 
data_hous 
 
_audit_creation_method            SHELXL-97 
_chemical_name_systematic 
; 
 ? 
; 
_chemical_name_common             ? 
_chemical_melting_point           ? 
_chemical_formula_moiety          ? 
_chemical_formula_sum 
 'H Cu O20 Pb6 Te4' 
_chemical_formula_weight          2138.09 
 
loop_ 
 _atom_type_symbol 
 _atom_type_description 
 _atom_type_scat_dispersion_real 
 _atom_type_scat_dispersion_imag 
 _atom_type_scat_source 
 'Pb'  'Pb'  -3.3944  10.1111 
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 
 'Te'  'Te'  -0.5308   1.6751 
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 
 'Cu'  'Cu'   0.3201   1.2651 
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 
 'O'  'O'   0.0106   0.0060 
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 
 'H'  'H'   0.0000   0.0000 
 '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+1/2, y+1/2, -z+1/2' 
 '-x, -y, -z' 
 'x-1/2, -y-1/2, z-1/2' 
 
_cell_length_a                    7.8552(5) 
_cell_length_b                    10.4836(7) 
_cell_length_c                    11.0426(8) 
_cell_angle_alpha                 90.00 
_cell_angle_beta                  95.547(2) 
_cell_angle_gamma                 90.00 
_cell_volume                      905.11(11) 
_cell_formula_units_Z             2 
_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           0.05 
_exptl_crystal_size_mid           0.04 
_exptl_crystal_size_min           0.02 
_exptl_crystal_density_meas       ? 
_exptl_crystal_density_diffrn     7.845 
_exptl_crystal_density_method     'not measured' 
_exptl_crystal_F_000              1780 
_exptl_absorpt_coefficient_mu     63.168 
_exptl_absorpt_correction_type    ? 
_exptl_absorpt_correction_T_min   0.1633 
_exptl_absorpt_correction_T_max   0.4509 
_exptl_absorpt_process_details    ? 
 
_exptl_special_details 
; 
 ? 
; 
 
_diffrn_ambient_temperature       293(2) 
_diffrn_radiation_wavelength      0.71075 
_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             19181 
_diffrn_reflns_av_R_equivalents   0.0718 
_diffrn_reflns_av_sigmaI/netI     0.0349 
_diffrn_reflns_limit_h_min        -10 
_diffrn_reflns_limit_h_max        10 
_diffrn_reflns_limit_k_min        -13 
_diffrn_reflns_limit_k_max        12 
_diffrn_reflns_limit_l_min        -14 
_diffrn_reflns_limit_l_max        14 
_diffrn_reflns_theta_min          3.05 
_diffrn_reflns_theta_max          27.48 
_reflns_number_total              2071 
_reflns_number_gt                 1832 
_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)+(0.0018P)²+19.9938P] 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          2071 
_refine_ls_number_parameters      146 
_refine_ls_number_restraints      1 
_refine_ls_R_factor_all           0.0357 
_refine_ls_R_factor_gt            0.0283 
_refine_ls_wR_factor_ref          0.0495 
_refine_ls_wR_factor_gt           0.0478 
_refine_ls_goodness_of_fit_ref    1.090 
_refine_ls_restrained_S_all       1.090 
_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 
Cu Cu 0.5000 0.5000 1.0000 0.0099(4) Uani 1 2 d S . . 
Te1 Te 0.15518(8) 0.36603(6) 0.80124(6) 0.00638(13) Uani 1 1 d . . . 
Te2 Te 0.79491(8) 0.24012(6) 0.60876(6) 0.00673(13) Uani 1 1 d . . . 
Pb1 Pb 0.34533(5) 0.18063(4) 0.57768(4) 0.01270(10) Uani 1 1 d . . . 
Pb2 Pb 0.45212(6) 0.53120(4) 0.66438(4) 0.01948(11) Uani 1 1 d . . . 
Pb3 Pb 0.97051(5) 0.62715(4) 0.60367(4) 0.01843(11) Uani 1 1 d . . . 
O1 O 0.9867(9) 0.1837(7) 0.5294(6) 0.0114(15) Uani 1 1 d . . . 
O2 O 0.3556(8) 0.4708(6) 0.8464(6) 0.0093(14) Uani 1 1 d . . . 
O3 O 0.6314(8) 0.1811(7) 0.4692(6) 0.0076(14) Uani 1 1 d . . . 
O4 O 0.9378(8) 0.2708(6) 0.7623(6) 0.0085(14) Uani 1 1 d . . . 
O5 O 0.2719(8) 0.2069(6) 0.7829(6) 0.0088(14) Uani 1 1 d . . . 
O6 O 0.1875(9) 0.4107(7) 0.6398(6) 0.0147(16) Uani 1 1 d . . . 
O7 O 0.4811(9) 0.0130(7) 0.6798(7) 0.0123(15) Uani 1 1 d . . . 
O8 O 0.8162(9) 0.4033(7) 0.5396(7) 0.0157(16) Uani 1 1 d . . . 
O9 O 0.5924(9) 0.2811(7) 0.6814(6) 0.0140(16) Uani 1 1 d . . . 
OH O 0.7945(9) 0.0613(7) 0.6673(7) 0.0148(16) Uani 1 1 d D . . 
H H 0.695(10) 0.081(14) 0.697(13) 0.050 Uiso 1 1 d 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 
Cu O1 1.957(7) 4_566 ? 
Cu O1 1.957(7) 2_656 ? 
Cu O2 1.971(7) . ? 
Cu O2 1.971(7) 3_667 ? 
Cu OH 2.648(8) 2_656 ? 
Cu OH 2.648(8) 4_566 ? 
Te1 O6 1.884(7) . ? 
Te1 O7 1.899(7) 2_556 ? 
Te1 O5 1.923(7) . ? 
Te1 O2 1.944(6) . ? 
Te1 O3 1.946(7) 4_566 ? 
Te1 O4 1.989(6) 1_455 ? 
Te1 Pb2 3.3771(8) . ? 
Te1 Pb1 3.5591(8) 2_556 ? 
Te1 Pb1 3.5800(8) . ? 
Te1 Pb2 3.6384(8) 2_546 ? 
Te1 Pb3 3.7076(8) 1_455 ? 
Te2 O8 1.887(7) . ? 
Te2 O9 1.899(7) . ? 
Te2 O1 1.909(7) . ? 
Te2 O4 1.967(7) . ? 
Te2 OH 1.984(8) . ? 
Te2 O3 2.006(6) . ? 
Te2 Cu 3.2786(6) 2_646 ? 
Te2 Pb3 3.4161(8) 3_766 ? 
Te2 Pb1 3.5699(8) . ? 
Te2 Pb2 3.7496(8) 2_646 ? 
Te2 Pb3 4.1369(8) 2_646 ? 
Te2 Pb2 4.1545(8) . ? 
Te2 H 2.12(14) . ? 
Pb1 O7 2.294(7) . ? 
Pb1 O9 2.399(7) . ? 
