_exptl_crystal_description       block
_exptl_crystal_F_000             2175.7009
_exptl_crystal_size_max          0.1
_exptl_crystal_size_mid          0.1
_exptl_crystal_size_min          0.1
_diffrn_reflns_av_R_equivalents  0.1422
_diffrn_reflns_av_unetI/netI     0.1102
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_number            44239
_diffrn_reflns_theta_full        25.0275
_diffrn_reflns_theta_max         25.03
_diffrn_reflns_theta_min         2.50
_diffrn_ambient_temperature      280.0
_diffrn_measured_fraction_theta_full 0.9997
_diffrn_measured_fraction_theta_max 0.9997
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71073
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.0
_reflns_limit_h_max              14
_reflns_limit_h_min              -14
_reflns_limit_k_max              10
_reflns_limit_k_min              0
_reflns_limit_l_max              20
_reflns_limit_l_min              0
_reflns_number_gt                2747
_reflns_number_total             3310
_reflns_threshold_expression     I>=2u(I)
_computing_cell_refinement       'SAINT V8.40B (?, 2016)'
_computing_data_reduction        'SAINT V8.40B (?, 2016)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'olex2.refine (Bourhis et al., 2015)'
_computing_structure_solution    'olex2.solve (Bourhis et al., 2015)'
_refine_diff_density_max         2.5596
_refine_diff_density_min         -2.6459
_refine_diff_density_rms         0.5161
_refine_ls_d_res_high            0.8400
_refine_ls_d_res_low             8.1606
_refine_ls_goodness_of_fit_ref   1.0269
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_constraints    0
_refine_ls_number_parameters     136
_refine_ls_number_reflns         3310
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0636
_refine_ls_R_factor_gt           0.0519
_refine_ls_restrained_S_all      1.0269
_refine_ls_shift/su_max          0.0022
_refine_ls_shift/su_mean         0.0005
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0810P)²+38.5136P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1390
_refine_ls_wR_factor_ref         0.1501
_olex2_refinement_description    
;
;
_atom_sites_solution_primary     iterative
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_refinement_flags_posn
Sb2 Sb 0.08647(7) 0.56404(9) 0.43901(5) 0.0179(2) Uani 1.000000 .
Sb1 Sb 0.51292(7) 1.04640(9) 0.37141(5) 0.0218(3) Uani 1.000000 .
Se7 Se 0.15184(11) -0.06570(13) 0.52757(8) 0.0218(3) Uani 1.000000 .
Rb1 Rb 0.02551(12) -0.02230(15) 0.30225(8) 0.0290(3) Uani 1.000000 .
Rb3 Rb 0.73520(13) 1.35119(15) 0.32112(9) 0.0326(4) Uani 1.000000 .
Se6 Se 0.10535(12) 0.31727(15) 0.62576(9) 0.0276(3) Uani 1.000000 .
Se1 Se 0.49525(13) 1.13683(17) 0.23024(9) 0.0320(4) Uani 1.000000 .
Zn2 Zn 0.04453(13) 0.16295(15) 0.50108(9) 0.0201(4) Uani 1.000000 .
Rb4 Rb 0.31730(13) 1.37474(16) 0.27951(11) 0.0403(4) Uani 1.000000 .
Se3 Se 0.43163(13) 0.71817(17) 0.54560(10) 0.0325(4) Uani 1.000000 .
Zn1 Zn 0.28170(13) 0.84400(16) 0.44719(10) 0.0221(4) Uani 1.000000 .
Se4 Se 0.19069(14) 0.65844(16) 0.34416(10) 0.0345(4) Uani 1.000000 .
Rb2 Rb 0.65867(14) 0.6972(2) 0.47036(10) 0.0444(4) Uani 1.000000 .
Se5 Se 0.05736(15) 0.30865(15) 0.38264(10) 0.0349(4) Uani 1.000000 .
Se2 Se 0.30908(14) 1.05033(18) 0.36880(11) 0.0416(4) Uani 1.000000 .


