data_ambrinoite
 
_audit_creation_method            SHELXL-97
_chemical_name_systematic
;
 ?
;
_chemical_name_common             ?
_chemical_melting_point           ?
_chemical_formula_moiety          ?
_chemical_formula_sum
 'As12.72 K3.20 N0.80 O2 S26 Sb3.28'
_chemical_formula_weight          2354.45

_chemical_special_details
;
The non-integer number of atoms in the unit-cell is due to the occurrence 
of partially occupied sites and substitutional disorder.
;
 
loop_
 _atom_type_symbol
 _atom_type_description
 _atom_type_scat_dispersion_real
 _atom_type_scat_dispersion_imag
 _atom_type_scat_source
 'As'  'As'  -0.9300   1.0051
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'K'  'K'   0.3868   1.0657
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'O'  'O'   0.0492   0.0322
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'S'  'S'   0.3331   0.5567
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'Sb'  'Sb'  -0.0562   5.8946
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'N'  'N'   0.0311   0.0180
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 
_symmetry_cell_setting             triclinic
_symmetry_space_group_name_H-M    P-1
 
loop_
 _symmetry_equiv_pos_as_xyz
 'x, y, z'
 '-x, -y, -z'
 
_cell_length_a                    9.7040(10)
_cell_length_b                    11.5790(15)
_cell_length_c                    12.102(2)
_cell_angle_alpha                 112.820(15)
_cell_angle_beta                  103.440(13)
_cell_angle_gamma                 90.490(10)
_cell_volume                      1211.6(3)
_cell_formula_units_Z             1
_cell_measurement_temperature     293(2)
_cell_measurement_reflns_used     2667
_cell_measurement_theta_min       2
_cell_measurement_theta_max       31.76
 
_exptl_crystal_description        lamellar
_exptl_crystal_colour             red
_exptl_crystal_size_max           0.08 
_exptl_crystal_size_mid           0.01
_exptl_crystal_size_min           0.005
_exptl_crystal_density_meas       'not measured'
_exptl_crystal_density_diffrn     3.227
_exptl_crystal_density_method     'not measured'
_exptl_crystal_F_000              1085
_exptl_absorpt_coefficient_mu     39.589
_exptl_absorpt_correction_type    none
_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      1.0000
_diffrn_radiation_type            'synchrotron'
_diffrn_radiation_source          'synchrotron'
_diffrn_radiation_monochromator   Si
_diffrn_measurement_device_type   'single axis'
_diffrn_measurement_method        'Mar CCD area detector'
_diffrn_detector_area_resol_mean  ?
_diffrn_standards_number          ?
_diffrn_standards_interval_count  ?
_diffrn_standards_interval_time   ?
_diffrn_standards_decay_%         ?
_diffrn_reflns_number             9705
_diffrn_reflns_av_R_equivalents   0.0283
_diffrn_reflns_av_sigmaI/netI     0.0234
_diffrn_reflns_limit_h_min        -9
_diffrn_reflns_limit_h_max        9
_diffrn_reflns_limit_k_min        -12
_diffrn_reflns_limit_k_max        12
_diffrn_reflns_limit_l_min        -12
_diffrn_reflns_limit_l_max        12
_diffrn_reflns_theta_min          2.66
_diffrn_reflns_theta_max          31.76
_diffrn_special_details
;
The resolution of the collected data is approximately 0.95 Å depending 
on the area of the detector. The data were collected by rotation around
a spindle axis only (standard on some image-plate systems).
;
_reflns_number_total              2667
_reflns_number_gt                 2554
_reflns_threshold_expression      >2sigma(I)
 
_computing_data_collection        ?
_computing_cell_refinement        ?
_computing_data_reduction         'Scalepack (Otwinowski & Minor, 1997)'
_computing_structure_solution     'SHELXS-97 (Sheldrick, 1997)'
_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)+(0.0458P)²+6.6264P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary      direct
_atom_sites_solution_secondary    difmap
_atom_sites_solution_hydrogens    '.'
_refine_ls_hydrogen_treatment     none
_refine_ls_extinction_method      SHELXL
_refine_ls_extinction_coef        0.00387(18)
_refine_ls_extinction_expression
 'Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^'
_refine_ls_number_reflns          2667
_refine_ls_number_parameters      225
_refine_ls_number_restraints      0
_refine_ls_R_factor_all           0.0353
_refine_ls_R_factor_gt            0.0341
_refine_ls_wR_factor_ref          0.0913
_refine_ls_wR_factor_gt           0.0903
_refine_ls_goodness_of_fit_ref    1.141
_refine_ls_restrained_S_all       1.141
_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
Sb1 Sb 0.39230(7) 0.64339(5) 0.83575(6) 0.0344(3) Uani 0.545(8) 1 d P . .
As1 As 0.39230(7) 0.64339(5) 0.83575(6) 0.0344(3) Uani 0.455(8) 1 d P . .
Sb2 Sb 0.01055(7) 0.14677(6) 0.83795(6) 0.0369(3) Uani 0.567(8) 1 d P . .
As2 As 0.01055(7) 0.14677(6) 0.83795(6) 0.0369(3) Uani 0.433(8) 1 d P . .
As3 As 0.66142(10) 0.98014(7) 0.71276(7) 0.0309(3) Uani 1 1 d . . .
As4 As 0.66440(9) 0.70477(7) 0.70910(7) 0.0302(3) Uani 1 1 d . . .
Sb5 Sb 0.24245(10) 0.92642(7) 0.96400(7) 0.0354(4) Uani 0.076(7) 1 d P . .
As5 As 0.24245(10) 0.92642(7) 0.96400(7) 0.0354(4) Uani 0.924(7) 1 d P . .
Sb6 Sb 0.00896(9) 0.64686(7) 0.82178(7) 0.0358(4) Uani 0.198(7) 1 d P . .
As6 As 0.00896(9) 0.64686(7) 0.82178(7) 0.0358(4) Uani 0.802(7) 1 d P . .
Sb7 Sb 0.38933(9) 0.14671(7) 0.82502(7) 0.0362(4) Uani 0.254(7) 1 d P . .
As7 As 0.38933(9) 0.14671(7) 0.82502(7) 0.0362(4) Uani 0.746(7) 1 d P . .
As8 As 0.23678(10) 0.42874(8) 0.94031(8) 0.0365(3) Uani 1 1 d . . .
S1 S 0.6161(2) 0.78139(16) 0.55761(16) 0.0323(5) Uani 1 1 d . . .
S2 S 0.3786(3) 0.34010(18) 0.8069(2) 0.0404(5) Uani 1 1 d . . .
S3 S 0.8204(2) 0.05989(18) 0.64367(17) 0.0321(5) Uani 1 1 d . . .
S4 S 0.3974(2) 0.85096(18) 0.83819(19) 0.0371(5) Uani 1 1 d . . .
S5 S 0.4723(2) 0.56200(17) 0.64325(17) 0.0314(5) Uani 1 1 d . . .
S6 S 0.0114(2) 0.34387(18) 0.81684(19) 0.0367(5) Uani 1 1 d . . .
S7 S 0.8220(2) 0.57190(17) 0.63615(17) 0.0323(5) Uani 1 1 d . . .
S8 S 0.4694(2) 0.06299(18) 0.64081(17) 0.0348(5) Uani 1 1 d . . .
S9 S 0.1611(2) 0.05729(18) 0.69909(18) 0.0358(5) Uani 1 1 d . . .
S10 S 0.1587(2) 0.56251(18) 0.69308(18) 0.0345(5) Uani 1 1 d . . .
S11 S 1.0192(2) 0.84849(18) 0.8257(2) 0.0392(5) Uani 1 1 d . . .
S12 S 0.2637(2) 0.2992(2) 0.03496(18) 0.0398(5) Uani 1 1 d . . .
