data_eight member of lillianite hologous series _audit_creation_method SHELXL-97 _chemical_name_systematic ; ? ; _chemical_name_common ? _chemical_melting_point ? _chemical_formula_moiety ? _chemical_formula_sum 'Ag2.20 Bi4.20 Pb2.60 S10' _chemical_formula_weight 1974.32 loop_ _atom_type_symbol _atom_type_description _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_source 'S' 'S' 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'Ag' 'Ag' -0.8971 1.1015 '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' 'Bi' 'Bi' -4.1077 10.2566 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' _symmetry_cell_setting 'Orthorhombic' _symmetry_space_group_name_H-M 'Cmcm ' loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-x, -y, z+1/2' '-x, y, -z+1/2' 'x, -y, -z' 'x+1/2, y+1/2, z' '-x+1/2, -y+1/2, z+1/2' '-x+1/2, y+1/2, -z+1/2' 'x+1/2, -y+1/2, -z' '-x, -y, -z' 'x, y, -z-1/2' 'x, -y, z-1/2' '-x, y, z' '-x+1/2, -y+1/2, -z' 'x+1/2, y+1/2, -z-1/2' 'x+1/2, -y+1/2, z-1/2' '-x+1/2, y+1/2, z' _cell_length_a 4.0841(11) _cell_length_b 13.453(4) _cell_length_c 33.932(9) _cell_angle_alpha 90.00 _cell_angle_beta 90.00 _cell_angle_gamma 90.00 _cell_volume 1864.4(9) _cell_formula_units_Z 4 _cell_measurement_temperature 546(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 7.034 _exptl_crystal_density_method 'not measured' _exptl_crystal_F_000 3301 _exptl_absorpt_coefficient_mu 66.228 _exptl_absorpt_correction_type ? _exptl_absorpt_correction_T_min ? _exptl_absorpt_correction_T_max ? _exptl_absorpt_process_details ? _exptl_special_details ; ? ; _diffrn_ambient_temperature 546(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 10711 _diffrn_reflns_av_R_equivalents 0.0973 _diffrn_reflns_av_sigmaI/netI 0.0387 _diffrn_reflns_limit_h_min -5 _diffrn_reflns_limit_h_max 5 _diffrn_reflns_limit_k_min -17 _diffrn_reflns_limit_k_max 17 _diffrn_reflns_limit_l_min -45 _diffrn_reflns_limit_l_max 43 _diffrn_reflns_theta_min 1.20 _diffrn_reflns_theta_max 28.37 _reflns_number_total 1286 _reflns_number_gt 1132 _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 F^2^ against ALL reflections. The weighted R-factor wR and goodness of fit S are based on F^2^, conventional R-factors R are based on F, with F set to zero for negative F^2^. The threshold expression of F^2^ > 2sigma(F^2^) is used only for calculating R-factors(gt) etc. and is not relevant to the choice of