Pb1 O5 2.408(7) . ? 
Pb1 O3 2.647(7) . ? 
Pb1 O1 2.816(7) 1_455 ? 
Pb1 O6 2.826(8) . ? 
Pb1 O2 2.879(7) 2_546 ? 
Pb1 Cu 3.3512(4) 2_546 ? 
Pb1 Te1 3.5590(8) 2_546 ? 
Pb1 Pb3 3.6421(6) 3_666 ? 
Pb1 O4 3.661(7) 4_565 ? 
Pb1 Pb3 3.7155(6) 2_646 ? 
Pb1 OH 3.784(7) . ? 
Pb2 O2 2.305(7) . ? 
Pb2 O6 2.426(7) . ? 
Pb2 OH 2.608(7) 2_656 ? 
Pb2 O5 2.651(7) 2_556 ? 
Pb2 O4 2.753(7) 2_656 ? 
Pb2 O9 2.843(7) . ? 
Pb2 O8 3.012(7) 3_666 ? 
Pb2 O3 3.394(7) 3_666 ? 
Pb2 O8 3.555(8) . ? 
Pb2 Te1 3.6384(8) 2_556 ? 
Pb2 O1 3.729(7) 2_656 ? 
Pb2 Te2 3.7496(8) 2_656 ? 
Pb2 Pb2 3.8343(9) 3_666 ? 
Pb3 O5 2.423(6) 2_656 ? 
Pb3 O8 2.434(8) 3_766 ? 
Pb3 O1 2.510(7) 3_766 ? 
Pb3 O7 2.668(7) 2_656 ? 
Pb3 O8 2.704(7) . ? 
Pb3 O6 2.843(8) 1_655 ? 
Pb3 O6 2.877(7) 3_666 ? 
Pb3 O9 2.951(7) 2_656 ? 
Pb3 Te2 3.4161(8) 3_766 ? 
Pb3 OH 3.496(8) 2_656 ? 
Pb3 Pb3 3.5735(10) 3_766 ? 
Pb3 Pb1 3.6421(6) 3_666 ? 
Pb3 Te1 3.7076(8) 1_655 ? 
Pb3 Pb1 3.7155(6) 2_656 ? 
Pb3 O3 3.867(7) 3_766 ? 
O1 Cu 1.957(7) 2_646 ? 
O1 Pb3 2.510(7) 3_766 ? 
O1 Pb1 2.816(7) 1_655 ? 
O1 Pb2 3.729(7) 2_646 ? 
O2 Pb1 2.879(7) 2_556 ? 
O2 Pb3 3.873(7) 2_646 ? 
O3 Te1 1.946(7) 4_665 ? 
O3 Pb2 3.394(7) 3_666 ? 
O3 Cu 3.451(7) 2_646 ? 
O3 Pb1 3.834(7) 3_656 ? 
O3 Pb3 3.867(6) 3_766 ? 
O4 Te1 1.989(6) 1_655 ? 
O4 Pb2 2.753(7) 2_646 ? 
O4 Pb1 3.661(7) 4_666 ? 
O4 Pb3 3.958(7) 2_646 ? 
O4 Pb1 4.069(7) 1_655 ? 
O4 Cu 4.118(7) 2_646 ? 
O5 Pb3 2.423(6) 2_646 ? 
O5 Pb2 2.651(7) 2_546 ? 
O6 Pb3 2.843(8) 1_455 ? 
O6 Pb3 2.877(7) 3_666 ? 
O7 Te1 1.899(7) 2_546 ? 
O7 Pb3 2.668(7) 2_646 ? 
O7 Pb1 3.849(7) 3_656 ? 
O7 Pb2 3.964(7) 2_546 ? 
O7 Cu 4.098(7) 2_546 ? 
O8 Pb3 2.434(8) 3_766 ? 
O8 Pb2 3.012(7) 3_666 ? 
O9 Pb3 2.951(7) 2_646 ? 
OH Pb2 2.608(7) 2_646 ? 
OH Cu 2.648(8) 2_646 ? 
OH Pb3 3.496(8) 2_646 ? 
OH Pb1 3.792(8) 3_656 ? 
OH H 0.90(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 
O1 Cu O1 179.998(2) 4_566 2_656 ? 
O1 Cu O2 87.4(3) 4_566 . ? 
O1 Cu O2 92.6(3) 2_656 . ? 
O1 Cu O2 92.6(3) 4_566 3_667 ? 
O1 Cu O2 87.4(3) 2_656 3_667 ? 
O2 Cu O2 179.999(2) . 3_667 ? 
O1 Cu OH 113.6(3) 4_566 2_656 ? 
O1 Cu OH 66.4(3) 2_656 2_656 ? 
O2 Cu OH 77.1(2) . 2_656 ? 
O2 Cu OH 102.9(3) 3_667 2_656 ? 
O1 Cu OH 66.4(3) 4_566 4_566 ? 
O1 Cu OH 113.6(3) 2_656 4_566 ? 
O2 Cu OH 102.9(3) . 4_566 ? 
O2 Cu OH 77.1(3) 3_667 4_566 ? 
OH Cu OH 180.000(1) 2_656 4_566 ? 
O6 Te1 O7 91.8(3) . 2_556 ? 
O6 Te1 O5 90.4(3) . . ? 
O7 Te1 O5 174.0(3) 2_556 . ? 
O6 Te1 O2 85.6(3) . . ? 
O7 Te1 O2 88.0(3) 2_556 . ? 
O5 Te1 O2 97.7(3) . . ? 
O6 Te1 O3 177.8(3) . 4_566 ? 
O7 Te1 O3 89.6(3) 2_556 4_566 ? 
O5 Te1 O3 88.3(3) . 4_566 ? 
O2 Te1 O3 92.8(3) . 4_566 ? 
O6 Te1 O4 96.4(3) . 1_455 ? 
O7 Te1 O4 87.1(3) 2_556 1_455 ? 
O5 Te1 O4 87.1(3) . 1_455 ? 
O2 Te1 O4 174.8(3) . 1_455 ? 
O3 Te1 O4 85.4(3) 4_566 1_455 ? 
O6 Te1 Pb2 44.5(2) . . ? 
O7 Te1 Pb2 93.1(2) 2_556 . ? 
O5 Te1 Pb2 92.3(2) . . ? 
O2 Te1 Pb2 41.2(2) . . ? 
O3 Te1 Pb2 133.7(2) 4_566 . ? 
O4 Te1 Pb2 140.9(2) 1_455 . ? 
O6 Te1 Pb1 97.5(2) . 2_556 ? 
O7 Te1 Pb1 35.5(2) 2_556 2_556 ? 
O5 Te1 Pb1 149.4(2) . 2_556 ? 
O2 Te1 Pb1 53.9(2) . 2_556 ? 
O3 Te1 Pb1 82.7(2) 4_566 2_556 ? 
O4 Te1 Pb1 120.9(2) 1_455 2_556 ? 
Pb2 Te1 Pb1 73.671(16) . 2_556 ? 