S13 S 0.2578(2) 0.77633(18) 0.03814(17) 0.0348(5) Uani 1 1 d . . .
K1 K 0.6681(3) 0.3331(2) 0.6791(3) 0.0652(13) Uani 0.829(14) 1 d P . .
N1 N 0.6681(3) 0.3331(2) 0.6791(3) 0.0652(13) Uani 0.171(14) 1 d P . .
K2 K 0.9242(4) 0.7592(3) 0.4774(3) 0.0730(15) Uani 0.770(14) 1 d P . .
N2 N 0.9242(4) 0.7592(3) 0.4774(3) 0.0730(15) Uani 0.230(14) 1 d P . .
W1 O 0.2172(8) 0.7496(6) 0.5285(6) 0.066(2) 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
Sb1 S4 2.392(2) . ?
Sb1 S10 2.426(2) . ?
Sb1 S5 2.463(2) . ?
Sb1 S13 2.944(2) 1_556 ?
Sb1 S12 3.281(2) 2_666 ?
Sb1 S2 3.390(2) . ?
Sb2 S6 2.393(2) . ?
Sb2 S9 2.418(2) . ?
Sb2 S3 2.462(2) 1_455 ?
Sb2 S12 2.962(2) 1_556 ?
Sb2 S13 3.262(2) 2_566 ?
Sb2 S11 3.402(2) 1_445 ?
As3 S8 2.253(2) 1_565 ?
As3 S3 2.260(2) 1_565 ?
As3 S1 2.294(2) . ?
As3 S13 3.150(2) 2_676 ?
As4 S5 2.254(2) . ?
As4 S7 2.258(2) . ?
As4 S1 2.2883(19) . ?
As4 S12 3.031(2) 2_666 ?
As4 S4 3.454(2) . ?
Sb5 S13 2.236(2) 1_556 ?
Sb5 S4 2.323(2) . ?
Sb5 S11 2.328(2) 1_455 ?
Sb6 S11 2.317(2) 1_455 ?
Sb6 S10 2.321(2) . ?
Sb6 S7 2.379(2) 1_455 ?
Sb6 S13 2.981(2) 1_556 ?
Sb6 S12 3.423(2) 2_566 ?
Sb6 S6 3.486(2) . ?
Sb7 S2 2.334(2) . ?
Sb7 S9 2.339(2) . ?
Sb7 S8 2.378(2) . ?
Sb7 S12 3.009(2) 1_556 ?
Sb7 S13 3.381(2) 2_666 ?
Sb7 S4 3.490(2) 1_545 ?
As8 S12 2.198(2) 1_556 ?
As8 S6 2.299(2) . ?
As8 S2 2.307(2) . ?
S1 K1 3.300(3) 2_666 ?
S1 K2 3.334(4) . ?
S2 K1 3.495(4) . ?
S3 As3 2.260(2) 1_545 ?
S3 As2 2.462(2) 1_655 ?
S3 Sb2 2.462(2) 1_655 ?
S3 K1 3.420(3) . ?
S3 S1 3.426(3) 1_545 ?
S4 W1 3.462(7) . ?
S4 As7 3.490(2) 1_565 ?
S4 Sb7 3.490(2) 1_565 ?
S5 K1 3.379(3) . ?
S6 K1 3.338(3) 1_455 ?
S6 K2 3.500(4) 2_666 ?
S7 As6 2.379(2) 1_655 ?
S7 Sb6 2.379(2) 1_655 ?
S7 K1 3.400(3) . ?
S7 W1 3.441(6) 2_666 ?
S8 As3 2.253(2) 1_545 ?
S8 K1 3.474(3) . ?
S9 W1 3.479(7) 1_545 ?
S10 K2 3.464(3) 2_666 ?
S11 As6 2.317(2) 1_655 ?
S11 Sb6 2.317(2) 1_655 ?
S11 As5 2.328(2) 1_655 ?
S11 Sb5 2.328(2) 1_655 ?
S11 As2 3.402(2) 1_665 ?
S11 Sb2 3.402(2) 1_665 ?
S12 As8 2.198(2) 1_554 ?
S12 As2 2.962(2) 1_554 ?
S12 Sb2 2.962(2) 1_554 ?
S12 As7 3.009(2) 1_554 ?
S12 Sb7 3.009(2) 1_554 ?
S12 As4 3.031(2) 2_666 ?
S12 Sb1 3.281(2) 2_666 ?
S12 As1 3.281(2) 2_666 ?
S12 As6 3.423(2) 2_566 ?
S12 Sb6 3.423(2) 2_566 ?
S13 As5 2.236(2) 1_554 ?
S13 Sb5 2.236(2) 1_554 ?
S13 Sb1 2.944(2) 1_554 ?
S13 As1 2.944(2) 1_554 ?
S13 As6 2.981(2) 1_554 ?
S13 Sb6 2.981(2) 1_554 ?
S13 As3 3.150(2) 2_676 ?
S13 Sb2 3.262(2) 2_566 ?
S13 As2 3.262(2) 2_566 ?
S13 As7 3.381(2) 2_666 ?
S13 Sb7 3.381(2) 2_666 ?
K1 W1 2.815(8) 2_666 ?
K1 S1 3.300(3) 2_666 ?
K1 S6 3.338(3) 1_655 ?
K2 W1 2.779(8) 1_655 ?
K2 S10 3.464(3) 2_666 ?
K2 S6 3.500(4) 2_666 ?
W1 N2 2.779(8) 1_455 ?
W1 K2 2.779(8) 1_455 ?
W1 N1 2.815(8) 2_666 ?
W1 K1 2.815(8) 2_666 ?
W1 S7 3.441(6) 2_666 ?
W1 S9 3.479(7) 1_565 ?
 
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 Sb1 S10 97.03(7) . . ?
S4 Sb1 S5 91.05(7) . . ?
S10 Sb1 S5 82.88(7) . . ?
S4 Sb1 S13 78.41(7) . 1_556 ?
S10 Sb1 S13 90.05(7) . 1_556 ?
S5 Sb1 S13 166.54(7) . 1_556 ?
S4 Sb1 S12 88.30(7) . 2_666 ?
S10 Sb1 S12 164.62(6) . 2_666 ?
S5 Sb1 S12 82.61(6) . 2_666 ?
S13 Sb1 S12 105.18(6) 1_556 2_666 ?
S4 Sb1 S2 175.37(7) . . ?
S10 Sb1 S2 80.14(6) . . ?
S5 Sb1 S2 84.97(6) . . ?
S13 Sb1 S2 105.16(5) 1_556 . ?
S12 Sb1 S2 93.53(6) 2_666 . ?
S10 Sb1 Sb5 86.04(5) . . ?
S5 Sb1 Sb5 128.46(5) . . ?
S13 Sb1 Sb5 39.12(4) 1_556 . ?
S12 Sb1 Sb5 107.06(5) 2_666 . ?
S2 Sb1 Sb5 141.87(4) . . ?
S4 Sb1 As4 68.09(6) . . ?
S10 Sb1 As4 116.25(5) . . ?
S5 Sb1 As4 39.20(5) . . ?
S13 Sb1 As4 138.99(4) 1_556 . ?
S12 Sb1 As4 52.62(4) 2_666 . ?
S2 Sb1 As4 109.77(4) . . ?
Sb5 Sb1 As4 108.23(3) . . ?
S4 Sb1 As8 144.79(6) . . ?
S10 Sb1 As8 74.55(5) . . ?
S5 Sb1 As8 120.78(5) . . ?
S13 Sb1 As8 67.66(4) 1_556 . ?
S12 Sb1 As8 108.92(4) 2_666 . ?
S2 Sb1 As8 38.04(4) . . ?
Sb5 Sb1 As8 104.00(3) . . ?
As4 Sb1 As8 146.48(3) . . ?
S4 Sb1 Sb6 88.89(6) . . ?
S10 Sb1 Sb6 38.06(5) . . ?