reflections for refinement. R-factors based on F^2^ 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/[\s^2^(Fo^2^)+(0.0487P)^2^+38.1207P] where P=(Fo^2^+2Fc^2^)/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 0.00000(2) _refine_ls_extinction_expression 'Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^' _refine_ls_number_reflns 1286 _refine_ls_number_parameters 65 _refine_ls_number_restraints 0 _refine_ls_R_factor_all 0.0417 _refine_ls_R_factor_gt 0.0366 _refine_ls_wR_factor_ref 0.0956 _refine_ls_wR_factor_gt 0.0919 _refine_ls_goodness_of_fit_ref 1.046 _refine_ls_restrained_S_all 1.046 _refine_ls_shift/su_max 2.132 _refine_ls_shift/su_mean 0.033 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 0.0000 0.09232(5) 0.42149(2) 0.0343(3) Uani 0.529(6) 2 d SP . . Ag1 Ag 0.0000 0.09232(5) 0.42149(2) 0.0343(3) Uani 0.471(6) 2 d SP . . Bi1 Bi 0.0000 0.18070(4) 0.632517(14) 0.02896(19) Uani 1 2 d S . . Pb2 Pb 0.0000 0.27343(7) 0.2500 0.0465(3) Uani 1 4 d S . . Bi2 Bi 0.0000 0.36320(4) 0.474307(17) 0.0335(3) Uani 0.742(7) 2 d SP . . Ag2 Ag 0.0000 0.36320(4) 0.474307(17) 0.0335(3) Uani 0.258(7) 2 d SP . . Bi3 Bi 0.0000 0.45846(6) 0.68301(2) 0.0358(3) Uani 0.564(6) 2 d SP . . Ag3 Ag 0.0000 0.45846(6) 0.68301(2) 0.0358(3) Uani 0.436(6) 2 d SP . . S1 S 0.0000 0.0000 0.5000 0.0405(12) Uani 1 4 d S . . S2 S 0.0000 0.0906(3) 0.70066(9) 0.0294(7) Uani 1 2 d S . . S3 S 0.0000 0.1914(3) 0.34185(12) 0.0378(8) Uani 1 2 d S . . S4 S 0.0000 0.2750(3) 0.54923(11) 0.0398(9) Uani 1 2 d S . . S5 S 0.0000 0.3694(4) 0.7500 0.0376(11) Uani 1 4 d S . . S6 S 0.0000 0.4531(3) 0.39715(12) 0.0389(8) Uani 1 2 d S . . loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_23 _atom_site_aniso_U_13 _atom_site_aniso_U_12 Pb1 0.0317(4) 0.0308(4) 0.0404(4) -0.0027(3) 0.000 0.000 Ag1 0.0317(4) 0.0308(4) 0.0404(4) -0.0027(3) 0.000 0.000 Bi1 0.0271(3) 0.0289(3) 0.0309(3) 0.00124(19) 0.000 0.000 Pb2 0.0313(4) 0.0407(5) 0.0674(6) 0.000 0.000 0.000 Bi2 0.0322(4) 0.0345(4) 0.0338(4) 0.0005(3) 0.000 0.000 Ag2 0.0322(4) 0.0345(4) 0.0338(4) 0.0005(3) 0.000 0.000 Bi3 0.0306(4) 0.0374(4) 0.0393(4) 0.0011(3) 0.000 0.000 Ag3 0.0306(4) 0.0374(4) 0.0393(4) 0.0011(3) 0.000 0.000 S1 0.033(3) 0.033(3) 0.055(3) -0.006(2) 0.000 0.000 S2 0.0324(16) 0.0295(16) 0.0265(14) 0.0004(12) 0.000 0.000 S3 0.0285(16) 0.0317(18) 0.053(2) -0.0121(16) 0.000 0.000 S4 0.039(2) 0.039(2) 0.0410(18) 0.0042(17) 0.000 