O6 Te1 Pb1 51.6(2) . . ? 
O7 Te1 Pb1 142.5(2) 2_556 . ? 
O5 Te1 Pb1 38.9(2) . . ? 
O2 Te1 Pb1 95.9(2) . . ? 
O3 Te1 Pb1 127.2(2) 4_566 . ? 
O4 Te1 Pb1 89.1(2) 1_455 . ? 
Pb2 Te1 Pb1 67.512(16) . . ? 
Pb1 Te1 Pb1 141.07(2) 2_556 . ? 
O6 Te1 Cu 108.5(2) . . ? 
O7 Te1 Cu 90.9(2) 2_556 . ? 
O5 Te1 Cu 93.7(2) . . ? 
O2 Te1 Cu 23.2(2) . . ? 
O3 Te1 Cu 69.8(2) 4_566 . ? 
O4 Te1 Cu 155.1(2) 1_455 . ? 
Pb2 Te1 Cu 63.996(14) . . ? 
Pb1 Te1 Cu 55.799(11) 2_556 . ? 
Pb1 Te1 Cu 107.011(17) . . ? 
O6 Te1 Pb2 113.1(2) . 2_546 ? 
O7 Te1 Pb2 129.2(2) 2_556 2_546 ? 
O5 Te1 Pb2 44.9(2) . 2_546 ? 
O2 Te1 Pb2 135.1(2) . 2_546 ? 
O3 Te1 Pb2 67.1(2) 4_566 2_546 ? 
O4 Te1 Pb2 48.37(19) 1_455 2_546 ? 
Pb2 Te1 Pb2 135.92(2) . 2_546 ? 
Pb1 Te1 Pb2 147.80(2) 2_556 2_546 ? 
Pb1 Te1 Pb2 70.394(15) . 2_546 ? 
Cu Te1 Pb2 118.730(18) . 2_546 ? 
O6 Te1 Pb3 48.7(2) . 1_455 ? 
O7 Te1 Pb3 43.4(2) 2_556 1_455 ? 
O5 Te1 Pb3 137.9(2) . 1_455 ? 
O2 Te1 Pb3 89.7(2) . 1_455 ? 
O3 Te1 Pb3 132.86(19) 4_566 1_455 ? 
O4 Te1 Pb3 87.95(19) 1_455 1_455 ? 
Pb2 Te1 Pb3 66.793(16) . 1_455 ? 
Pb1 Te1 Pb3 61.461(14) 2_556 1_455 ? 
Pb1 Te1 Pb3 99.246(18) . 1_455 ? 
Cu Te1 Pb3 107.399(17) . 1_455 ? 
Pb2 Te1 Pb3 133.82(2) 2_546 1_455 ? 
O8 Te2 O9 94.4(3) . . ? 
O8 Te2 O1 89.5(3) . . ? 
O9 Te2 O1 174.2(3) . . ? 
O8 Te2 O4 97.8(3) . . ? 
O9 Te2 O4 91.8(3) . . ? 
O1 Te2 O4 92.1(3) . . ? 
O8 Te2 OH 172.6(3) . . ? 
O9 Te2 OH 92.8(3) . . ? 
O1 Te2 OH 83.3(3) . . ? 
O4 Te2 OH 83.8(3) . . ? 
O8 Te2 O3 92.5(3) . . ? 
O9 Te2 O3 83.9(3) . . ? 
O1 Te2 O3 91.5(3) . . ? 
O4 Te2 O3 169.1(3) . . ? 
OH Te2 O3 86.4(3) . . ? 
O8 Te2 Cu 118.8(2) . 2_646 ? 
O9 Te2 Cu 142.2(2) . 2_646 ? 
O1 Te2 Cu 32.5(2) . 2_646 ? 
O4 Te2 Cu 100.5(2) . 2_646 ? 
OH Te2 Cu 53.8(2) . 2_646 ? 
O3 Te2 Cu 77.4(2) . 2_646 ? 
O8 Te2 Pb3 43.8(2) . 3_766 ? 
O9 Te2 Pb3 136.7(2) . 3_766 ? 
O1 Te2 Pb3 46.3(2) . 3_766 ? 
O4 Te2 Pb3 102.97(19) . 3_766 ? 
OH Te2 Pb3 128.8(2) . 3_766 ? 
O3 Te2 Pb3 86.91(19) . 3_766 ? 
Cu Te2 Pb3 75.193(16) 2_646 3_766 ? 
O8 Te2 Pb1 104.2(2) . . ? 
O9 Te2 Pb1 38.6(2) . . ? 
O1 Te2 Pb1 136.0(2) . . ? 
O4 Te2 Pb1 126.0(2) . . ? 
OH Te2 Pb1 80.4(2) . . ? 
O3 Te2 Pb1 47.02(19) . . ? 
Cu Te2 Pb1 110.317(18) 2_646 . ? 
Pb3 Te2 Pb1 126.83(2) 3_766 . ? 
O8 Te2 Pb2 137.5(2) . 2_646 ? 
O9 Te2 Pb2 105.2(2) . 2_646 ? 
O1 Te2 Pb2 74.6(2) . 2_646 ? 
O4 Te2 Pb2 45.4(2) . 2_646 ? 
OH Te2 Pb2 41.2(2) . 2_646 ? 
O3 Te2 Pb2 126.3(2) . 2_646 ? 
Cu Te2 Pb2 63.177(13) 2_646 2_646 ? 
Pb3 Te2 Pb2 114.23(2) 3_766 2_646 ? 
Pb1 Te2 Pb2 114.686(19) . 2_646 ? 
O8 Te2 Pb3 129.9(2) . 2_646 ? 
O9 Te2 Pb3 40.1(2) . 2_646 ? 
O1 Te2 Pb3 137.9(2) . 2_646 ? 
O4 Te2 Pb3 70.9(2) . 2_646 ? 
OH Te2 Pb3 57.5(2) . 2_646 ? 
O3 Te2 Pb3 99.70(19) . 2_646 ? 
Cu Te2 Pb3 111.304(18) 2_646 2_646 ? 
Pb3 Te2 Pb3 171.51(2) 3_766 2_646 ? 
Pb1 Te2 Pb3 57.078(13) . 2_646 ? 
Pb2 Te2 Pb3 66.032(14) 2_646 2_646 ? 
O8 Te2 Pb2 58.5(2) . . ? 
O9 Te2 Pb2 35.9(2) . . ? 
O1 Te2 Pb2 147.9(2) . . ? 
O4 Te2 Pb2 94.4(2) . . ? 
OH Te2 Pb2 128.7(2) . . ? 
O3 Te2 Pb2 88.0(2) . . ? 
Cu Te2 Pb2 165.15(2) 2_646 . ? 
Pb3 Te2 Pb2 101.695(18) 3_766 . ? 
Pb1 Te2 Pb2 59.552(13) . . ? 
Pb2 Te2 Pb2 129.754(17) 2_646 . ? 
