# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2016

####################################################################### 
# 
# 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_a
_database_code_depnum_ccdc_archive 'CCDC 1484524'
_audit_update_record             
;
2016-06-10 deposited with the CCDC.
2016-07-06 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'Ga6 Pb5 S15 Zn'
_chemical_formula_weight         2000.76

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Ga Ga 0.2307 1.6083 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pb Pb -3.3944 10.1111 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Zn Zn 0.2839 1.4301 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_H-M   Ama2

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

_cell_length_a                   22.232(9)
_cell_length_b                   17.933(7)
_cell_length_c                   6.225(2)
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_volume                     2481.8(16)
_cell_formula_units_Z            4
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    4069
_cell_measurement_theta_min      2.2715
_cell_measurement_theta_max      27.4739

_exptl_crystal_description       Plate
_exptl_crystal_colour            Yellow
_exptl_crystal_size_max          0.2000
_exptl_crystal_size_mid          0.1500
_exptl_crystal_size_min          0.0700
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    5.355
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             3462
_exptl_absorpt_coefficient_mu    42.379
_exptl_absorpt_correction_type   Multi-scan
_exptl_absorpt_correction_T_min  0.5078
_exptl_absorpt_correction_T_max  1.0000
_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  Saturn724
_diffrn_measurement_method       CCD_Profile_fitting
_diffrn_detector_area_resol_mean 28.5714
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            10542
_diffrn_reflns_av_R_equivalents  0.0705
_diffrn_reflns_av_sigmaI/netI    0.0845
_diffrn_reflns_limit_h_min       -28
_diffrn_reflns_limit_h_max       28
_diffrn_reflns_limit_k_min       -23
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_l_min       -7
_diffrn_reflns_limit_l_max       8
_diffrn_reflns_theta_min         2.27
_diffrn_reflns_theta_max         27.46
_reflns_number_total             2677
_reflns_number_gt                2374
_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)+(0.0455P)²+692.7769P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   .
_refine_ls_hydrogen_treatment    .
_refine_ls_extinction_method     SHELXL
_refine_ls_extinction_coef       ?
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.046(15)
_refine_ls_number_reflns         2677
_refine_ls_number_parameters     132
_refine_ls_number_restraints     1
_refine_ls_R_factor_all          0.0583
_refine_ls_R_factor_gt           0.0483
_refine_ls_wR_factor_ref         0.1184
_refine_ls_wR_factor_gt          0.1002
_refine_ls_goodness_of_fit_ref   0.722
_refine_ls_restrained_S_all      0.722
_refine_ls_shift/su_max          0.000
_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
Pb1 Pb 0.88154(4) 0.85957(5) 0.10838(19) 0.0312(2) Uani 1 1 d . . .
Pb2 Pb 0.88709(4) 1.14980(5) 0.20088(16) 0.0308(2) Uani 1 1 d . . .
Pb3 Pb 0.7500 0.64530(9) 0.2507(3) 0.0383(4) Uani 1 2 d S . .
Ga1 Ga 0.7500 0.80405(15) -0.2816(6) 0.0121(6) Uani 1 2 d S . .
Zn1 Zn 1.0000 1.0000 0.6265(5) 0.0073(6) Uani 1 2 d S . .
Ga2 Ga 0.83815(9) 0.96770(11) 0.5929(4) 0.0139(4) Uani 1 1 d . . .
Ga4 Ga 1.02733(9) 0.80504(10) 0.6828(4) 0.0112(4) Uani 1 1 d . . .
Ga3 Ga 0.7500 0.96989(17) 0.0680(6) 0.0167(7) Uani 1 2 d S . .
S1 S 0.7500 0.8406(4) 0.0770(12) 0.0161(14) Uani 1 2 d S . .
S2 S 0.8426(2) 0.8408(2) 0.6005(9) 0.0136(9) Uani 1 1 d . . .
S3 S 0.9188(2) 1.0065(3) 0.3953(8) 0.0128(9) Uani 1 1 d . . .
S4 S 0.9921(2) 0.8077(2) 0.3387(8) 0.0128(10) Uani 1 1 d . . .
S5 S 0.9972(2) 0.9046(2) -0.1322(8) 0.0131(9) Uani 1 1 d . . .
S6 S 0.7500 1.1793(3) 0.1903(14) 0.0153(14) Uani 1 2 d S . .
S7 S 0.8715(2) 0.7022(2) 0.1205(9) 0.0129(9) Uani 1 1 d . . .