0.000 S5 0.028(2) 0.028(2) 0.057(3) 0.000 0.000 0.000 S6 0.0356(19) 0.036(2) 0.0451(19) -0.0037(17) 0.000 0.000 _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 S4 2.888(3) 13_556 ? Pb1 S4 2.888(3) 13_456 ? Pb1 S6 2.891(3) 5_445 ? Pb1 S6 2.891(3) 5_545 ? Pb1 S1 2.9392(10) . ? Pb1 S3 3.014(4) . ? Bi1 S2 2.611(3) . ? Bi1 S3 2.808(3) 13_556 ? Bi1 S3 2.808(3) 13_456 ? Bi1 S6 2.903(3) 13_456 ? Bi1 S6 2.903(3) 13_556 ? Bi1 S4 3.098(4) . ? Pb2 S5 2.804(4) 13_456 ? Pb2 S5 2.804(4) 13_556 ? Bi2 S4 2.805(4) . ? Bi2 S4 2.875(3) 13_456 ? Bi2 S4 2.875(3) 13_556 ? Bi2 S1 2.8840(7) 5 ? Bi2 S1 2.8840(7) 5_455 ? Bi2 S6 2.884(4) . ? Bi3 S5 2.569(3) . ? Bi3 S2 2.773(2) 5 ? Bi3 S2 2.773(2) 5_455 ? Bi3 S6 2.969(4) 9_566 ? Bi3 S3 2.991(3) 13_456 ? Bi3 S3 2.991(3) 13_556 ? S1 Ag2 2.8840(7) 13_556 ? S1 Ag2 2.8840(7) 5_445 ? S1 Bi2 2.8840(7) 13_556 ? S1 Bi2 2.8840(7) 5_445 ? S1 Ag2 2.8840(7) 13_456 ? S1 Ag2 2.8840(7) 5_545 ? S1 Bi2 2.8840(7) 5_545 ? S1 Bi2 2.8840(7) 13_456 ? S1 Pb1 2.9392(10) 9_556 ? S1 Ag1 2.9392(10) 9_556 ? S2 Ag3 2.773(2) 5_445 ? S2 Bi3 2.773(2) 5_445 ? S2 Ag3 2.773(2) 5_545 ? S2 Bi3 2.773(2) 5_545 ? S3 Bi1 2.808(3) 13_556 ? S3 Bi1 2.808(3) 13_456 ? S3 Bi3 2.991(3) 13_456 ? S3 Bi3 2.991(3) 13_556 ? S4 Ag2 2.875(3) 13_456 ? S4 Bi2 2.875(3) 13_456 ? S4 Ag2 2.875(3) 13_556 ? S4 Bi2 2.875(3) 13_556 ? S4 Pb1 2.888(3) 13_556 ? S4 Ag1 2.888(3) 13_556 ? S4 Pb1 2.888(3) 13_456 ? S4 Ag1 2.888(3) 13_456 ? S5 Ag3 2.569(3) 10_557 ? S5 Bi3 2.569(3) 10_557 ? S5 Pb2 2.804(4) 13_456 ? S5 Pb2 2.804(4) 13_556 ? S6 Ag1 2.891(3) 5 ? S6 Pb1 2.891(3) 5 ? S6 Ag1 2.891(3) 5_455 ? S6 Pb1 2.891(3) 5_455 ? S6 Bi1 2.903(3) 13_456 ? S6 Bi1 2.903(3) 13_556 ? S6 Ag3 2.969(4) 9_566 ? S6 Bi3 2.969(4) 9_566 ? 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 S4 Pb1 S4 89.99(12) 13_556 13_456 ? S4 Pb1 S6 176.25(12) 13_556 5_445 ? S4 Pb1 S6 89.94(8) 13_456 5_445 ? S4 Pb1 S6 89.94(8) 13_556 5_545 ? S4 Pb1 S6 176.25(12) 13_456 5_545 ? S6 Pb1 S6 89.88(12) 5_445 5_545 ? S4 Pb1 S1 87.09(8) 13_556 . ? S4 Pb1 S1 87.09(8) 13_456 . ? S6 Pb1 S1 89.16(8) 5_445 . ? S6 Pb1 S1 89.16(8) 5_545 . ? S4 Pb1 S3 92.02(9) 13_556 . ? S4 Pb1 S3 92.02(9) 13_456 . ? S6 Pb1 S3 91.74(10) 5_445 . ? S6 Pb1 S3 91.74(10) 5_545 . ? S1 Pb1 S3 178.74(8) . . ? S2 Bi1 S3 90.59(10) . 13_556 ? S2 Bi1 S3 90.59(10) . 13_456 ? S3 Bi1 S3 93.30(11) 13_556 13_456 ? S2 Bi1 S6 91.09(10) . 