S5 Sb1 Sb6 120.23(6) . . ?
S13 Sb1 Sb6 51.99(4) 1_556 . ?
S12 Sb1 Sb6 157.04(4) 2_666 . ?
S2 Sb1 Sb6 91.06(4) . . ?
Sb5 Sb1 Sb6 58.17(2) . . ?
As4 Sb1 Sb6 144.86(3) . . ?
As8 Sb1 Sb6 63.16(2) . . ?
S6 Sb2 S9 94.73(7) . . ?
S6 Sb2 S3 88.03(7) . 1_455 ?
S9 Sb2 S3 82.56(7) . 1_455 ?
S6 Sb2 S12 76.98(7) . 1_556 ?
S9 Sb2 S12 89.91(7) . 1_556 ?
S3 Sb2 S12 162.65(6) 1_455 1_556 ?
S6 Sb2 S13 87.93(7) . 2_566 ?
S9 Sb2 S13 165.11(6) . 2_566 ?
S3 Sb2 S13 82.90(6) 1_455 2_566 ?
S12 Sb2 S13 104.95(6) 1_556 2_566 ?
S6 Sb2 S11 171.50(7) . 1_445 ?
S9 Sb2 S11 77.61(6) . 1_445 ?
S3 Sb2 S11 87.34(6) 1_455 1_445 ?
S12 Sb2 S11 106.36(6) 1_556 1_445 ?
S13 Sb2 S11 98.56(6) 2_566 1_445 ?
S6 Sb2 As8 40.15(5) . . ?
S9 Sb2 As8 84.74(5) . . ?
S3 Sb2 As8 124.96(5) 1_455 . ?
S12 Sb2 As8 38.29(4) 1_556 . ?
S13 Sb2 As8 106.31(4) 2_566 . ?
S11 Sb2 As8 140.79(5) 1_445 . ?
S6 Sb2 As3 110.76(6) . 1_445 ?
S9 Sb2 As3 110.95(5) . 1_445 ?
S12 Sb2 As3 156.40(5) 1_556 1_445 ?
S13 Sb2 As3 54.71(4) 2_566 1_445 ?
S11 Sb2 As3 69.36(4) 1_445 1_445 ?
As8 Sb2 As3 149.72(3) . 1_445 ?
S6 Sb2 Sb7 87.72(6) . . ?
S9 Sb2 Sb7 37.88(5) . . ?
S3 Sb2 Sb7 119.49(6) 1_455 . ?
S12 Sb2 Sb7 52.10(5) 1_556 . ?
S13 Sb2 Sb7 157.00(4) 2_566 . ?
S11 Sb2 Sb7 88.36(4) 1_445 . ?
As8 Sb2 Sb7 57.83(2) . . ?
As3 Sb2 Sb7 146.87(3) 1_445 . ?
S6 Sb2 As5 145.13(6) . 1_545 ?
S9 Sb2 As5 73.29(5) . 1_545 ?
S3 Sb2 As5 121.42(5) 1_455 1_545 ?
S12 Sb2 As5 70.52(5) 1_556 1_545 ?
S13 Sb2 As5 112.11(4) 2_566 1_545 ?
S11 Sb2 As5 36.14(4) 1_445 1_545 ?
As8 Sb2 As5 105.24(3) . 1_545 ?
As3 Sb2 As5 104.10(2) 1_445 1_545 ?
Sb7 Sb2 As5 62.49(2) . 1_545 ?
S6 Sb2 Sb5 145.13(6) . 1_545 ?
S9 Sb2 Sb5 73.29(5) . 1_545 ?
S3 Sb2 Sb5 121.42(5) 1_455 1_545 ?
S12 Sb2 Sb5 70.52(5) 1_556 1_545 ?
S13 Sb2 Sb5 112.11(4) 2_566 1_545 ?
S11 Sb2 Sb5 36.14(4) 1_445 1_545 ?
As8 Sb2 Sb5 105.24(3) . 1_545 ?
As3 Sb2 Sb5 104.10(2) 1_445 1_545 ?
Sb7 Sb2 Sb5 62.49(2) . 1_545 ?
S8 As3 S3 97.74(8) 1_565 1_565 ?
S8 As3 S1 98.54(8) 1_565 . ?
S3 As3 S1 97.61(8) 1_565 . ?
S8 As3 S13 90.38(7) 1_565 2_676 ?
S3 As3 S13 88.75(6) 1_565 2_676 ?
S1 As3 S13 168.22(6) . 2_676 ?
S8 As3 As4 125.98(6) 1_565 . ?
S3 As3 As4 122.18(6) 1_565 . ?
S1 As3 As4 46.12(5) . . ?
S13 As3 As4 122.15(4) 2_676 . ?
S3 As3 As7 122.87(6) 1_565 1_565 ?
S1 As3 As7 122.11(6) . 1_565 ?
S13 As3 As7 60.82(5) 2_676 1_565 ?
As4 As3 As7 114.93(3) . 1_565 ?
S3 As3 Sb7 122.87(6) 1_565 1_565 ?
S1 As3 Sb7 122.11(6) . 1_565 ?
S13 As3 Sb7 60.82(5) 2_676 1_565 ?
As4 As3 Sb7 114.93(3) . 1_565 ?
S8 As3 As5 114.67(6) 1_565 2_677 ?
S3 As3 As5 113.18(6) 1_565 2_677 ?
S1 As3 As5 129.59(5) . 2_677 ?
As4 As3 As5 83.47(3) . 2_677 ?
As7 As3 As5 73.19(3) 1_565 2_677 ?
Sb7 As3 As5 73.19(3) 1_565 2_677 ?
S8 As3 Sb5 114.67(6) 1_565 2_677 ?
S3 As3 Sb5 113.18(6) 1_565 2_677 ?
S1 As3 Sb5 129.59(5) . 2_677 ?
As4 As3 Sb5 83.47(3) . 2_677 ?
As7 As3 Sb5 73.19(3) 1_565 2_677 ?
Sb7 As3 Sb5 73.19(3) 1_565 2_677 ?
S8 As3 As2 122.76(6) 1_565 1_665 ?
S1 As3 As2 121.78(6) . 1_665 ?
S13 As3 As2 57.70(4) 2_676 1_665 ?
As4 As3 As2 111.23(3) . 1_665 ?
As7 As3 As2 115.96(3) 1_565 1_665 ?
Sb7 As3 As2 115.96(3) 1_565 1_665 ?
As5 As3 As2 70.64(3) 2_677 1_665 ?
Sb5 As3 As2 70.64(3) 2_677 1_665 ?
S8 As3 Sb2 122.76(6) 1_565 1_665 ?
S1 As3 Sb2 121.78(6) . 1_665 ?
S13 As3 Sb2 57.70(4) 2_676 1_665 ?
As4 As3 Sb2 111.23(3) . 1_665 ?
As7 As3 Sb2 115.96(3) 1_565 1_665 ?
Sb7 As3 Sb2 115.96(3) 1_565 1_665 ?
As5 As3 Sb2 70.64(3) 2_677 1_665 ?
Sb5 As3 Sb2 70.64(3) 2_677 1_665 ?
S8 As3 S4 82.76(7) 1_565 . ?
S3 As3 S4 178.53(7) 1_565 . ?
S1 As3 S4 83.68(6) . . ?
S13 As3 S4 89.86(5) 2_676 . ?
As4 As3 S4 58.29(4) . . ?
As7 As3 S4 56.72(4) 1_565 . ?
Sb7 As3 S4 56.72(4) 1_565 . ?
As5 As3 S4 65.37(4) 2_677 . ?
Sb5 As3 S4 65.37(4) 2_677 . ?
As2 As3 S4 135.52(4) 1_665 . ?
Sb2 As3 S4 135.52(4) 1_665 . ?
S5 As4 S7 98.45(8) . . ?
S5 As4 S1 100.13(8) . . ?