S8 S 0.8334(2) 1.0208(3) -0.0780(8) 0.0135(9) Uani 1 1 d . . .
S9 S 0.7500 0.5069(4) -0.0776(11) 0.0125(13) Uani 1 2 d S . .


_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
Pb1 S7 2.832(4) . ?
Pb1 S1 2.9506(18) . ?
Pb1 S4 2.994(5) . ?
Pb1 S5 3.083(5) . ?
Pb1 S2 3.201(6) . ?
Pb1 S3 3.289(5) . ?
Pb1 S8 3.294(5) . ?
Pb1 S2 3.295(6) 1_554 ?
Pb1 Ga3 3.540(2) . ?
Pb1 Ga4 3.610(2) 6_764 ?
Pb2 S7 2.797(6) 5 ?
Pb2 S4 2.921(5) 2_775 ?
Pb2 S3 2.927(5) . ?
Pb2 S6 3.0941(19) . ?
Pb2 S8 3.129(5) . ?
Pb2 S5 3.445(5) 2_775 ?
Pb2 Ga4 3.644(3) 2_775 ?
Pb2 Pb3 4.1412(18) 5_554 ?
Pb3 S6 2.804(9) 5_545 ?
Pb3 S7 2.999(5) . ?
Pb3 S7 2.999(5) 3_655 ?
Pb3 S8 3.092(5) 7_645 ?
Pb3 S8 3.092(5) 5_545 ?
Pb3 S9 3.214(7) . ?
Pb3 Pb2 4.1412(18) 5_545 ?
Pb3 Pb2 4.1412(18) 7_645 ?
Ga1 S6 2.244(7) 5_544 ?
Ga1 S2 2.283(5) 3_654 ?
Ga1 S2 2.283(5) 1_554 ?
Ga1 S1 2.327(8) . ?
Zn1 S5 2.278(5) 2_776 ?
Zn1 S5 2.278(5) 1_556 ?
Zn1 S3 2.311(5) . ?
Zn1 S3 2.311(5) 2_775 ?
Ga2 S8 2.261(5) 1_556 ?
Ga2 S2 2.279(5) . ?
Ga2 S3 2.284(5) . ?
Ga2 S9 2.337(4) 5 ?
Ga4 S5 2.227(5) 1_556 ?
Ga4 S4 2.284(5) 6_765 ?
Ga4 S7 2.287(5) 6_765 ?
Ga4 S4 2.281(5) . ?
Ga4 Pb1 3.610(2) 6_765 ?
Ga4 Pb2 3.644(3) 2_775 ?
Ga3 S8 2.258(5) . ?
Ga3 S8 2.258(5) 3_655 ?
Ga3 S9 2.304(7) 5 ?
Ga3 S1 2.319(8) . ?
Ga3 Pb1 3.540(2) 3_655 ?
S1 Pb1 2.9506(18) 3_655 ?
S2 Ga1 2.283(5) 1_556 ?
S2 Pb1 3.295(6) 1_556 ?
S4 Ga4 2.284(5) 6_764 ?
S4 Pb2 2.921(5) 2_775 ?
S5 Ga4 2.227(5) 1_554 ?
S5 Zn1 2.278(5) 1_554 ?
S5 Pb2 3.445(5) 2_775 ?
S6 Ga1 2.244(7) 5 ?
S6 Pb3 2.804(9) 5_554 ?
S6 Pb2 3.0941(19) 3_655 ?
S7 Ga4 2.287(5) 6_764 ?
S7 Pb2 2.797(6) 5_544 ?
S8 Ga2 2.261(5) 1_554 ?
S8 Pb3 3.092(5) 5_554 ?
S9 Ga3 2.304(7) 5_544 ?
S9 Ga2 2.337(4) 5_544 ?
S9 Ga2 2.337(4) 7_644 ?

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
S7 Pb1 S1 78.97(17) . . ?
S7 Pb1 S4 75.08(14) . . ?
S1 Pb1 S4 144.06(19) . . ?
S7 Pb1 S5 109.85(13) . . ?
S1 Pb1 S5 145.54(18) . . ?
S4 Pb1 S5 68.25(14) . . ?
S7 Pb1 S2 81.28(14) . . ?
S1 Pb1 S2 77.48(17) . . ?
S4 Pb1 S2 74.40(14) . . ?
S5 Pb1 S2 135.90(13) . . ?
S7 Pb1 S3 143.48(15) . . ?
S1 Pb1 S3 112.21(16) . . ?
S4 Pb1 S3 77.40(13) . . ?
S5 Pb1 S3 81.03(13) . . ?