13_456 ? S3 Bi1 S6 177.44(10) 13_556 13_456 ? S3 Bi1 S6 88.62(7) 13_456 13_456 ? S2 Bi1 S6 91.09(10) . 13_556 ? S3 Bi1 S6 88.62(7) 13_556 13_556 ? S3 Bi1 S6 177.44(10) 13_456 13_556 ? S6 Bi1 S6 89.42(11) 13_456 13_556 ? S2 Bi1 S4 176.51(12) . . ? S3 Bi1 S4 91.81(10) 13_556 . ? S3 Bi1 S4 91.81(10) 13_456 . ? S6 Bi1 S4 86.43(10) 13_456 . ? S6 Bi1 S4 86.43(10) 13_556 . ? S5 Pb2 S5 93.48(16) 13_456 13_556 ? S4 Bi2 S4 88.75(10) . 13_456 ? S4 Bi2 S4 88.75(10) . 13_556 ? S4 Bi2 S4 90.51(12) 13_456 13_556 ? S4 Bi2 S1 89.76(6) . 5 ? S4 Bi2 S1 178.50(8) 13_456 5 ? S4 Bi2 S1 89.65(6) 13_556 5 ? S4 Bi2 S1 89.76(6) . 5_455 ? S4 Bi2 S1 89.65(6) 13_456 5_455 ? S4 Bi2 S1 178.50(8) 13_556 5_455 ? S1 Bi2 S1 90.16(3) 5 5_455 ? S4 Bi2 S6 179.80(11) . . ? S4 Bi2 S6 91.11(10) 13_456 . ? S4 Bi2 S6 91.11(10) 13_556 . ? S1 Bi2 S6 90.38(6) 5 . ? S1 Bi2 S6 90.38(6) 5_455 . ? S5 Bi3 S2 96.19(10) . 5 ? S5 Bi3 S2 96.19(10) . 5_455 ? S2 Bi3 S2 94.87(11) 5 5_455 ? S5 Bi3 S6 175.83(14) . 9_566 ? S2 Bi3 S6 86.62(9) 5 9_566 ? S2 Bi3 S6 86.62(9) 5_455 9_566 ? S5 Bi3 S3 86.28(11) . 13_456 ? S2 Bi3 S3 174.76(9) 5 13_456 ? S2 Bi3 S3 89.44(7) 5_455 13_456 ? S6 Bi3 S3 90.67(10) 9_566 13_456 ? S5 Bi3 S3 86.28(11) . 13_556 ? S2 Bi3 S3 89.44(7) 5 13_556 ? S2 Bi3 S3 174.76(9) 5_455 13_556 ? S6 Bi3 S3 90.67(10) 9_566 13_556 ? S3 Bi3 S3 86.11(10) 13_456 13_556 ? Ag2 S1 Ag2 180.0 13_556 5_445 ? Ag2 S1 Bi2 0.00(2) 13_556 13_556 ? Ag2 S1 Bi2 180.00(2) 5_445 13_556 ? Ag2 S1 Bi2 180.0 13_556 5_445 ? Ag2 S1 Bi2 0.00(3) 5_445 5_445 ? Bi2 S1 Bi2 180.0 13_556 5_445 ? Ag2 S1 Ag2 90.16(3) 13_556 13_456 ? Ag2 S1 Ag2 89.84(3) 5_445 13_456 ? Bi2 S1 Ag2 90.16(3) 13_556 13_456 ? Bi2 S1 Ag2 89.84(3) 5_445 13_456 ? Ag2 S1 Ag2 89.84(3) 13_556 5_545 ? Ag2 S1 Ag2 90.16(3) 5_445 5_545 ? Bi2 S1 Ag2 89.84(3) 13_556 5_545 ? Bi2 S1 Ag2 90.16(3) 5_445 5_545 ? Ag2 S1 Ag2 180.00(2) 13_456 5_545 ? Ag2 S1 Bi2 89.84(3) 13_556 5_545 ? Ag2 S1 Bi2 90.16(3) 5_445 5_545 ? Bi2 S1 Bi2 89.84(3) 13_556 5_545 ? Bi2 S1 Bi2 90.16(3) 5_445 5_545 ? Ag2 S1 Bi2 180.00(2) 13_456 5_545 ? Ag2 S1 Bi2 0.00(3) 5_545 5_545 ? Ag2 S1 Bi2 90.16(3) 13_556 13_456 ? Ag2 S1 Bi2 89.84(3) 5_445 13_456 ? Bi2 S1 Bi2 90.16(3) 13_556 13_456 ? Bi2 S1 Bi2 89.84(3) 5_445 13_456 ? Ag2 S1 Bi2 0.00(2) 13_456 13_456 ? Ag2 S1 Bi2 180.00(2) 5_545 13_456 ? Bi2 S1 Bi2 180.00(2) 5_545 13_456 ? Ag2 S1 Pb1 90.247(19) 13_556 . ? Ag2 S1 Pb1 89.753(19) 5_445 . ? Bi2 S1 Pb1 90.247(19) 13_556 . ? Bi2 S1 Pb1 89.753(19) 