S7 As4 S1 97.96(8) . . ?
S5 As4 S12 92.03(7) . 2_666 ?
S7 As4 S12 95.97(7) . 2_666 ?
S1 As4 S12 159.92(7) . 2_666 ?
S5 As4 As3 125.73(6) . . ?
S7 As4 As3 123.32(6) . . ?
S1 As4 As3 46.27(5) . . ?
S12 As4 As3 113.69(5) 2_666 . ?
S5 As4 S4 71.26(7) . . ?
S7 As4 S4 166.34(7) . . ?
S1 As4 S4 92.82(7) . . ?
S12 As4 S4 75.91(6) 2_666 . ?
As3 As4 S4 70.32(4) . . ?
S5 As4 As6 123.22(6) . 1_655 ?
S1 As4 As6 120.67(6) . 1_655 ?
S12 As4 As6 62.97(5) 2_666 1_655 ?
As3 As4 As6 111.05(3) . 1_655 ?
S4 As4 As6 135.77(4) . 1_655 ?
S5 As4 Sb6 123.22(6) . 1_655 ?
S1 As4 Sb6 120.67(6) . 1_655 ?
S12 As4 Sb6 62.97(5) 2_666 1_655 ?
As3 As4 Sb6 111.05(3) . 1_655 ?
S4 As4 Sb6 135.77(4) . 1_655 ?
S5 As4 S11 161.82(7) . . ?
S7 As4 S11 67.10(7) . . ?
S1 As4 S11 93.04(6) . . ?
S12 As4 S11 79.16(6) 2_666 . ?
As3 As4 S11 72.44(4) . . ?
S4 As4 S11 120.86(6) . . ?
S7 As4 Sb1 126.37(6) . . ?
S1 As4 Sb1 121.05(6) . . ?
S12 As4 Sb1 59.32(5) 2_666 . ?
As3 As4 Sb1 110.31(3) . . ?
As6 As4 Sb1 118.28(3) 1_655 . ?
Sb6 As4 Sb1 118.28(3) 1_655 . ?
S11 As4 Sb1 136.23(4) . . ?
S5 As4 S5 56.02(7) . 2_666 ?
S7 As4 S5 63.14(6) . 2_666 ?
S1 As4 S5 64.99(5) . 2_666 ?
S12 As4 S5 134.79(5) 2_666 2_666 ?
As3 As4 S5 111.12(4) . 2_666 ?
S4 As4 S5 114.90(5) . 2_666 ?
As6 As4 S5 105.72(4) 1_655 2_666 ?
Sb6 As4 S5 105.72(4) 1_655 2_666 ?
S11 As4 S5 120.69(5) . 2_666 ?
Sb1 As4 S5 99.59(4) . 2_666 ?
S13 Sb5 S4 96.45(8) 1_556 . ?
S13 Sb5 S11 96.52(8) 1_556 1_455 ?
S4 Sb5 S11 102.90(9) . 1_455 ?
S13 Sb5 Sb6 57.53(6) 1_556 . ?
S4 Sb5 Sb6 94.42(6) . . ?
S13 Sb5 As3 61.81(5) 1_556 2_677 ?
S4 Sb5 As3 124.12(7) . 2_677 ?
S11 Sb5 As3 128.68(7) 1_455 2_677 ?
Sb6 Sb5 As3 110.09(3) . 2_677 ?
S13 Sb5 Sb1 56.19(6) 1_556 . ?
S4 Sb5 Sb1 42.31(5) . . ?
S11 Sb5 Sb1 93.71(6) 1_455 . ?
Sb6 Sb5 Sb1 63.16(2) . . ?
As3 Sb5 Sb1 106.93(3) 2_677 . ?
S13 Sb5 As2 149.54(7) 1_556 1_565 ?
S4 Sb5 As2 106.64(6) . 1_565 ?
S11 Sb5 As2 59.54(5) 1_455 1_565 ?
Sb6 Sb5 As2 100.30(3) . 1_565 ?
As3 Sb5 As2 116.51(3) 2_677 1_565 ?
Sb1 Sb5 As2 136.56(3) . 1_565 ?
S13 Sb5 Sb2 149.54(7) 1_556 1_565 ?
S4 Sb5 Sb2 106.64(6) . 1_565 ?
S11 Sb5 Sb2 59.54(5) 1_455 1_565 ?
Sb6 Sb5 Sb2 100.30(3) . 1_565 ?
As3 Sb5 Sb2 116.51(3) 2_677 1_565 ?
Sb1 Sb5 Sb2 136.56(3) . 1_565 ?
S13 Sb5 As7 153.96(7) 1_556 1_565 ?
S4 Sb5 As7 60.91(5) . 1_565 ?
S11 Sb5 As7 100.88(6) 1_455 1_565 ?
Sb6 Sb5 As7 131.50(3) . 1_565 ?
As3 Sb5 As7 118.34(3) 2_677 1_565 ?
Sb1 Sb5 As7 103.16(3) . 1_565 ?
As2 Sb5 As7 56.14(2) 1_565 1_565 ?
Sb2 Sb5 As7 56.14(2) 1_565 1_565 ?
S13 Sb5 Sb7 153.96(7) 1_556 1_565 ?
S4 Sb5 Sb7 60.91(5) . 1_565 ?
S11 Sb5 Sb7 100.88(6) 1_455 1_565 ?
Sb6 Sb5 Sb7 131.50(3) . 1_565 ?
As3 Sb5 Sb7 118.34(3) 2_677 1_565 ?
Sb1 Sb5 Sb7 103.16(3) . 1_565 ?
As2 Sb5 Sb7 56.14(2) 1_565 1_565 ?
Sb2 Sb5 Sb7 56.14(2) 1_565 1_565 ?
S11 Sb6 S10 98.45(8) 1_455 . ?
S11 Sb6 S7 91.61(7) 1_455 1_455 ?
S10 Sb6 S7 85.51(8) . 1_455 ?
S11 Sb6 S13 78.90(7) 1_455 1_556 ?
S10 Sb6 S13 91.19(7) . 1_556 ?
S7 Sb6 S13 169.41(7) 1_455 1_556 ?
S11 Sb6 S12 91.88(7) 1_455 2_566 ?
S10 Sb6 S12 165.57(6) . 2_566 ?
S7 Sb6 S12 84.15(7) 1_455 2_566 ?
S13 Sb6 S12 100.71(6) 1_556 2_566 ?
S11 Sb6 As4 71.75(6) 1_455 1_455 ?
S10 Sb6 As4 122.05(6) . 1_455 ?
S7 Sb6 As4 40.06(5) 1_455 1_455 ?
S13 Sb6 As4 137.88(5) 1_556 1_455 ?
S12 Sb6 As4 52.08(4) 2_566 1_455 ?
S11 Sb6 S6 177.20(8) 1_455 . ?
S10 Sb6 S6 79.43(6) . . ?
S7 Sb6 S6 90.05(6) 1_455 . ?
S13 Sb6 S6 99.25(5) 1_556 . ?
S12 Sb6 S6 90.53(5) 2_566 . ?
As4 Sb6 S6 110.90(4) 1_455 . ?
S11 Sb6 Sb5 41.04(6) 1_455 . ?
S10 Sb6 Sb5 88.06(5) . . ?
S7 Sb6 Sb5 130.41(6) 1_455 . ?
S13 Sb6 Sb5 39.25(4) 1_556 . ?
S12 Sb6 Sb5 106.32(4) 2_566 . ?
As4 Sb6 Sb5 110.87(3) 1_455 . ?
S6 Sb6 Sb5 136.68(5) . . ?
S11 Sb6 Sb1 89.92(6) 1_455 . ?
S10 Sb6 Sb1 40.11(5) . . ?
S7 Sb6 Sb1 125.02(6) 1_455 . ?
S13 Sb6 Sb1 51.09(4) 1_556 . ?