S2 Pb1 S3 68.46(12) . . ?
S7 Pb1 S8 149.13(14) . . ?
S1 Pb1 S8 75.86(16) . . ?
S4 Pb1 S8 135.09(13) . . ?
S5 Pb1 S8 82.54(13) . . ?
S2 Pb1 S8 109.97(12) . . ?
S3 Pb1 S8 64.54(12) . . ?
S7 Pb1 S2 84.42(14) . 1_554 ?
S1 Pb1 S2 70.39(17) . 1_554 ?
S4 Pb1 S2 130.05(13) . 1_554 ?
S5 Pb1 S2 77.27(13) . 1_554 ?
S2 Pb1 S2 146.75(16) . 1_554 ?
S3 Pb1 S2 132.00(12) . 1_554 ?
S8 Pb1 S2 70.52(11) . 1_554 ?
S7 Pb1 Ga3 119.57(11) . . ?
S1 Pb1 Ga3 40.61(14) . . ?
S4 Pb1 Ga3 152.37(12) . . ?
S5 Pb1 Ga3 120.54(11) . . ?
S2 Pb1 Ga3 84.45(10) . . ?
S3 Pb1 Ga3 78.41(10) . . ?
S8 Pb1 Ga3 38.37(10) . . ?
S2 Pb1 Ga3 76.82(10) 1_554 . ?
S7 Pb1 Ga4 39.30(10) . 6_764 ?
S1 Pb1 Ga4 118.07(14) . 6_764 ?
S4 Pb1 Ga4 39.08(9) . 6_764 ?
S5 Pb1 Ga4 78.96(10) . 6_764 ?
S2 Pb1 Ga4 86.72(9) . 6_764 ?
S3 Pb1 Ga4 116.34(10) . 6_764 ?
S8 Pb1 Ga4 160.95(10) . 6_764 ?
S2 Pb1 Ga4 100.78(9) 1_554 6_764 ?
Ga3 Pb1 Ga4 158.40(6) . 6_764 ?
S7 Pb2 S4 75.65(14) 5 2_775 ?
S7 Pb2 S3 86.49(14) 5 . ?
S4 Pb2 S3 83.45(14) 2_775 . ?
S7 Pb2 S6 80.80(19) 5 . ?
S4 Pb2 S6 150.16(16) 2_775 . ?
S3 Pb2 S6 113.35(16) . . ?
S7 Pb2 S8 135.97(13) 5 . ?
S4 Pb2 S8 134.97(14) 2_775 . ?
S3 Pb2 S8 70.87(14) . . ?
S6 Pb2 S8 74.85(17) . . ?
S7 Pb2 S5 138.56(13) 5 2_775 ?
S4 Pb2 S5 64.15(13) 2_775 2_775 ?
S3 Pb2 S5 79.65(13) . 2_775 ?
S6 Pb2 S5 140.46(18) . 2_775 ?
S8 Pb2 S5 75.04(13) . 2_775 ?
S7 Pb2 Ga4 38.87(10) 5 2_775 ?
S4 Pb2 Ga4 38.73(11) 2_775 2_775 ?
S3 Pb2 Ga4 74.26(11) . 2_775 ?
S6 Pb2 Ga4 119.60(17) . 2_775 ?
S8 Pb2 Ga4 145.12(11) . 2_775 ?
S5 Pb2 Ga4 99.70(10) 2_775 2_775 ?
S7 Pb2 Pb3 123.16(10) 5 5_554 ?
S4 Pb2 Pb3 151.72(11) 2_775 5_554 ?
S3 Pb2 Pb3 116.12(11) . 5_554 ?
S6 Pb2 Pb3 42.60(16) . 5_554 ?
S8 Pb2 Pb3 47.88(10) . 5_554 ?
S5 Pb2 Pb3 97.86(9) 2_775 5_554 ?
Ga4 Pb2 Pb3 161.05(5) 2_775 5_554 ?
S6 Pb3 S7 100.95(13) 5_545 . ?
S6 Pb3 S7 100.95(13) 5_545 3_655 ?
S7 Pb3 S7 128.5(2) . 3_655 ?
S6 Pb3 S8 79.65(14) 5_545 7_645 ?
S7 Pb3 S8 151.52(13) . 7_645 ?
S7 Pb3 S8 78.40(13) 3_655 7_645 ?
S6 Pb3 S8 79.65(14) 5_545 5_545 ?
S7 Pb3 S8 78.40(13) . 5_545 ?