Pb3 Te2 Pb2 73.432(14) 2_646 . ? 
O8 Te2 H 161.8(18) . . ? 
O9 Te2 H 67.7(17) . . ? 
O1 Te2 H 108.1(18) . . ? 
O4 Te2 H 87(4) . . ? 
OH Te2 H 25.1(17) . . ? 
O3 Te2 H 83(4) . . ? 
Cu Te2 H 77(2) 2_646 . ? 
Pb3 Te2 H 152(2) 3_766 . ? 
Pb1 Te2 H 60(3) . . ? 
Pb2 Te2 H 55(3) 2_646 . ? 
Pb3 Te2 H 36(3) 2_646 . ? 
Pb2 Te2 H 103.6(17) . . ? 
O7 Pb1 O9 77.6(3) . . ? 
O7 Pb1 O5 76.6(2) . . ? 
O9 Pb1 O5 75.9(2) . . ? 
O7 Pb1 O3 81.3(2) . . ? 
O9 Pb1 O3 62.1(2) . . ? 
O5 Pb1 O3 135.8(2) . . ? 
O7 Pb1 O1 120.7(2) . 1_455 ? 
O9 Pb1 O1 146.5(2) . 1_455 ? 
O5 Pb1 O1 81.4(2) . 1_455 ? 
O3 Pb1 O1 142.4(2) . 1_455 ? 
O7 Pb1 O6 136.7(2) . . ? 
O9 Pb1 O6 82.1(2) . . ? 
O5 Pb1 O6 61.5(2) . . ? 
O3 Pb1 O6 121.3(2) . . ? 
O1 Pb1 O6 65.3(2) 1_455 . ? 
O7 Pb1 O2 60.9(2) . 2_546 ? 
O9 Pb1 O2 129.6(2) . 2_546 ? 
O5 Pb1 O2 68.0(2) . 2_546 ? 
O3 Pb1 O2 130.3(2) . 2_546 ? 
O1 Pb1 O2 59.83(19) 1_455 2_546 ? 
O6 Pb1 O2 108.40(19) . 2_546 ? 
O7 Pb1 Cu 91.10(17) . 2_546 ? 
O9 Pb1 Cu 165.36(17) . 2_546 ? 
O5 Pb1 Cu 92.52(16) . 2_546 ? 
O3 Pb1 Cu 125.93(14) . 2_546 ? 
O1 Pb1 Cu 35.69(14) 1_455 2_546 ? 
O6 Pb1 Cu 100.43(14) . 2_546 ? 
O2 Pb1 Cu 35.89(13) 2_546 2_546 ? 
O7 Pb1 Te1 28.71(17) . 2_546 ? 
O9 Pb1 Te1 104.93(18) . 2_546 ? 
O5 Pb1 Te1 75.14(16) . 2_546 ? 
O3 Pb1 Te1 101.73(15) . 2_546 ? 
O1 Pb1 Te1 92.54(14) 1_455 2_546 ? 
O6 Pb1 Te1 133.09(15) . 2_546 ? 
O2 Pb1 Te1 33.06(13) 2_546 2_546 ? 
Cu Pb1 Te1 62.756(12) 2_546 2_546 ? 
O7 Pb1 Te2 71.22(17) . . ? 
O9 Pb1 Te2 29.59(17) . . ? 
O5 Pb1 Te2 102.37(16) . . ? 
O3 Pb1 Te2 33.68(14) . . ? 
O1 Pb1 Te2 168.07(14) 1_455 . ? 
O6 Pb1 Te2 106.31(14) . . ? 
O2 Pb1 Te2 132.10(13) 2_546 . ? 
Cu Pb1 Te2 153.136(16) 2_546 . ? 
Te1 Pb1 Te2 99.368(17) 2_546 . ? 
O7 Pb1 Te1 106.38(18) . . ? 
O9 Pb1 Te1 78.74(17) . . ? 
O5 Pb1 Te1 30.10(15) . . ? 
O3 Pb1 Te1 137.75(15) . . ? 
O1 Pb1 Te1 69.39(14) 1_455 . ? 
O6 Pb1 Te1 31.50(14) . . ? 
O2 Pb1 Te1 86.39(13) 2_546 . ? 
Cu Pb1 Te1 95.852(14) 2_546 . ? 
Te1 Pb1 Te1 103.202(13) 2_546 . ? 
Te2 Pb1 Te1 108.280(17) . . ? 
O7 Pb1 Pb3 162.46(17) . 3_666 ? 
O9 Pb1 Pb3 119.74(18) . 3_666 ? 
O5 Pb1 Pb3 103.99(15) . 3_666 ? 
O3 Pb1 Pb3 108.26(14) . 3_666 ? 
O1 Pb1 Pb3 43.44(14) 1_455 3_666 ? 
O6 Pb1 Pb3 50.93(14) . 3_666 ? 
O2 Pb1 Pb3 102.68(13) 2_546 3_666 ? 
Cu Pb1 Pb3 71.363(11) 2_546 3_666 ? 
Te1 Pb1 Pb3 133.935(17) 2_546 3_666 ? 
Te2 Pb1 Pb3 124.830(17) . 3_666 ? 
Te1 Pb1 Pb3 76.782(15) . 3_666 ? 
O7 Pb1 O4 116.6(2) . 4_565 ? 
O9 Pb1 O4 99.6(2) . 4_565 ? 
O5 Pb1 O4 165.24(19) . 4_565 ? 
O3 Pb1 O4 46.70(17) . 4_565 ? 
O1 Pb1 O4 96.03(17) 1_455 4_565 ? 
O6 Pb1 O4 104.13(18) . 4_565 ? 
O2 Pb1 O4 123.22(17) 2_546 4_565 ? 
Cu Pb1 O4 93.73(10) 2_546 4_565 ? 
Te1 Pb1 O4 119.58(11) 2_546 4_565 ? 
Te2 Pb1 O4 77.40(10) . 4_565 ? 
Te1 Pb1 O4 135.63(10) . 4_565 ? 
Pb3 Pb1 O4 65.62(10) 3_666 4_565 ? 
O7 Pb1 Pb3 45.50(18) . 2_646 ? 
O9 Pb1 Pb3 52.51(17) . 2_646 ? 
O5 Pb1 Pb3 39.88(15) . 2_646 ? 
O3 Pb1 Pb3 99.14(14) . 2_646 ? 
O1 Pb1 Pb3 118.15(14) 1_455 2_646 ? 
O6 Pb1 Pb3 92.22(14) . 2_646 ? 
O2 Pb1 Pb3 77.47(13) 2_546 2_646 ? 
Cu Pb1 Pb3 112.866(13) 2_546 2_646 ? 
Te1 Pb1 Pb3 61.240(14) 2_546 2_646 ? 
Te2 Pb1 Pb3 69.164(14) . 2_646 ? 
Te1 Pb1 Pb3 65.106(14) . 2_646 ? 
Pb3 Pb1 Pb3 141.848(16) 3_666 2_646 ? 