S12 Sb6 Sb1 150.72(4) 2_566 . ?
As4 Sb6 Sb1 153.41(3) 1_455 . ?
S6 Sb6 Sb1 87.28(4) . . ?
Sb5 Sb6 Sb1 58.67(2) . . ?
S11 Sb6 As8 141.43(6) 1_455 . ?
S10 Sb6 As8 71.50(6) . . ?
S7 Sb6 As8 123.35(5) 1_455 . ?
S13 Sb6 As8 64.60(4) 1_556 . ?
S12 Sb6 As8 106.19(4) 2_566 . ?
As4 Sb6 As8 145.50(3) 1_455 . ?
S6 Sb6 As8 36.17(4) . . ?
Sb5 Sb6 As8 100.53(3) . . ?
Sb1 Sb6 As8 57.96(2) . . ?
S2 Sb7 S9 96.59(8) . . ?
S2 Sb7 S8 89.38(7) . . ?
S9 Sb7 S8 86.61(8) . . ?
S2 Sb7 S12 77.74(7) . 1_556 ?
S9 Sb7 S12 90.29(7) . 1_556 ?
S8 Sb7 S12 166.33(7) . 1_556 ?
S2 Sb7 S13 89.54(7) . 2_666 ?
S9 Sb7 S13 167.79(7) . 2_666 ?
S8 Sb7 S13 82.89(7) . 2_666 ?
S12 Sb7 S13 101.35(6) 1_556 2_666 ?
S2 Sb7 S4 177.46(7) . 1_545 ?
S9 Sb7 S4 81.43(6) . 1_545 ?
S8 Sb7 S4 88.90(6) . 1_545 ?
S12 Sb7 S4 103.81(6) 1_556 1_545 ?
S13 Sb7 S4 92.11(5) 2_666 1_545 ?
S2 Sb7 As3 113.30(6) . 1_545 ?
S9 Sb7 As3 113.34(6) . 1_545 ?
S8 Sb7 As3 39.56(5) . 1_545 ?
S12 Sb7 As3 151.39(5) 1_556 1_545 ?
S13 Sb7 As3 54.45(4) 2_666 1_545 ?
S4 Sb7 As3 66.29(4) 1_545 1_545 ?
S2 Sb7 As8 40.61(6) . . ?
S9 Sb7 As8 86.48(6) . . ?
S8 Sb7 As8 127.95(6) . . ?
S12 Sb7 As8 38.46(4) 1_556 . ?
S13 Sb7 As8 104.92(4) 2_666 . ?
S4 Sb7 As8 140.44(5) 1_545 . ?
As3 Sb7 As8 151.15(3) 1_545 . ?
S2 Sb7 Sb2 89.33(6) . . ?
S9 Sb7 Sb2 39.42(5) . . ?
S8 Sb7 Sb2 125.33(6) . . ?
S12 Sb7 Sb2 50.95(4) 1_556 . ?
S13 Sb7 Sb2 151.74(4) 2_666 . ?
S4 Sb7 Sb2 90.13(4) 1_545 . ?
As3 Sb7 Sb2 148.73(3) 1_545 . ?
As8 Sb7 Sb2 58.50(2) . . ?
S2 Sb7 As1 82.89(6) . 2_667 ?
S9 Sb7 As1 144.36(6) . 2_667 ?
S8 Sb7 As1 128.93(6) . 2_667 ?
S12 Sb7 As1 54.60(4) 1_556 2_667 ?
S13 Sb7 As1 46.83(4) 2_666 2_667 ?
S4 Sb7 As1 99.65(4) 1_545 2_667 ?
As3 Sb7 As1 99.17(3) 1_545 2_667 ?
As8 Sb7 As1 69.98(2) . 2_667 ?
Sb2 Sb7 As1 105.07(3) . 2_667 ?
S2 Sb7 Sb1 82.89(6) . 2_667 ?
S9 Sb7 Sb1 144.36(6) . 2_667 ?
S8 Sb7 Sb1 128.93(6) . 2_667 ?
S12 Sb7 Sb1 54.60(4) 1_556 2_667 ?
S13 Sb7 Sb1 46.83(4) 2_666 2_667 ?
S4 Sb7 Sb1 99.65(4) 1_545 2_667 ?
As3 Sb7 Sb1 99.17(3) 1_545 2_667 ?
As8 Sb7 Sb1 69.98(2) . 2_667 ?
Sb2 Sb7 Sb1 105.07(3) . 2_667 ?
S12 As8 S6 96.74(8) 1_556 . ?
S12 As8 S2 97.72(8) 1_556 . ?
S6 As8 S2 102.51(9) . . ?
S12 As8 Sb7 58.38(6) 1_556 . ?
S6 As8 Sb7 94.35(6) . . ?
S12 As8 Sb2 56.61(6) 1_556 . ?
S2 As8 Sb2 94.33(6) . . ?
Sb7 As8 Sb2 63.67(2) . . ?
S12 As8 Sb1 149.84(7) 1_556 . ?
S6 As8 Sb1 110.61(6) . . ?
S2 As8 Sb1 64.88(5) . . ?
Sb7 As8 Sb1 105.58(3) . . ?
Sb2 As8 Sb1 143.67(3) . . ?
S12 As8 S13 135.82(7) 1_556 1_556 ?
S6 As8 S13 107.97(6) . 1_556 ?
S2 As8 S13 111.32(6) . 1_556 ?
Sb7 As8 S13 149.19(5) . 1_556 ?
Sb2 As8 S13 145.89(5) . 1_556 ?
Sb1 As8 S13 47.10(4) . 1_556 ?
S12 As8 S10 163.16(7) 1_556 . ?
S6 As8 S10 72.71(6) . . ?
S2 As8 S10 72.62(6) . . ?
Sb7 As8 S10 108.39(4) . . ?
Sb2 As8 S10 109.41(4) . . ?
S13 As8 S10 60.95(4) 1_556 . ?
S12 As8 Sb6 150.16(7) 1_556 . ?
S6 As8 Sb6 63.47(5) . . ?
S2 As8 Sb6 107.93(6) . . ?
Sb7 As8 Sb6 139.75(3) . . ?
Sb2 As8 Sb6 105.38(3) . . ?
Sb1 As8 Sb6 58.88(2) . . ?
S13 As8 Sb6 46.43(4) 1_556 . ?
As4 S1 As3 87.61(7) . . ?
As4 S1 K1 121.47(8) . 2_666 ?
As3 S1 K1 127.09(9) . 2_666 ?
As4 S1 K2 100.92(9) . . ?
As3 S1 K2 99.85(8) . . ?
K1 S1 K2 114.20(9) 2_666 . ?
As4 S1 S3 111.81(7) . 1_565 ?
K1 S1 S3 125.21(7) 2_666 1_565 ?
K2 S1 S3 63.76(7) . 1_565 ?
As3 S1 S7 112.41(7) . . ?
K1 S1 S7 118.03(7) 2_666 . ?
K2 S1 S7 65.66(7) . . ?
S3 S1 S7 109.97(7) 1_565 . ?
As4 S1 S8 114.05(8) . 1_565 ?
K1 S1 S8 86.88(7) 2_666 1_565 ?
K2 S1 S8 120.62(8) . 1_565 ?
S3 S1 S8 59.29(6) 1_565 1_565 ?
S7 S1 S8 150.53(7) . 1_565 ?
As3 S1 S5 112.44(7) . . ?
K1 S1 S5 81.93(7) 2_666 . ?
K2 S1 S5 123.17(8) . . ?
S3 S1 S5 148.81(7) 1_565 . ?
S7 S1 S5 59.24(6) . . ?
S8 S1 S5 114.07(8) 1_565 . ?
As4 S1 S8 171.70(9) . 2_666 ?
As3 S1 S8 84.82(6) . 2_666 ?
K1 S1 S8 61.51(6) 2_666 2_666 ?