5_445 . ? Ag2 S1 Pb1 90.247(19) 13_456 . ? Ag2 S1 Pb1 89.753(19) 5_545 . ? Bi2 S1 Pb1 89.753(19) 5_545 . ? Bi2 S1 Pb1 90.247(19) 13_456 . ? Ag2 S1 Pb1 89.753(19) 13_556 9_556 ? Ag2 S1 Pb1 90.247(19) 5_445 9_556 ? Bi2 S1 Pb1 89.753(19) 13_556 9_556 ? Bi2 S1 Pb1 90.247(19) 5_445 9_556 ? Ag2 S1 Pb1 89.753(19) 13_456 9_556 ? Ag2 S1 Pb1 90.247(19) 5_545 9_556 ? Bi2 S1 Pb1 90.247(19) 5_545 9_556 ? Bi2 S1 Pb1 89.753(19) 13_456 9_556 ? Pb1 S1 Pb1 180.0 . 9_556 ? Ag2 S1 Ag1 89.753(19) 13_556 9_556 ? Ag2 S1 Ag1 90.247(19) 5_445 9_556 ? Bi2 S1 Ag1 89.753(19) 13_556 9_556 ? Bi2 S1 Ag1 90.247(19) 5_445 9_556 ? Ag2 S1 Ag1 89.753(19) 13_456 9_556 ? Ag2 S1 Ag1 90.247(19) 5_545 9_556 ? Bi2 S1 Ag1 90.247(19) 5_545 9_556 ? Bi2 S1 Ag1 89.753(19) 13_456 9_556 ? Pb1 S1 Ag1 180.0 . 9_556 ? Pb1 S1 Ag1 0.00(2) 9_556 9_556 ? Bi1 S2 Ag3 96.11(9) . 5_445 ? Bi1 S2 Bi3 96.11(9) . 5_445 ? Ag3 S2 Bi3 0.00(2) 5_445 5_445 ? Bi1 S2 Ag3 96.11(9) . 5_545 ? Ag3 S2 Ag3 94.87(11) 5_445 5_545 ? Bi3 S2 Ag3 94.87(11) 5_445 5_545 ? Bi1 S2 Bi3 96.11(9) . 5_545 ? Ag3 S2 Bi3 94.87(11) 5_445 5_545 ? Bi3 S2 Bi3 94.87(11) 5_445 5_545 ? Ag3 S2 Bi3 0.00(4) 5_545 5_545 ? Bi1 S3 Bi1 93.30(11) 13_556 13_456 ? Bi1 S3 Bi3 175.37(13) 13_556 13_456 ? Bi1 S3 Bi3 90.22(2) 13_456 13_456 ? Bi1 S3 Bi3 90.22(2) 13_556 13_556 ? Bi1 S3 Bi3 175.37(13) 13_456 13_556 ? Bi3 S3 Bi3 86.11(10) 13_456 13_556 ? Bi1 S3 Pb1 89.61(10) 13_556 . ? Bi1 S3 Pb1 89.61(10) 13_456 . ? Bi3 S3 Pb1 87.40(10) 13_456 . ? Bi3 S3 Pb1 87.40(10) 13_556 . ? Bi2 S4 Ag2 91.25(10) . 13_456 ? Bi2 S4 Bi2 91.25(10) . 13_456 ? Ag2 S4 Bi2 0.000(18) 13_456 13_456 ? Bi2 S4 Ag2 91.25(10) . 13_556 ? Ag2 S4 Ag2 90.51(12) 13_456 13_556 ? Bi2 S4 Ag2 90.51(12) 13_456 13_556 ? Bi2 S4 Bi2 91.25(10) . 13_556 ? Ag2 S4 Bi2 90.51(12) 13_456 13_556 ? Bi2 S4 Bi2 90.51(12) 13_456 13_556 ? Ag2 S4 Bi2 0.00(3) 13_556 13_556 ? Bi2 S4 Pb1 92.90(10) . 13_556 ? Ag2 S4 Pb1 175.85(15) 13_456 13_556 ? Bi2 S4 Pb1 175.85(15) 13_456 13_556 ? Ag2 S4 Pb1 89.60(2) 13_556 13_556 ? Bi2 S4 Pb1 89.60(2) 13_556 13_556 ? Bi2 S4 Ag1 92.90(10) . 13_556 ? Ag2 S4 Ag1 175.85(15) 13_456 13_556 ? Bi2 S4 Ag1 175.85(15) 13_456 13_556 ? Ag2 S4 Ag1 89.60(2) 13_556 13_556 ? Bi2 S4 Ag1 89.60(2) 13_556 13_556 ? Pb1 S4 Ag1 0.00(3) 13_556 13_556 ? Bi2 S4 Pb1 92.90(10) . 13_456 ? Ag2 S4 Pb1 89.60(2) 13_456 13_456 ? Bi2 S4 Pb1 89.60(2) 13_456 13_456 ? Ag2 S4 Pb1 175.85(15) 13_556 13_456 ? Bi2 S4 Pb1 175.85(15) 13_556 13_456 ? Pb1 S4 Pb1 89.99(12) 13_556 13_456 ? Ag1 S4 Pb1 89.99(12) 13_556 13_456 ? Bi2 S4 Ag1 92.90(10) . 