S7 Pb3 S8 151.52(13) 3_655 5_545 ?
S8 Pb3 S8 73.68(19) 7_645 5_545 ?
S6 Pb3 S9 142.03(19) 5_545 . ?
S7 Pb3 S9 95.21(11) . . ?
S7 Pb3 S9 95.21(11) 3_655 . ?
S8 Pb3 S9 70.23(14) 7_645 . ?
S8 Pb3 S9 70.23(14) 5_545 . ?
S6 Pb3 Pb2 48.34(4) 5_545 5_545 ?
S7 Pb3 Pb2 60.89(11) . 5_545 ?
S7 Pb3 Pb2 147.05(11) 3_655 5_545 ?
S8 Pb3 Pb2 102.82(10) 7_645 5_545 ?
S8 Pb3 Pb2 48.65(9) 5_545 5_545 ?
S9 Pb3 Pb2 116.44(8) . 5_545 ?
S6 Pb3 Pb2 48.34(4) 5_545 7_645 ?
S7 Pb3 Pb2 147.05(11) . 7_645 ?
S7 Pb3 Pb2 60.89(11) 3_655 7_645 ?
S8 Pb3 Pb2 48.65(9) 7_645 7_645 ?
S8 Pb3 Pb2 102.82(10) 5_545 7_645 ?
S9 Pb3 Pb2 116.44(8) . 7_645 ?
Pb2 Pb3 Pb2 94.78(5) 5_545 7_645 ?
S6 Ga1 S2 105.23(15) 5_544 3_654 ?
S6 Ga1 S2 105.23(15) 5_544 1_554 ?
S2 Ga1 S2 128.8(3) 3_654 1_554 ?
S6 Ga1 S1 110.8(3) 5_544 . ?
S2 Ga1 S1 103.13(17) 3_654 . ?
S2 Ga1 S1 103.13(17) 1_554 . ?
S5 Zn1 S5 97.5(3) 2_776 1_556 ?
S5 Zn1 S3 113.22(18) 2_776 . ?
S5 Zn1 S3 115.26(18) 1_556 . ?
S5 Zn1 S3 115.26(18) 2_776 2_775 ?
S5 Zn1 S3 113.22(18) 1_556 2_775 ?
S3 Zn1 S3 103.0(3) . 2_775 ?
S8 Ga2 S2 113.8(2) 1_556 . ?
S8 Ga2 S3 113.36(19) 1_556 . ?
S2 Ga2 S3 106.3(2) . . ?
S8 Ga2 S9 104.2(2) 1_556 5 ?
S2 Ga2 S9 110.3(2) . 5 ?
S3 Ga2 S9 108.8(2) . 5 ?
S5 Ga4 S4 115.6(2) 1_556 6_765 ?
S5 Ga4 S7 115.4(2) 1_556 6_765 ?
S4 Ga4 S7 102.01(19) 6_765 6_765 ?
S5 Ga4 S4 111.42(19) 1_556 . ?
S4 Ga4 S4 110.64(15) 6_765 . ?
S7 Ga4 S4 100.3(2) 6_765 . ?
S5 Ga4 Pb1 152.95(16) 1_556 6_765 ?
S4 Ga4 Pb1 55.73(13) 6_765 6_765 ?
S7 Ga4 Pb1 51.66(11) 6_765 6_765 ?
S4 Ga4 Pb1 95.12(14) . 6_765 ?
S5 Ga4 Pb2 113.87(14) 1_556 2_775 ?
S4 Ga4 Pb2 130.20(14) 6_765 2_775 ?
S7 Ga4 Pb2 50.14(14) 6_765 2_775 ?
S4 Ga4 Pb2 53.23(14) . 2_775 ?
Pb1 Ga4 Pb2 77.47(5) 6_765 2_775 ?
S8 Ga3 S8 110.4(3) . 3_655 ?
S8 Ga3 S9 105.60(18) . 5 ?
S8 Ga3 S9 105.60(18) 3_655 5 ?
S8 Ga3 S1 114.45(18) . . ?
S8 Ga3 S1 114.45(18) 3_655 . ?
S9 Ga3 S1 105.4(3) 5 . ?
S8 Ga3 Pb1 158.92(19) . 3_655 ?
S8 Ga3 Pb1 64.91(14) 3_655 3_655 ?
S9 Ga3 Pb1 95.35(12) 5 3_655 ?
S1 Ga3 Pb1 55.91(5) . 3_655 ?
S8 Ga3 Pb1 64.91(14) . . ?
S8 Ga3 Pb1 158.92(19) 3_655 . ?