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
Sb2 Se6 2.5593(17) 3_566 ?
Sb2 Se4 2.5141(17) . ?
Sb2 Se5 2.5301(16) . ?
Sb1 Se1 2.5005(17) . ?
Sb1 Se3 2.5733(18) 3_676 ?
Sb1 Se2 2.5239(19) . ?
Se7 Zn2 2.511(2) 3_556 ?
Se7 Zn2 2.4650(19) . ?
Se7 Zn1 2.552(2) 1_545 ?
Rb1 Se5 3.398(2) 2_545 ?
Rb1 Se2 3.436(2) 1_545 ?
Se6 Zn2 2.486(2) . ?
Se1 Rb4 3.398(2) 2_645 ?
Se1 Rb2 3.440(2) 2_655 ?
Zn2 Se5 2.474(2) . ?
Rb4 Se4 3.404(2) 1_565 ?
Se3 Zn1 2.406(2) . ?
Zn1 Se4 2.475(2) . ?
Zn1 Se2 2.409(2) . ?

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
Se4 Sb2 Se6 99.59(6) . 3_566 ?
Se5 Sb2 Se6 102.95(6) . 3_566 ?
Se5 Sb2 Se4 96.87(6) . . ?
Se3 Sb1 Se1 100.53(6) 3_676 . ?
Se2 Sb1 Se1 100.30(6) . . ?
Se2 Sb1 Se3 95.79(6) . 3_676 ?
Zn1 Se7 Zn2 125.13(7) 1_545 . ?
Zn1 Se7 Zn2 120.92(7) 1_545 3_556 ?
Se2 Rb1 Se5 113.27(6) 1_545 2_545 ?
Zn2 Se6 Sb2 82.36(6) . 3_566 ?
Rb4 Se1 Sb1 86.87(6) 2_645 . ?
Rb2 Se1 Sb1 151.55(7) 2_655 . ?
Rb2 Se1 Rb4 104.66(6) 2_655 2_645 ?
Se6 Zn2 Se7 108.79(7) . . ?
Se6 Zn2 Se7 113.71(7) . 3_556 ?
Se5 Zn2 Se7 116.85(7) . . ?
Se5 Zn2 Se7 109.29(8) . 3_556 ?
Se5 Zn2 Se6 108.25(7) . . ?
Se4 Rb4 Se1 81.94(5) 1_565 2_655 ?
Zn1 Se3 Sb1 90.20(6) . 3_676 ?
Se3 Zn1 Se7 105.33(7) . 1_565 ?
Se4 Zn1 Se7 112.32(7) . 1_565 ?
Se4 Zn1 Se3 105.04(8) . . ?
Se2 Zn1 Se7 104.99(7) . 1_565 ?
Se2 Zn1 Se3 124.14(8) . . ?
Se2 Zn1 Se4 105.12(8) . . ?
Rb4 Se4 Sb2 108.70(6) 1_545 . ?
Zn1 Se4 Sb2 89.72(6) . . ?
Zn1 Se4 Rb4 127.20(7) . 1_545 ?
Rb1 Se5 Sb2 84.06(5) 2 . ?
Zn2 Se5 Sb2 103.34(7) . . ?
Zn2 Se5 Rb1 159.19(8) . 2 ?
Rb1 Se2 Sb1 158.56(8) 1_565 . ?
Zn1 Se2 Sb1 106.65(8) . . ?
Zn1 Se2 Rb1 74.27(6) . 1_565 ?