K2 S1 S8 83.77(8) . 2_666 ?
S3 S1 S8 63.98(6) 1_565 2_666 ?
S7 S1 S8 146.57(8) . 2_666 ?
S8 S1 S8 57.72(6) 1_565 2_666 ?
S5 S1 S8 142.05(8) . 2_666 ?
As4 S1 S5 81.25(6) . 2_666 ?
As3 S1 S5 167.93(8) . 2_666 ?
K1 S1 S5 57.05(6) 2_666 2_666 ?
K2 S1 S5 86.90(7) . 2_666 ?
S3 S1 S5 149.24(8) 1_565 2_666 ?
S7 S1 S5 61.20(5) . 2_666 ?
S8 S1 S5 142.43(8) 1_565 2_666 ?
S5 S1 S5 55.66(6) . 2_666 ?
S8 S1 S5 105.98(6) 2_666 2_666 ?
As4 S1 W1 92.19(12) . . ?
As3 S1 W1 95.43(11) . . ?
K1 S1 W1 46.00(11) 2_666 . ?
K2 S1 W1 160.19(12) . . ?
S3 S1 W1 124.71(11) 1_565 . ?
S7 S1 W1 119.49(11) . . ?
S8 S1 W1 65.50(11) 1_565 . ?
S5 S1 W1 60.62(11) . . ?
S8 S1 W1 85.14(11) 2_666 . ?
S5 S1 W1 80.45(11) 2_666 . ?
As4 S1 S2 137.19(8) . 2_666 ?
As3 S1 S2 130.56(7) . 2_666 ?
K1 S1 S2 55.20(7) 2_666 2_666 ?
K2 S1 S2 59.40(7) . 2_666 ?
S3 S1 S2 93.68(6) 1_565 2_666 ?
S7 S1 S2 99.21(6) . 2_666 ?
S8 S1 S2 108.46(6) 1_565 2_666 ?
S5 S1 S2 116.29(6) . 2_666 ?
S8 S1 S2 51.10(5) 2_666 2_666 ?
S5 S1 S2 61.50(5) 2_666 2_666 ?
W1 S1 S2 100.97(11) . 2_666 ?
As8 S2 Sb7 98.22(8) . . ?
As8 S2 S8 141.22(9) . . ?
Sb7 S2 S8 45.85(5) . . ?
As8 S2 Sb1 77.08(6) . . ?
Sb7 S2 Sb1 169.72(9) . . ?
S8 S2 Sb1 140.85(7) . . ?
Sb7 S2 S12 60.05(6) . 1_556 ?
S8 S2 S12 105.78(7) . 1_556 ?
Sb1 S2 S12 113.05(7) . 1_556 ?
As8 S2 S9 87.43(7) . . ?
S8 S2 S9 56.73(6) . . ?
Sb1 S2 S9 145.42(8) . . ?
S12 S2 S9 67.43(6) 1_556 . ?
As8 S2 K1 155.76(10) . . ?
Sb7 S2 K1 98.82(8) . . ?
S8 S2 K1 61.29(7) . . ?
Sb1 S2 K1 83.20(6) . . ?
S12 S2 K1 145.29(9) 1_556 . ?
S9 S2 K1 116.70(8) . . ?
Sb7 S2 S6 91.59(7) . . ?
S8 S2 S6 115.49(8) . . ?
Sb1 S2 S6 90.26(6) . . ?
S12 S2 S6 57.45(6) 1_556 . ?
S9 S2 S6 59.96(6) . . ?
K1 S2 S6 156.66(9) . . ?
As8 S2 K2 93.91(9) . 2_666 ?
Sb7 S2 K2 97.89(8) . 2_666 ?
S8 S2 K2 80.23(7) . 2_666 ?
Sb1 S2 K2 91.59(7) . 2_666 ?
S12 S2 K2 108.89(8) 1_556 2_666 ?
S9 S2 K2 58.44(7) . 2_666 ?
K1 S2 K2 100.67(8) . 2_666 ?
S6 S2 K2 56.99(7) . 2_666 ?
As8 S2 S10 72.14(7) . . ?
Sb7 S2 S10 148.67(9) . . ?
S8 S2 S10 128.50(8) . . ?
S12 S2 S10 110.93(8) 1_556 . ?
S9 S2 S10 107.10(7) . . ?
K1 S2 S10 100.81(7) . . ?
S6 S2 S10 61.94(5) . . ?
K2 S2 S10 54.57(6) 2_666 . ?
As3 S3 As2 98.08(7) 1_545 1_655 ?
As3 S3 Sb2 98.08(7) 1_545 1_655 ?
As3 S3 S9 129.60(9) 1_545 1_655 ?
As2 S3 S9 48.13(5) 1_655 1_655 ?
Sb2 S3 S9 48.13(5) 1_655 1_655 ?
As3 S3 S6 121.73(8) 1_545 1_655 ?
As2 S3 S6 45.14(5) 1_655 1_655 ?
Sb2 S3 S6 45.14(5) 1_655 1_655 ?
S9 S3 S6 64.88(6) 1_655 1_655 ?
As2 S3 S8 122.09(8) 1_655 . ?
Sb2 S3 S8 122.09(8) 1_655 . ?
S9 S3 S8 168.90(8) 1_655 . ?
S6 S3 S8 113.02(8) 1_655 . ?
As3 S3 K1 95.07(8) 1_545 . ?
As2 S3 K1 96.84(8) 1_655 . ?
Sb2 S3 K1 96.84(8) 1_655 . ?
S9 S3 K1 121.18(8) 1_655 . ?
S6 S3 K1 58.85(6) 1_655 . ?
S8 S3 K1 61.25(7) . . ?
As2 S3 S1 121.49(7) 1_655 1_545 ?
Sb2 S3 S1 121.49(7) 1_655 1_545 ?
S9 S3 S1 117.70(8) 1_655 1_545 ?
S6 S3 S1 161.93(8) 1_655 1_545 ?
S8 S3 S1 60.64(6) . 1_545 ?
K1 S3 S1 121.08(8) . 1_545 ?
As3 S3 W1 131.70(15) 1_545 2_666 ?
As2 S3 W1 113.57(13) 1_655 2_666 ?
Sb2 S3 W1 113.57(13) 1_655 2_666 ?
S9 S3 W1 98.43(14) 1_655 2_666 ?
S6 S3 W1 69.83(11) 1_655 2_666 ?
S8 S3 W1 90.65(14) . 2_666 ?
K1 S3 W1 47.64(13) . 2_666 ?
S1 S3 W1 124.94(12) 1_545 2_666 ?
As3 S3 K2 94.03(8) 1_545 1_545 ?
As2 S3 K2 103.52(9) 1_655 1_545 ?
Sb2 S3 K2 103.52(9) 1_655 1_545 ?
S9 S3 K2 67.21(8) 1_655 1_545 ?
S6 S3 K2 131.59(9) 1_655 1_545 ?
S8 S3 K2 115.32(8) . 1_545 ?
K1 S3 K2 156.26(9) . 1_545 ?
S1 S3 K2 56.86(7) 1_545 1_545 ?
W1 S3 K2 111.59(13) 2_666 1_545 ?
As3 S3 S8 81.16(7) 1_545 2_656 ?
As2 S3 S8 178.32(9) 1_655 2_656 ?
Sb2 S3 S8 178.32(9) 1_655 2_656 ?
S9 S3 S8 133.44(8) 1_655 2_656 ?
S6 S3 S8 134.13(7) 1_655 2_656 ?
S8 S3 S8 56.42(6) . 2_656 ?
K1 S3 S8 81.77(7) . 2_656 ?
S1 S3 S8 58.81(5) 1_545 2_656 ?
W1 S3 S8 66.14(12) 2_666 2_656 ?
K2 S3 S8 78.04(8) 1_545 2_656 ?
As3 S3 S13 55.18(5) 1_545 2_666 ?