O4 Pb1 Pb3 145.79(10) 4_565 2_646 ? 
O7 Pb1 OH 40.6(2) . . ? 
O9 Pb1 OH 47.9(2) . . ? 
O5 Pb1 OH 95.38(19) . . ? 
O3 Pb1 OH 46.21(18) . . ? 
O1 Pb1 OH 160.67(18) 1_455 . ? 
O6 Pb1 OH 129.69(18) . . ? 
O2 Pb1 OH 101.22(17) 2_546 . ? 
Cu Pb1 OH 126.24(12) 2_546 . ? 
Te1 Pb1 OH 68.29(11) 2_546 . ? 
Te2 Pb1 OH 31.12(11) . . ? 
Te1 Pb1 OH 116.09(12) . . ? 
Pb3 Pb1 OH 153.53(11) 3_666 . ? 
O4 Pb1 OH 91.68(15) 4_565 . ? 
Pb3 Pb1 OH 55.56(12) 2_646 . ? 
O2 Pb2 O6 66.7(2) . . ? 
O2 Pb2 OH 72.8(2) . 2_656 ? 
O6 Pb2 OH 136.9(2) . 2_656 ? 
O2 Pb2 O5 73.6(2) . 2_556 ? 
O6 Pb2 O5 78.9(2) . 2_556 ? 
OH Pb2 O5 103.7(2) 2_656 2_556 ? 
O2 Pb2 O4 96.6(2) . 2_656 ? 
O6 Pb2 O4 138.6(2) . 2_656 ? 
OH Pb2 O4 58.9(2) 2_656 2_656 ? 
O5 Pb2 O4 59.84(19) 2_556 2_656 ? 
O2 Pb2 O9 81.2(2) . . ? 
O6 Pb2 O9 81.3(2) . . ? 
OH Pb2 O9 78.5(2) 2_656 . ? 
O5 Pb2 O9 152.6(2) 2_556 . ? 
O4 Pb2 O9 135.51(19) 2_656 . ? 
O2 Pb2 O8 116.7(2) . 3_666 ? 
O6 Pb2 O8 60.3(2) . 3_666 ? 
OH Pb2 O8 159.4(2) 2_656 3_666 ? 
O5 Pb2 O8 64.8(2) 2_556 3_666 ? 
O4 Pb2 O8 100.91(19) 2_656 3_666 ? 
O9 Pb2 O8 119.9(2) . 3_666 ? 
O2 Pb2 Te1 33.80(16) . . ? 
O6 Pb2 Te1 33.01(17) . . ? 
OH Pb2 Te1 104.82(17) 2_656 . ? 
O5 Pb2 Te1 75.90(14) 2_556 . ? 
O4 Pb2 Te1 123.17(14) 2_656 . ? 
O9 Pb2 Te1 77.15(14) . . ? 
O8 Pb2 Te1 89.31(14) 3_666 . ? 
O2 Pb2 O3 123.9(2) . 3_666 ? 
O6 Pb2 O3 106.7(2) . 3_666 ? 
OH Pb2 O3 107.7(2) 2_656 3_666 ? 
O5 Pb2 O3 51.18(18) 2_556 3_666 ? 
O4 Pb2 O3 50.13(18) 2_656 3_666 ? 
O9 Pb2 O3 154.91(18) . 3_666 ? 
O8 Pb2 O3 51.71(17) 3_666 3_666 ? 
Te1 Pb2 O3 122.51(11) . 3_666 ? 
O2 Pb2 O8 125.4(2) . . ? 
O6 Pb2 O8 118.2(2) . . ? 
OH Pb2 O8 74.6(2) 2_656 . ? 
O5 Pb2 O8 157.39(18) 2_556 . ? 
O4 Pb2 O8 102.51(18) 2_656 . ? 
O9 Pb2 O8 49.95(18) . . ? 
O8 Pb2 O8 109.10(15) 3_666 . ? 
Te1 Pb2 O8 126.61(12) . . ? 
O3 Pb2 O8 107.20(16) 3_666 . ? 
O2 Pb2 Te1 94.31(17) . 2_556 ? 
O6 Pb2 Te1 108.04(18) . 2_556 ? 
OH Pb2 Te1 88.72(17) 2_656 2_556 ? 
O5 Pb2 Te1 30.82(14) 2_556 2_556 ? 
O4 Pb2 Te1 32.69(13) 2_656 2_556 ? 
O9 Pb2 Te1 167.17(14) . 2_556 ? 
O8 Pb2 Te1 72.88(14) 3_666 2_556 ? 
Te1 Pb2 Te1 105.725(15) . 2_556 ? 
O3 Pb2 Te1 31.88(11) 3_666 2_556 ? 
O8 Pb2 Te1 127.41(12) . 2_556 ? 
O2 Pb2 Cu 27.51(16) . . ? 
O6 Pb2 Cu 93.97(17) . . ? 
OH Pb2 Cu 45.64(17) 2_656 . ? 
O5 Pb2 Cu 81.21(14) 2_556 . ? 
O4 Pb2 Cu 77.73(14) 2_656 . ? 
O9 Pb2 Cu 81.45(14) . . ? 
O8 Pb2 Cu 139.88(15) 3_666 . ? 
Te1 Pb2 Cu 60.960(13) . . ? 
O3 Pb2 Cu 120.68(11) 3_666 . ? 
O8 Pb2 Cu 110.30(12) . . ? 
Te1 Pb2 Cu 89.024(14) 2_556 . ? 
O2 Pb2 O1 49.6(2) . 2_656 ? 
O6 Pb2 O1 111.0(2) . 2_656 ? 
OH Pb2 O1 43.90(19) 2_656 2_656 ? 
O5 Pb2 O1 62.17(18) 2_556 2_656 ? 
O4 Pb2 O1 48.15(18) 2_656 2_656 ? 
O9 Pb2 O1 108.69(18) . 2_656 ? 
O8 Pb2 O1 126.87(18) 3_666 2_656 ? 
Te1 Pb2 O1 81.26(11) . 2_656 ? 
O3 Pb2 O1 90.90(16) 3_666 2_656 ? 
O8 Pb2 O1 118.37(16) . 2_656 ? 
Te1 Pb2 O1 60.18(11) 2_556 2_656 ? 
Cu Pb2 O1 30.53(11) . 2_656 ? 
O2 Pb2 Te2 77.04(16) . 2_656 ? 
O6 Pb2 Te2 140.56(17) . 2_656 ? 
OH Pb2 Te2 30.07(17) 2_656 2_656 ? 
O5 Pb2 Te2 76.56(14) 2_556 2_656 ? 
O4 Pb2 Te2 30.60(14) 2_656 2_656 ? 
O9 Pb2 Te2 108.52(14) . 2_656 ? 
O8 Pb2 Te2 130.84(14) 3_666 2_656 ? 
Te1 Pb2 Te2 110.175(19) . 2_656 ? 
O3 Pb2 Te2 80.73(11) 3_666 2_656 ? 