_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_mo_T_20230730_62Z_281K_0m_a
_database_code_depnum_ccdc_archive 'CCDC 2323927'
loop_
_audit_author_name
_audit_author_address
'Lirong Zhang'
;Inner  Mongolia Normal University
China
;
_audit_update_record             
;
2024-01-08 deposited with the CCDC.	2024-08-12 downloaded from the CCDC.
;
_audit_creation_date             2023-12-27
_audit_creation_method           
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_chemical_formula_moiety         '4(Cs), Sb2 Se7 Zn2'
_chemical_formula_sum            'Cs4 Sb2 Se7 Zn2'
_chemical_formula_weight         1458.65
loop_
_atom_type_symbol
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_Cromer_Mann_a1
_atom_type_scat_Cromer_Mann_a2
_atom_type_scat_Cromer_Mann_a3
_atom_type_scat_Cromer_Mann_a4
_atom_type_scat_Cromer_Mann_b1
_atom_type_scat_Cromer_Mann_b2
_atom_type_scat_Cromer_Mann_b3
_atom_type_scat_Cromer_Mann_b4
_atom_type_scat_Cromer_Mann_c
_atom_type_scat_source
_atom_type_scat_dispersion_source
Cs -0.25336 2.18958 20.38920 19.10620 10.66200 1.49530 3.56900 0.31070 24.38790
213.90401 3.33520007133
'International Tables Volume C Table 6.1.1.4 (pp. 500-502)'
'Henke, Gullikson and Davis, At. Data and Nucl. Data Tables, 1993, 54, 2'
Sb -0.60640 1.48759 19.64180 19.04550 5.03710 2.68270 5.30340 0.46070 27.90740
75.28250 4.59089994431
'International Tables Volume C Table 6.1.1.4 (pp. 500-502)'
'Henke, Gullikson and Davis, At. Data and Nucl. Data Tables, 1993, 54, 2'
Zn 0.31207 1.46666 14.07430 7.03180 5.16520 2.41000 3.26550 0.23330 10.31630
58.70970 1.30410003662
'International Tables Volume C Table 6.1.1.4 (pp. 500-502)'
'Henke, Gullikson and Davis, At. Data and Nucl. Data Tables, 1993, 54, 2'
Se -0.08110 2.30834 17.00060 5.81960 3.97310 4.35430 2.40980 0.27260 15.23720
43.81630 2.84089994431
'International Tables Volume C Table 6.1.1.4 (pp. 500-502)'
'Henke, Gullikson and Davis, At. Data and Nucl. Data Tables, 1993, 54, 2'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 1 21/c 1'
_space_group_name_Hall           '-P 2ybc'
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -x,y+1/2,-z+1/2
3 -x,-y,-z
4 x,-y-1/2,z-1/2

_symmetry_Int_Tables_number      14
_cell_length_a                   12.7022(19)
_cell_length_b                   9.3928(13)
_cell_length_c                   17.516(3)
_cell_angle_alpha                90
_cell_angle_beta                 106.755(4)
_cell_angle_gamma                90
_cell_volume                     2001.1(5)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    9917
_cell_measurement_temperature    279.00
_cell_measurement_theta_max      28.48
_cell_measurement_theta_min      2.43
_exptl_absorpt_coefficient_mu    24.917
_exptl_absorpt_correction_T_max  0.7464
_exptl_absorpt_correction_T_min  0.3898
_exptl_absorpt_correction_type   none
_exptl_absorpt_process_details   
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.1565 before and 0.0766 after correction.
The Ratio of minimum to maximum transmission is 0.5222.
The λ/2 correction factor is Not present.
;
_exptl_crystal_colour            'clear light colourless'
_exptl_crystal_colour_lustre     clear
_exptl_crystal_colour_modifier   light
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    4.8413
_exptl_crystal_description       block
_exptl_crystal_F_000             2473.7471
_exptl_crystal_size_max          0.1
_exptl_crystal_size_mid          0.1
_exptl_crystal_size_min          0.1
_diffrn_reflns_av_R_equivalents  0.1041
_diffrn_reflns_av_unetI/netI     0.0691
_diffrn_reflns_limit_h_max       19
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            56570
_diffrn_reflns_theta_full        25.0273
_diffrn_reflns_theta_max         25.03
_diffrn_reflns_theta_min         2.43
_diffrn_ambient_temperature      279.0
_diffrn_measured_fraction_theta_full 0.9997
_diffrn_measured_fraction_theta_max 0.9997
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71073
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.0
_reflns_limit_h_max              14
_reflns_limit_h_min              -15
_reflns_limit_k_max              11
_reflns_limit_k_min              0
_reflns_limit_l_max              20
_reflns_limit_l_min              0
_reflns_number_gt                3159
_reflns_number_total             3531
_reflns_threshold_expression     I>=2u(I)
_computing_cell_refinement       'SAINT V8.40B (?, 2016)'
_computing_data_reduction        'SAINT V8.40B (?, 2016)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'olex2.refine (Bourhis et al., 2015)'
_computing_structure_solution    'olex2.solve (Bourhis et al., 2015)'
_refine_diff_density_max         1.9945
_refine_diff_density_min         -3.7193
_refine_diff_density_rms         0.4831
_refine_ls_d_res_high            0.8400
_refine_ls_d_res_low             8.3862
_refine_ls_goodness_of_fit_ref   1.0322
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_constraints    0
_refine_ls_number_parameters     136
_refine_ls_number_reflns         3531
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0588
_refine_ls_R_factor_gt           0.0528
_refine_ls_restrained_S_all      1.0322
_refine_ls_shift/su_max          0.0002
_refine_ls_shift/su_mean         0.0001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0477P)²+186.6777P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1392
_refine_ls_wR_factor_ref         0.1429
_olex2_refinement_description    
;
;
_atom_sites_solution_primary     iterative
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_refinement_flags_posn
Cs1 Cs 0.02505(9) 1.01550(12) 0.30065(7) 0.0264(3) Uani 1.000000 .
Sb1 Sb 0.08740(9) 0.43508(12) 0.44334(6) 0.0179(3) Uani 1.000000 .
Cs03 Cs 0.26285(10) 0.34201(13) 0.68348(7) 0.0294(3) Uani 1.000000 .
Sb2 Sb 0.50865(9) -0.03834(12) 0.37489(7) 0.0220(3) Uani 1.000000 .
Cs Cs 0.30767(11) -0.36964(13) 0.27541(9) 0.0388(3) Uani 1.000000 .
Cs06 Cs 0.34649(11) -0.17717(16) 0.03218(8) 0.0402(3) Uani 1.000000 .
Se1 Se 0.14773(14) 1.06125(19) 0.52858(11) 0.0242(4) Uani 1.000000 .
Zn1 Zn 0.04374(16) 0.8355(2) 0.50153(12) 0.0202(4) Uani 1.000000 .
Zn2 Zn 0.27961(16) 0.1511(2) 0.45412(12) 0.0224(4) Uani 1.000000 .
Se2 Se 0.09769(17) 0.6810(2) 0.62192(12) 0.0338(5) Uani 1.000000 .
Se3 Se 0.06016(19) 0.6862(2) 0.38794(13) 0.0359(5) Uani 1.000000 .
Se7 Se 0.48934(18) -0.1191(2) 0.23580(13) 0.0376(5) Uani 1.000000 .
Se5 Se 0.42912(18) 0.2696(3) 0.54853(14) 0.0404(5) Uani 1.000000 .
Se4 Se 0.19641(19) 0.3389(2) 0.35579(14) 0.0400(5) Uani 1.000000 .
Se6 Se 0.3109(2) -0.0484(3) 0.37720(16) 0.0483(6) Uani 1.000000 .