13_456 ? Ag2 S4 Ag1 89.60(2) 13_456 13_456 ? Bi2 S4 Ag1 89.60(2) 13_456 13_456 ? Ag2 S4 Ag1 175.85(15) 13_556 13_456 ? Bi2 S4 Ag1 175.85(15) 13_556 13_456 ? Pb1 S4 Ag1 89.99(12) 13_556 13_456 ? Ag1 S4 Ag1 89.99(12) 13_556 13_456 ? Pb1 S4 Ag1 0.00(3) 13_456 13_456 ? Bi2 S4 Bi1 179.18(16) . . ? Ag2 S4 Bi1 89.33(9) 13_456 . ? Bi2 S4 Bi1 89.33(9) 13_456 . ? Ag2 S4 Bi1 89.33(9) 13_556 . ? Bi2 S4 Bi1 89.33(9) 13_556 . ? Pb1 S4 Bi1 86.52(9) 13_556 . ? Ag1 S4 Bi1 86.52(9) 13_556 . ? Pb1 S4 Bi1 86.52(9) 13_456 . ? Ag1 S4 Bi1 86.52(9) 13_456 . ? Ag3 S5 Bi3 0.000(15) 10_557 10_557 ? Ag3 S5 Bi3 124.4(2) 10_557 . ? Bi3 S5 Bi3 124.4(2) 10_557 . ? Ag3 S5 Pb2 108.63(4) 10_557 13_456 ? Bi3 S5 Pb2 108.63(4) 10_557 13_456 ? Bi3 S5 Pb2 108.63(4) . 13_456 ? Ag3 S5 Pb2 108.63(4) 10_557 13_556 ? Bi3 S5 Pb2 108.63(4) 10_557 13_556 ? Bi3 S5 Pb2 108.63(4) . 13_556 ? Pb2 S5 Pb2 93.48(16) 13_456 13_556 ? Ag1 S6 Pb1 0.00(3) 5 5 ? Ag1 S6 Ag1 89.88(12) 5 5_455 ? Pb1 S6 Ag1 89.88(12) 5 5_455 ? Ag1 S6 Pb1 89.88(12) 5 5_455 ? Pb1 S6 Pb1 89.88(12) 5 5_455 ? Ag1 S6 Pb1 0.00(3) 5_455 5_455 ? Ag1 S6 Bi2 90.71(10) 5 . ? Pb1 S6 Bi2 90.71(10) 5 . ? Ag1 S6 Bi2 90.71(10) 5_455 . ? Pb1 S6 Bi2 90.71(10) 5_455 . ? Ag1 S6 Bi1 176.16(16) 5 13_456 ? Pb1 S6 Bi1 176.16(16) 5 13_456 ? Ag1 S6 Bi1 90.23(2) 5_455 13_456 ? Pb1 S6 Bi1 90.23(2) 5_455 13_456 ? Bi2 S6 Bi1 93.13(10) . 13_456 ? Ag1 S6 Bi1 90.23(2) 5 13_556 ? Pb1 S6 Bi1 90.23(2) 5 13_556 ? Ag1 S6 Bi1 176.16(16) 5_455 13_556 ? Pb1 S6 Bi1 176.16(16) 5_455 13_556 ? Bi2 S6 Bi1 93.13(10) . 13_556 ? Bi1 S6 Bi1 89.42(11) 13_456 13_556 ? Ag1 S6 Ag3 90.13(10) 5 9_566 ? Pb1 S6 Ag3 90.13(10) 5 9_566 ? Ag1 S6 Ag3 90.13(10) 5_455 9_566 ? Pb1 S6 Ag3 90.13(10) 5_455 9_566 ? Bi2 S6 Ag3 178.81(16) . 9_566 ? Bi1 S6 Ag3 86.03(9) 13_456 9_566 ? Bi1 S6 Ag3 86.03(9) 13_556 9_566 ? Ag1 S6 Bi3 90.13(10) 5 9_566 ? Pb1 S6 Bi3 90.13(10) 5 9_566 ? Ag1 S6 Bi3 90.13(10) 5_455 9_566 ? Pb1 S6 Bi3 90.13(10) 5_455 9_566 ? Bi2 S6 Bi3 178.81(16) . 9_566 ? Bi1 S6 Bi3 86.03(9) 13_456 9_566 ? Bi1 S6 Bi3 86.03(9) 13_556 9_566 ? Ag3 S6 Bi3 0.000(11) 9_566 9_566 ? _diffrn_measured_fraction_theta_max 0.950 _diffrn_reflns_theta_full 28.37 _diffrn_measured_fraction_theta_full 0.950 _refine_diff_density_max 2.909 _refine_diff_density_min -1.718 _refine_diff_density_rms 0.377