As2 S3 S13 57.54(5) 1_655 2_666 ?
Sb2 S3 S13 57.54(5) 1_655 2_666 ?
S9 S3 S13 105.61(7) 1_655 2_666 ?
S6 S3 S13 66.56(6) 1_655 2_666 ?
S8 S3 S13 64.62(6) . 2_666 ?
K1 S3 S13 66.77(7) . 2_666 ?
S1 S3 S13 96.28(6) 1_545 2_666 ?
W1 S3 S13 113.15(13) 2_666 2_666 ?
K2 S3 S13 135.25(8) 1_545 2_666 ?
S8 S3 S13 120.92(7) 2_656 2_666 ?
Sb5 S4 Sb1 96.88(7) . . ?
Sb1 S4 S13 58.02(5) . 1_556 ?
Sb5 S4 As4 164.44(8) . . ?
Sb1 S4 As4 71.92(6) . . ?
S13 S4 As4 124.86(7) 1_556 . ?
Sb5 S4 W1 110.63(16) . . ?
Sb1 S4 W1 94.02(12) . . ?
S13 S4 W1 121.01(15) 1_556 . ?
As4 S4 W1 81.52(14) . . ?
Sb5 S4 S5 137.81(8) . . ?
Sb1 S4 S5 45.30(5) . . ?
S13 S4 S5 102.93(7) 1_556 . ?
W1 S4 S5 64.35(12) . . ?
Sb5 S4 As7 83.52(6) . 1_565 ?
Sb1 S4 As7 176.60(9) . 1_565 ?
S13 S4 As7 123.06(7) 1_556 1_565 ?
As4 S4 As7 108.32(6) . 1_565 ?
W1 S4 As7 82.69(11) . 1_565 ?
S5 S4 As7 133.03(7) . 1_565 ?
Sb5 S4 Sb7 83.52(6) . 1_565 ?
Sb1 S4 Sb7 176.60(9) . 1_565 ?
S13 S4 Sb7 123.06(7) 1_556 1_565 ?
As4 S4 Sb7 108.32(6) . 1_565 ?
W1 S4 Sb7 82.69(11) . 1_565 ?
S5 S4 Sb7 133.03(7) . 1_565 ?
Sb5 S4 S10 85.65(7) . . ?
S13 S4 S10 65.90(6) 1_556 . ?
As4 S4 S10 92.40(6) . . ?
W1 S4 S10 60.82(12) . . ?
S5 S4 S10 54.39(6) . . ?
As7 S4 S10 134.97(7) 1_565 . ?
Sb7 S4 S10 134.97(7) 1_565 . ?
Sb1 S4 S11 89.93(7) . 1_455 ?
S13 S4 S11 57.77(6) 1_556 1_455 ?
As4 S4 S11 147.86(7) . 1_455 ?
W1 S4 S11 73.35(15) . 1_455 ?
S5 S4 S11 111.07(7) . 1_455 ?
As7 S4 S11 88.29(6) 1_565 1_455 ?
Sb7 S4 S11 88.29(6) 1_565 1_455 ?
S10 S4 S11 57.99(6) . 1_455 ?
As4 S5 Sb1 97.11(7) . . ?
As4 S5 S10 135.77(9) . . ?
Sb1 S5 S10 48.07(5) . . ?
As4 S5 S5 90.36(9) . 2_666 ?
Sb1 S5 S5 171.12(12) . 2_666 ?
S10 S5 S5 123.06(10) . 2_666 ?
As4 S5 K1 93.60(8) . . ?
Sb1 S5 K1 101.84(8) . . ?
S10 S5 K1 116.88(8) . . ?
S5 S5 K1 82.38(9) 2_666 . ?
Sb1 S5 S7 123.77(8) . . ?
S10 S5 S7 171.57(8) . . ?
S5 S5 S7 65.11(7) 2_666 . ?
K1 S5 S7 60.02(7) . . ?
As4 S5 S4 70.72(6) . . ?
S10 S5 S4 65.08(6) . . ?
S5 S5 S4 136.39(9) 2_666 . ?
K1 S5 S4 135.87(8) . . ?
S7 S5 S4 111.05(7) . . ?
Sb1 S5 S1 117.47(7) . . ?
S10 S5 S1 124.05(8) . . ?
S5 S5 S1 65.92(6) 2_666 . ?
K1 S5 S1 119.07(8) . . ?
S7 S5 S1 59.62(6) . . ?
S4 S5 S1 75.13(6) . . ?
As4 S5 S7 135.50(8) . 2_666 ?
Sb1 S5 S7 113.13(8) . 2_666 ?
S10 S5 S7 65.10(6) . 2_666 ?
S5 S5 S7 57.99(7) 2_666 2_666 ?
K1 S5 S7 110.16(7) . 2_666 ?
S7 S5 S7 123.11(6) . 2_666 ?
S4 S5 S7 109.44(7) . 2_666 ?
S1 S5 S7 95.51(6) . 2_666 ?
As4 S5 W1 95.87(13) . . ?
Sb1 S5 W1 87.46(13) . . ?
S10 S5 W1 61.89(13) . . ?
S5 S5 W1 87.01(13) 2_666 . ?
K1 S5 W1 165.81(12) . . ?
S7 S5 W1 123.26(14) . . ?
S4 S5 W1 57.78(11) . . ?
S1 S5 W1 64.03(13) . . ?
S7 S5 W1 55.89(10) 2_666 . ?
As4 S5 S1 135.84(9) . 2_666 ?
Sb1 S5 S1 117.59(7) . 2_666 ?
S10 S5 S1 88.33(6) . 2_666 ?
S5 S5 S1 58.42(6) 2_666 2_666 ?
K1 S5 S1 55.02(6) . 2_666 ?
S7 S5 S1 95.24(7) . 2_666 ?
S4 S5 S1 153.41(8) . 2_666 ?
S1 S5 S1 124.34(6) . 2_666 ?
S7 S5 S1 55.33(5) 2_666 2_666 ?
W1 S5 S1 111.19(11) . 2_666 ?
As8 S6 Sb2 97.71(8) . . ?
As8 S6 K1 158.83(9) . 1_455 ?
Sb2 S6 K1 100.43(8) . 1_455 ?
K1 S6 S12 149.96(9) 1_455 1_556 ?
As8 S6 S3 139.81(9) . 1_455 ?
Sb2 S6 S3 46.83(5) . 1_455 ?
K1 S6 S3 61.26(7) 1_455 1_455 ?
S12 S6 S3 105.50(7) 1_556 1_455 ?
As8 S6 Sb6 80.36(6) . . ?
Sb2 S6 Sb6 173.27(9) . . ?
K1 S6 Sb6 80.36(6) 1_455 . ?
S12 S6 Sb6 117.37(7) 1_556 . ?
S3 S6 Sb6 137.13(7) 1_455 . ?
As8 S6 K2 100.51(10) . 2_666 ?
Sb2 S6 K2 98.63(8) . 2_666 ?
K1 S6 K2 87.51(9) 1_455 2_666 ?
S12 S6 K2 115.54(10) 1_556 2_666 ?
S3 S6 K2 72.83(7) 1_455 2_666 ?
Sb6 S6 K2 88.07(7) . 2_666 ?
As8 S6 S9 86.32(7) . . ?
K1 S6 S9 114.49(8) 1_455 . ?
S12 S6 S9 67.17(6) 1_556 . ?
S3 S6 S9 55.45(6) 1_455 . ?
Sb6 S6 S9 142.72(7) . . ?
K2 S6 S9 60.27(7) 2_666 . ?
Sb2 S6 S2 91.36(7) . . ?
K1 S6 S2 150.22(9) 1_455 . ?
S12 S6 S2 58.30(6) 1_556 . ?
S3 S6 S2 112.38(8) 1_455 . ?
Sb6 S6 S2 91.09(6) . . ?