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
Sb1 Se2 2.544(2) 3_566 ?
Sb1 Se3 2.536(2) . ?
Sb1 Se4 2.512(2) . ?
Sb2 Se7 2.495(2) . ?
Sb2 Se5 2.556(3) 3_656 ?
Sb2 Se6 2.526(3) . ?
Se1 Zn1 2.470(3) . ?
Se1 Zn1 2.529(3) 3_576 ?
Se1 Zn2 2.545(3) 1_565 ?
Zn1 Se2 2.488(3) . ?
Zn1 Se3 2.492(3) . ?
Zn2 Se5 2.402(3) . ?
Zn2 Se4 2.479(3) . ?
Zn2 Se6 2.407(3) . ?

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
Se3 Sb1 Se2 102.73(8) . 3_566 ?
Se4 Sb1 Se2 99.91(8) . 3_566 ?
Se4 Sb1 Se3 98.01(8) . . ?
Se5 Sb2 Se7 100.51(8) 3_656 . ?
Se6 Sb2 Se7 100.72(9) . . ?
Se6 Sb2 Se5 96.79(9) . 3_656 ?
Zn2 Se1 Zn1 125.51(10) 1_565 . ?
Zn2 Se1 Zn1 120.10(9) 1_565 3_576 ?
Se2 Zn1 Se1 109.67(10) . . ?
Se2 Zn1 Se1 114.44(10) . 3_576 ?
Se3 Zn1 Se1 118.23(10) . . ?
Se3 Zn1 Se1 110.25(10) . 3_576 ?
Se3 Zn1 Se2 106.41(10) . . ?
Se5 Zn2 Se1 107.90(10) . 1_545 ?
Se4 Zn2 Se1 112.35(10) . 1_545 ?
Se4 Zn2 Se5 104.05(11) . . ?
Se6 Zn2 Se1 105.53(11) . 1_545 ?
Se6 Zn2 Se5 121.39(11) . . ?
Se6 Zn2 Se4 105.73(11) . . ?
Zn1 Se2 Sb1 82.89(8) . 3_566 ?
Zn1 Se3 Sb1 104.57(9) . . ?
Zn2 Se5 Sb2 91.78(9) . 3_656 ?
Zn2 Se4 Sb1 91.80(9) . . ?
Zn2 Se6 Sb2 107.77(11) . . ?

_olex2_submission_special_instructions 'No special instructions were received'