O8 Pb2 Te2 94.88(12) . 2_656 ? 
Te1 Pb2 Te2 58.660(15) 2_556 2_656 ? 
Cu Pb2 Te2 52.191(12) . 2_656 ? 
O1 Pb2 Te2 29.58(11) 2_656 2_656 ? 
O2 Pb2 Pb2 152.89(17) . 3_666 ? 
O6 Pb2 Pb2 92.84(17) . 3_666 ? 
OH Pb2 Pb2 119.29(17) 2_656 3_666 ? 
O5 Pb2 Pb2 121.43(14) 2_556 3_666 ? 
O4 Pb2 Pb2 110.45(14) 2_656 3_666 ? 
O9 Pb2 Pb2 78.16(14) . 3_666 ? 
O8 Pb2 Pb2 61.18(15) 3_666 3_666 ? 
Te1 Pb2 Pb2 122.92(2) . 3_666 ? 
O3 Pb2 Pb2 77.73(11) 3_666 3_666 ? 
O8 Pb2 Pb2 47.92(12) . 3_666 ? 
Te1 Pb2 Pb2 109.39(2) 2_556 3_666 ? 
Cu Pb2 Pb2 157.26(2) . 3_666 ? 
O1 Pb2 Pb2 155.76(11) 2_656 3_666 ? 
Te2 Pb2 Pb2 126.33(2) 2_656 3_666 ? 
O5 Pb3 O8 77.8(2) 2_656 3_766 ? 
O5 Pb3 O1 83.0(2) 2_656 3_766 ? 
O8 Pb3 O1 65.4(2) 3_766 3_766 ? 
O5 Pb3 O7 69.6(2) 2_656 2_656 ? 
O8 Pb3 O7 118.4(2) 3_766 2_656 ? 
O1 Pb3 O7 149.7(2) 3_766 2_656 ? 
O5 Pb3 O8 140.0(2) 2_656 . ? 
O8 Pb3 O8 92.0(2) 3_766 . ? 
O1 Pb3 O8 127.9(2) 3_766 . ? 
O7 Pb3 O8 82.3(2) 2_656 . ? 
O5 Pb3 O6 75.2(2) 2_656 1_655 ? 
O8 Pb3 O6 63.0(2) 3_766 1_655 ? 
O1 Pb3 O6 126.9(2) 3_766 1_655 ? 
O7 Pb3 O6 59.0(2) 2_656 1_655 ? 
O8 Pb3 O6 65.9(2) . 1_655 ? 
O5 Pb3 O6 142.5(2) 2_656 3_666 ? 
O8 Pb3 O6 68.7(2) 3_766 3_666 ? 
O1 Pb3 O6 68.4(2) 3_766 3_666 ? 
O7 Pb3 O6 141.9(2) 2_656 3_666 ? 
O8 Pb3 O6 59.6(2) . 3_666 ? 
O6 Pb3 O6 102.69(18) 1_655 3_666 ? 
O5 Pb3 O9 65.9(2) 2_656 2_656 ? 
O8 Pb3 O9 140.7(2) 3_766 2_656 ? 
O1 Pb3 O9 94.7(2) 3_766 2_656 ? 
O7 Pb3 O9 62.9(2) 2_656 2_656 ? 
O8 Pb3 O9 125.4(2) . 2_656 ? 
O6 Pb3 O9 117.9(2) 1_655 2_656 ? 
O6 Pb3 O9 137.4(2) 3_666 2_656 ? 
O5 Pb3 Te2 74.65(16) 2_656 3_766 ? 
O8 Pb3 Te2 32.46(17) 3_766 3_766 ? 
O1 Pb3 Te2 33.35(16) 3_766 3_766 ? 
O7 Pb3 Te2 139.33(15) 2_656 3_766 ? 
O8 Pb3 Te2 115.58(16) . 3_766 ? 
O6 Pb3 Te2 93.76(15) 1_655 3_766 ? 
O6 Pb3 Te2 68.11(14) 3_666 3_766 ? 
O9 Pb3 Te2 118.22(14) 2_656 3_766 ? 
O5 Pb3 OH 102.7(2) 2_656 2_656 ? 
O8 Pb3 OH 160.0(2) 3_766 2_656 ? 
O1 Pb3 OH 134.6(2) 3_766 2_656 ? 
O7 Pb3 OH 46.08(19) 2_656 2_656 ? 
O8 Pb3 OH 74.6(2) . 2_656 ? 
O6 Pb3 OH 97.56(19) 1_655 2_656 ? 
O6 Pb3 OH 114.54(19) 3_666 2_656 ? 
O9 Pb3 OH 50.85(19) 2_656 2_656 ? 
Te2 Pb3 OH 167.31(13) 3_766 2_656 ? 
O5 Pb3 Pb3 115.79(16) 2_656 3_766 ? 
O8 Pb3 Pb3 49.13(17) 3_766 3_766 ? 
O1 Pb3 Pb3 100.46(16) 3_766 3_766 ? 
O7 Pb3 Pb3 102.92(15) 2_656 3_766 ? 
O8 Pb3 Pb3 42.90(16) . 3_766 ? 
O6 Pb3 Pb3 51.77(14) 1_655 3_766 ? 
O6 Pb3 Pb3 50.92(15) 3_666 3_766 ? 
O9 Pb3 Pb3 164.89(14) 2_656 3_766 ? 
Te2 Pb3 Pb3 75.640(19) 3_766 3_766 ? 
OH Pb3 Pb3 116.05(12) 2_656 3_766 ? 
O5 Pb3 Pb1 125.70(16) 2_656 3_666 ? 
O8 Pb3 Pb1 100.97(17) 3_766 3_666 ? 
O1 Pb3 Pb1 50.48(16) 3_766 3_666 ? 
O7 Pb3 Pb1 140.48(15) 2_656 3_666 ? 
O8 Pb3 Pb1 94.13(15) . 3_666 ? 
O6 Pb3 Pb1 152.37(14) 1_655 3_666 ? 
O6 Pb3 Pb1 49.70(15) 3_666 3_666 ? 
O9 Pb3 Pb1 88.95(14) 2_656 3_666 ? 
Te2 Pb3 Pb1 77.355(16) 3_766 3_666 ? 
OH Pb3 Pb1 94.90(12) 2_656 3_666 ? 
Pb3 Pb3 Pb1 100.610(18) 3_766 3_666 ? 
O5 Pb3 Te1 72.01(16) 2_656 1_655 ? 
O8 Pb3 Te1 91.77(17) 3_766 1_655 ? 
O1 Pb3 Te1 149.42(16) 3_766 1_655 ? 
O7 Pb3 Te1 29.27(15) 2_656 1_655 ? 
O8 Pb3 Te1 69.70(15) . 1_655 ? 
O6 Pb3 Te1 29.88(14) 1_655 1_655 ? 
O6 Pb3 Te1 123.85(15) 3_666 1_655 ? 
O9 Pb3 Te1 90.96(14) 2_656 1_655 ? 