S9 Ga3 Pb1 95.35(12) 5 . ?
S1 Ga3 Pb1 55.91(5) . . ?
Pb1 Ga3 Pb1 111.42(9) 3_655 . ?
Ga3 S1 Ga1 105.0(3) . . ?
Ga3 S1 Pb1 83.48(14) . . ?
Ga1 S1 Pb1 95.51(15) . . ?
Ga3 S1 Pb1 83.48(14) . 3_655 ?
Ga1 S1 Pb1 95.51(15) . 3_655 ?
Pb1 S1 Pb1 164.7(3) . 3_655 ?
Ga2 S2 Ga1 104.8(2) . 1_556 ?
Ga2 S2 Pb1 83.51(17) . . ?
Ga1 S2 Pb1 125.6(2) 1_556 . ?
Ga2 S2 Pb1 85.93(16) . 1_556 ?
Ga1 S2 Pb1 87.58(19) 1_556 1_556 ?
Pb1 S2 Pb1 146.75(16) . 1_556 ?
Ga2 S3 Zn1 105.2(2) . . ?
Ga2 S3 Pb2 107.50(19) . . ?
Zn1 S3 Pb2 119.33(19) . . ?
Ga2 S3 Pb1 81.41(15) . . ?
Zn1 S3 Pb1 119.65(18) . . ?
Pb2 S3 Pb1 114.70(16) . . ?
Ga4 S4 Ga4 116.5(2) 6_764 . ?
Ga4 S4 Pb2 106.27(19) 6_764 2_775 ?
Ga4 S4 Pb2 88.04(17) . 2_775 ?
Ga4 S4 Pb1 85.19(16) 6_764 . ?
Ga4 S4 Pb1 137.6(2) . . ?
Pb2 S4 Pb1 122.22(18) 2_775 . ?
Ga4 S5 Zn1 104.7(2) 1_554 1_554 ?
Ga4 S5 Pb1 107.01(18) 1_554 . ?
Zn1 S5 Pb1 122.7(2) 1_554 . ?
Ga4 S5 Pb2 81.92(15) 1_554 2_775 ?
Zn1 S5 Pb2 126.07(19) 1_554 2_775 ?
Pb1 S5 Pb2 104.85(14) . 2_775 ?
Ga1 S6 Pb3 107.0(3) 5 5_554 ?
Ga1 S6 Pb2 99.71(12) 5 3_655 ?
Pb3 S6 Pb2 89.06(16) 5_554 3_655 ?
Ga1 S6 Pb2 99.71(12) 5 . ?
Pb3 S6 Pb2 89.06(16) 5_554 . ?
Pb2 S6 Pb2 160.2(2) 3_655 . ?
Ga4 S7 Pb2 90.99(17) 6_764 5_544 ?
Ga4 S7 Pb1 89.04(15) 6_764 . ?
Pb2 S7 Pb1 107.47(18) 5_544 . ?
Ga4 S7 Pb3 145.2(2) 6_764 . ?
Pb2 S7 Pb3 104.47(15) 5_544 . ?
Pb1 S7 Pb3 114.67(15) . . ?
Ga3 S8 Ga2 103.5(2) . 1_554 ?
Ga3 S8 Pb3 86.47(18) . 5_554 ?
Ga2 S8 Pb3 91.13(17) 1_554 5_554 ?
Ga3 S8 Pb2 112.9(2) . . ?
Ga2 S8 Pb2 142.7(2) 1_554 . ?
Pb3 S8 Pb2 83.47(12) 5_554 . ?
Ga3 S8 Pb1 76.72(15) . . ?
Ga2 S8 Pb1 86.23(16) 1_554 . ?
Pb3 S8 Pb1 161.83(18) 5_554 . ?
Pb2 S8 Pb1 109.24(16) . . ?
Ga3 S9 Ga2 110.36(19) 5_544 5_544 ?
Ga3 S9 Ga2 110.36(19) 5_544 7_644 ?
Ga2 S9 Ga2 114.0(3) 5_544 7_644 ?
Ga3 S9 Pb3 146.2(3) 5_544 . ?
Ga2 S9 Pb3 86.78(18) 5_544 . ?
Ga2 S9 Pb3 86.78(18) 7_644 . ?

_diffrn_measured_fraction_theta_max 0.997
_diffrn_reflns_theta_full        27.46
_diffrn_measured_fraction_theta_full 0.997
_refine_diff_density_max         2.236
_refine_diff_density_min         -3.397
_refine_diff_density_rms         0.476