Te2 Pb3 Te1 119.898(19) 3_766 1_655 ? 
OH Pb3 Te1 69.81(12) 2_656 1_655 ? 
Pb3 Pb3 Te1 76.028(18) 3_766 1_655 ? 
Pb1 Pb3 Te1 159.887(17) 3_666 1_655 ? 
O5 Pb3 Pb1 39.59(16) 2_656 2_656 ? 
O8 Pb3 Pb1 113.95(17) 3_766 2_656 ? 
O1 Pb3 Pb1 111.92(16) 3_766 2_656 ? 
O7 Pb3 Pb1 37.83(15) 2_656 2_656 ? 
O8 Pb3 Pb1 120.16(16) . 2_656 ? 
O6 Pb3 Pb1 79.31(14) 1_655 2_656 ? 
O6 Pb3 Pb1 177.31(15) 3_666 2_656 ? 
O9 Pb3 Pb1 40.17(14) 2_656 2_656 ? 
Te2 Pb3 Pb1 113.725(17) 3_766 2_656 ? 
OH Pb3 Pb1 63.21(12) 2_656 2_656 ? 
Pb3 Pb3 Pb1 131.04(2) 3_766 2_656 ? 
Pb1 Pb3 Pb1 128.272(15) 3_666 2_656 ? 
Te1 Pb3 Pb1 57.300(13) 1_655 2_656 ? 
O5 Pb3 O3 43.65(19) 2_656 3_766 ? 
O8 Pb3 O3 46.5(2) 3_766 3_766 ? 
O1 Pb3 O3 46.43(18) 3_766 3_766 ? 
O7 Pb3 O3 111.82(18) 2_656 3_766 ? 
O8 Pb3 O3 138.40(19) . 3_766 ? 
O6 Pb3 O3 87.62(18) 1_655 3_766 ? 
O6 Pb3 O3 99.30(17) 3_666 3_766 ? 
O9 Pb3 O3 94.86(17) 2_656 3_766 ? 
Te2 Pb3 O3 31.20(10) 3_766 3_766 ? 
OH Pb3 O3 143.44(15) 2_656 3_766 ? 
Pb3 Pb3 O3 95.57(10) 3_766 3_766 ? 
Pb1 Pb3 O3 96.86(10) 3_666 3_766 ? 
Te1 Pb3 O3 103.18(10) 1_655 3_766 ? 
Pb1 Pb3 O3 82.53(10) 2_656 3_766 ? 
Te2 O1 Cu 116.0(3) . 2_646 ? 
Te2 O1 Pb3 100.4(3) . 3_766 ? 
Cu O1 Pb3 131.9(3) 2_646 3_766 ? 
Te2 O1 Pb1 137.4(3) . 1_655 ? 
Cu O1 Pb1 87.2(2) 2_646 1_655 ? 
Pb3 O1 Pb1 86.1(2) 3_766 1_655 ? 
Te2 O1 Pb2 75.8(2) . 2_646 ? 
Cu O1 Pb2 74.0(2) 2_646 2_646 ? 
Pb3 O1 Pb2 148.9(3) 3_766 2_646 ? 
Pb1 O1 Pb2 77.56(16) 1_655 2_646 ? 
Te2 O1 Pb1 28.99(15) . . ? 
Cu O1 Pb1 94.6(2) 2_646 . ? 
Pb3 O1 Pb1 104.76(19) 3_766 . ? 
Pb1 O1 Pb1 163.2(2) 1_655 . ? 
Pb2 O1 Pb1 86.83(12) 2_646 . ? 
Te1 O2 Cu 133.9(4) . . ? 
Te1 O2 Pb2 105.0(3) . . ? 
Cu O2 Pb2 119.8(3) . . ? 
Te1 O2 Pb1 93.1(2) . 2_556 ? 
Cu O2 Pb1 85.2(2) . 2_556 ? 
Pb2 O2 Pb1 106.2(2) . 2_556 ? 
Te1 O2 Pb3 77.1(2) . 2_646 ? 
Cu O2 Pb3 81.7(2) . 2_646 ? 
Pb2 O2 Pb3 103.8(2) . 2_646 ? 
Pb1 O2 Pb3 149.9(2) 2_556 2_646 ? 
Te1 O2 Pb1 57.03(17) . . ? 
Cu O2 Pb1 133.1(3) . . ? 
Pb2 O2 Pb1 64.71(16) . . ? 
Pb1 O2 Pb1 141.0(2) 2_556 . ? 
Pb3 O2 Pb1 54.24(9) 2_646 . ? 
Te1 O3 Te2 134.2(3) 4_665 . ? 
Te1 O3 Pb1 126.5(3) 4_665 . ? 
Te2 O3 Pb1 99.3(3) . . ? 
Te1 O3 Pb2 81.0(2) 4_665 3_666 ? 
Te2 O3 Pb2 98.2(2) . 3_666 ? 
Pb1 O3 Pb2 93.51(19) . 3_666 ? 
Te1 O3 Cu 78.3(2) 4_665 2_646 ? 
Te2 O3 Cu 68.00(18) . 2_646 ? 
Pb1 O3 Cu 134.1(2) . 2_646 ? 
Pb2 O3 Cu 131.0(2) 3_666 2_646 ? 
Te1 O3 Pb1 67.05(19) 4_665 3_656 ? 
Te2 O3 Pb1 111.9(2) . 3_656 ? 
Pb1 O3 Pb1 96.49(18) . 3_656 ? 
Pb2 O3 Pb1 146.1(2) 3_666 3_656 ? 
Cu O3 Pb1 54.47(10) 2_646 3_656 ? 
Te1 O3 Pb3 77.26(19) 4_665 3_766 ? 
Te2 O3 Pb3 61.89(16) . 3_766 ? 
Pb1 O3 Pb3 146.5(2) . 3_766 ? 
Pb2 O3 Pb3 64.77(11) 3_666 3_766 ? 
Cu O3 Pb3 67.60(11) 2_646 3_766 ? 
Pb1 O3 Pb3 115.85(17) 3_656 3_766 ? 
Te2 O4 Te1 132.5(4) . 1_655 ? 
Te2 O4 Pb2 104.0(3) . 2_646 ? 
Te1 O4 Pb2 98.9(2) 1_655 2_646 ? 
Te2 O4 Pb1 133.9(3) . 4_666 ? 
Te1 O4 Pb1 88.3(2) 1_655 4_666 ? 
Pb2 O4 Pb1 86.13(17) 2_646 4_666 ? 
Te2 O4 Pb3 81.1(2) . 2_646 ? 
Te1 O4 Pb3 145.1(3) 1_655 2_646 ? 
Pb2 O4 Pb3 77.62(15) 2_646 2_646 ? 
Pb1 O4 Pb3 56.95(10) 4_666 2_646 ? 
Te2 O4 Pb1 86.6(2) . 1_655 ? 
Te1 O4 Pb1 61.60(17) 1_655 1_655 ? 
Pb2 O4 Pb1 72.26(15) 2_646 1_655 ? 
Pb1 O4 Pb1 138.31(18) 4_666 1_655 ? 
Pb3 O4 Pb1 143.53(18) 2_646 1_655 ? 
Te2 O4 Cu 51.52(16) . 2_646 ? 
Te1 O4 Cu 109.9(2) 1_655 2_646 ? 
Pb2 O4 Cu 61.48(13) 2_646 2_646 ? 
Pb1 O4 Cu 144.36(19) 4_666 2_646 ? 
Pb3 O4 Cu 98.99(14) 2_646 2_646 ? 
Pb1 O4 Cu 48.32(8) 1_655 2_646 ? 
Te2 O4 Pb3 80.6(2) . . ? 
Te1 O4 Pb3 63.39(17) 1_655 . ? 
Pb2 O4 Pb3 156.4(2) 2_646 . ? 
Pb1 O4 Pb3 107.63(16) 4_666 . ? 
Pb3 O4 Pb3 125.93(17) 2_646 . ? 
Pb1 O4 Pb3 85.05(13) 1_655 . ? 
Cu O4 Pb3 107.93(15) 2_646 . ? 
Te1 O5 Pb1 111.0(3) . . ? 
Te1 O5 Pb3 128.9(3) . 2_646 ? 
Pb1 O5 Pb3 100.5(2) . 2_646 ? 
Te1 O5 Pb2 104.3(3) . 2_546 ? 
Pb1 O5 Pb2 110.6(2) . 2_546 ? 
Pb3 O5 Pb2 100.7(2) 2_646 2_546 ? 
Te1 O5 Pb2 58.59(17) . . ? 
Pb1 O5 Pb2 70.17(16) . . ? 
Pb3 O5 Pb2 99.2(2) 2_646 . ? 
Pb2 O5 Pb2 159.5(2) 2_546 . ? 
Te1 O6 Pb2 102.5(3) . . ? 
Te1 O6 Pb1 96.9(3) . . ? 
Pb2 O6 Pb1 94.6(2) . . ? 
Te1 O6 Pb3 101.4(3) . 1_455 ? 
Pb2 O6 Pb3 95.5(2) . 1_455 ? 
Pb1 O6 Pb3 156.7(3) . 1_455 ? 
Te1 O6 Pb3 139.9(3) . 3_666 ? 
Pb2 O6 Pb3 117.6(3) . 3_666 ? 
Pb1 O6 Pb3 79.37(19) . 3_666 ? 
Pb3 O6 Pb3 77.32(18) 1_455 3_666 ? 
Te1 O6 Pb3 110.7(2) . . ? 
Pb2 O6 Pb3 15.11(12) . . ? 
Pb1 O6 Pb3 81.12(15) . . ? 
Pb3 O6 Pb3 105.45(17) 1_455 . ? 
Pb3 O6 Pb3 108.12(17) 3_666 . ? 
Te1 O7 Pb1 115.8(3) 2_546 . ? 
Te1 O7 Pb3 107.3(3) 2_546 2_646 ? 
Pb1 O7 Pb3 96.7(2) . 2_646 ? 
Te1 O7 Pb1 84.1(2) 2_546 3_656 ? 
Pb1 O7 Pb1 102.8(2) . 3_656 ? 
Pb3 O7 Pb1 150.3(2) 2_646 3_656 ? 
Te1 O7 Pb2 58.30(18) 2_546 2_546 ? 
Pb1 O7 Pb2 78.39(18) . 2_546 ? 
Pb3 O7 Pb2 69.10(15) 2_646 2_546 ? 
Pb1 O7 Pb2 136.59(19) 3_656 2_546 ? 
Te1 O7 Cu 61.53(19) 2_546 2_546 ? 
Pb1 O7 Cu 54.85(14) . 2_546 ? 
Pb3 O7 Cu 119.6(2) 2_646 2_546 ? 
Pb1 O7 Cu 90.03(15) 3_656 2_546 ? 
Pb2 O7 Cu 54.67(9) 2_546 2_546 ? 
Te2 O8 Pb3 103.7(3) . 3_766 ? 
Te2 O8 Pb3 137.4(4) . . ? 
Pb3 O8 Pb3 88.0(2) 3_766 . ? 
Te2 O8 Pb2 115.2(3) . 3_666 ? 
Pb3 O8 Pb2 91.1(2) 3_766 3_666 ? 
Pb3 O8 Pb2 105.2(2) . 3_666 ? 
Te2 O8 Pb2 94.5(3) . . ? 
Pb3 O8 Pb2 158.7(3) 3_766 . ? 
Pb3 O8 Pb2 85.89(19) . . ? 
Pb2 O8 Pb2 70.90(15) 3_666 . ? 
Te2 O9 Pb1 111.8(3) . . ? 
Te2 O9 Pb2 121.1(3) . . ? 
Pb1 O9 Pb2 94.8(2) . . ? 
Te2 O9 Pb3 115.4(3) . 2_646 ? 
Pb1 O9 Pb3 87.3(2) . 2_646 ? 
Pb2 O9 Pb3 117.6(2) . 2_646 ? 
Te2 O9 Pb3 62.55(19) . . ? 
Pb1 O9 Pb3 136.9(2) . . ? 
Pb2 O9 Pb3 62.32(13) . . ? 
Pb3 O9 Pb3 135.2(2) 2_646 . ? 
Te2 OH Pb2 108.7(3) . 2_646 ? 
Te2 OH Cu 88.9(3) . 2_646 ? 
Pb2 OH Cu 89.6(2) 2_646 2_646 ? 
Te2 OH Pb3 94.0(3) . 2_646 ? 
Pb2 OH Pb3 88.6(2) 2_646 2_646 ? 
Cu OH Pb3 177.0(3) 2_646 2_646 ? 
Te2 OH Pb1 68.5(2) . . ? 
Pb2 OH Pb1 148.7(3) 2_646 . ? 
Cu OH Pb1 120.9(2) 2_646 . ? 
Pb3 OH Pb1 61.22(12) 2_646 . ? 
Te2 OH Pb1 114.1(3) . 3_656 ? 
Pb2 OH Pb1 125.2(3) 2_646 3_656 ? 
Cu OH Pb1 59.60(15) 2_646 3_656 ? 
Pb3 OH Pb1 119.8(2) 2_646 3_656 ? 
Pb1 OH Pb1 80.57(14) . 3_656 ? 
Te2 OH H 86(10) . . ? 
Pb2 OH H 114(10) 2_646 . ? 
Cu OH H 157(10) 2_646 . ? 
Pb3 OH H 25(10) 2_646 . ? 
Pb1 OH H 37(10) . . ? 
Pb1 OH H 102(10) 3_656 . ? 
 
_diffrn_measured_fraction_theta_max    0.996 
_diffrn_reflns_theta_full              27.48 
_diffrn_measured_fraction_theta_full   0.996 
_refine_diff_density_max    1.755 
_refine_diff_density_min   -1.849 
_refine_diff_density_rms    0.377 