K2 S6 S2 63.58(8) 2_666 . ?
S9 S6 S2 58.55(6) . . ?
As8 S6 S10 72.18(6) . . ?
Sb2 S6 S10 148.74(9) . . ?
K1 S6 S10 97.00(7) 1_455 . ?
S12 S6 S10 111.61(7) 1_556 . ?
S3 S6 S10 125.92(7) 1_455 . ?
K2 S6 S10 56.31(6) 2_666 . ?
S9 S6 S10 106.03(7) . . ?
S2 S6 S10 61.90(5) . . ?
As4 S7 As6 97.27(8) . 1_655 ?
As4 S7 Sb6 97.27(8) . 1_655 ?
As4 S7 S10 138.54(8) . 1_655 ?
As6 S7 S10 46.49(5) 1_655 1_655 ?
Sb6 S7 S10 46.49(5) 1_655 1_655 ?
As4 S7 S11 74.75(7) . . ?
S10 S7 S11 64.71(6) 1_655 . ?
As4 S7 K1 92.98(8) . . ?
As6 S7 K1 97.77(8) 1_655 . ?
Sb6 S7 K1 97.77(8) 1_655 . ?
S10 S7 K1 109.06(8) 1_655 . ?
S11 S7 K1 134.73(8) . . ?
As6 S7 S5 121.36(8) 1_655 . ?
Sb6 S7 S5 121.36(8) 1_655 . ?
S10 S7 S5 164.48(8) 1_655 . ?
S11 S7 S5 114.67(8) . . ?
K1 S7 S5 59.44(6) . . ?
As6 S7 S1 119.58(7) 1_655 . ?
Sb6 S7 S1 119.58(7) 1_655 . ?
S10 S7 S1 130.88(8) 1_655 . ?
S11 S7 S1 78.57(6) . . ?
K1 S7 S1 120.00(8) . . ?
S5 S7 S1 61.14(6) . . ?
As4 S7 W1 131.16(16) . 2_666 ?
As6 S7 W1 114.42(13) 1_655 2_666 ?
Sb6 S7 W1 114.42(13) 1_655 2_666 ?
S10 S7 W1 88.03(14) 1_655 2_666 ?
S11 S7 W1 152.46(15) . 2_666 ?
K1 S7 W1 48.59(14) . 2_666 ?
S5 S7 W1 90.44(15) . 2_666 ?
S1 S7 W1 125.99(13) . 2_666 ?
As4 S7 S5 83.41(7) . 2_666 ?
As6 S7 S5 175.84(8) 1_655 2_666 ?
Sb6 S7 S5 175.84(8) 1_655 2_666 ?
S10 S7 S5 134.36(8) 1_655 2_666 ?
S11 S7 S5 140.36(7) . 2_666 ?
K1 S7 S5 78.09(7) . 2_666 ?
S5 S7 S5 56.89(6) . 2_666 ?
S1 S7 S5 63.47(5) . 2_666 ?
W1 S7 S5 62.55(12) 2_666 2_666 ?
As4 S7 K2 92.37(8) . . ?
As6 S7 K2 100.75(8) 1_655 . ?
Sb6 S7 K2 100.75(8) 1_655 . ?
S10 S7 K2 78.87(8) 1_655 . ?
S11 S7 K2 65.34(7) . . ?
K1 S7 K2 159.91(9) . . ?
S5 S7 K2 115.55(8) . . ?
S1 S7 K2 55.90(7) . . ?
W1 S7 K2 115.28(14) 2_666 . ?
S5 S7 K2 83.31(7) 2_666 . ?
As4 S7 S10 124.51(8) . 2_666 ?
As6 S7 S10 129.71(9) 1_655 2_666 ?
Sb6 S7 S10 129.71(9) 1_655 2_666 ?
S10 S7 S10 83.61(7) 1_655 2_666 ?
S11 S7 S10 117.25(7) . 2_666 ?
K1 S7 S10 105.71(8) . 2_666 ?
S5 S7 S10 108.87(7) . 2_666 ?
S1 S7 S10 85.63(6) . 2_666 ?
W1 S7 S10 59.82(12) 2_666 2_666 ?
S5 S7 S10 52.00(5) 2_666 2_666 ?
K2 S7 S10 55.87(6) . 2_666 ?
As3 S8 Sb7 98.20(8) 1_545 . ?
As3 S8 S9 126.51(9) 1_545 . ?
Sb7 S8 S9 46.19(6) . . ?
As3 S8 S2 122.90(9) 1_545 . ?
S9 S8 S2 64.36(6) . . ?
As3 S8 S8 88.87(9) 1_545 2_656 ?
Sb7 S8 S8 171.48(13) . 2_656 ?
S9 S8 S8 125.45(11) . 2_656 ?
S2 S8 S8 133.84(10) . 2_656 ?
Sb7 S8 S3 122.75(8) . . ?
S9 S8 S3 166.37(8) . . ?
S2 S8 S3 114.89(8) . . ?
S8 S8 S3 65.77(8) 2_656 . ?
Sb7 S8 S1 121.38(8) . 1_545 ?
S9 S8 S1 116.10(8) . 1_545 ?
S2 S8 S1 162.35(8) . 1_545 ?
S8 S8 S1 61.76(7) 2_656 1_545 ?
S3 S8 S1 60.07(6) . 1_545 ?
As3 S8 K1 93.75(8) 1_545 . ?
Sb7 S8 K1 98.50(8) . . ?
S9 S8 K1 124.74(9) . . ?
S2 S8 K1 61.93(7) . . ?
S8 S8 K1 85.70(9) 2_656 . ?
S3 S8 K1 59.67(7) . . ?
S1 S8 K1 118.97(8) 1_545 . ?
As3 S8 S1 136.46(9) 1_545 2_666 ?
Sb7 S8 S1 115.76(8) . 2_666 ?
S9 S8 S1 97.00(8) . 2_666 ?
S2 S8 S1 73.92(6) . 2_666 ?
S8 S8 S1 60.52(6) 2_656 2_666 ?
S3 S8 S1 95.69(7) . 2_666 ?
S1 S8 S1 122.28(6) 1_545 2_666 ?
K1 S8 S1 56.59(6) . 2_666 ?
As3 S8 S3 132.86(8) 1_545 2_656 ?
Sb7 S8 S3 113.67(9) . 2_656 ?
S9 S8 S3 68.16(6) . 2_656 ?
S2 S8 S3 104.02(8) . 2_656 ?
S8 S8 S3 57.81(7) 2_656 2_656 ?
S3 S8 S3 123.58(6) . 2_656 ?
S1 S8 S3 91.76(6) 1_545 2_656 ?
K1 S8 S3 113.59(7) . 2_656 ?
S1 S8 S3 57.21(5) 2_666 2_656 ?
As3 S8 S13 54.18(5) 1_545 2_666 ?
Sb7 S8 S13 59.71(6) . 2_666 ?
S9 S8 S13 105.67(7) . 2_666 ?
S2 S8 S13 68.77(6) . 2_666 ?
S8 S8 S13 128.77(10) 2_656 2_666 ?
S3 S8 S13 63.15(6) . 2_666 ?
S1 S8 S13 95.07(6) 1_545 2_666 ?
K1 S8 S13 65.72(6) . 2_666 ?
S1 S8 S13 120.90(7) 2_666 2_666 ?
S3 S8 S13 172.41(8) 2_656 2_666 ?
Sb7 S9 Sb2 102.70(8) . . ?
Sb7 S9 S3 149.95(9) . 1_455 ?
Sb2 S9 S3 49.31(6) . 1_455 ?
Sb7 S9 S8 47.20(6) . . ?
Sb2 S9 S8 148.64(9) . . ?
S3 S9 S8 155.31(9) 1_455 . ?
Sb7 S9 W1 102.50(14) . 1_545 ?
Sb2 S9 W1 133.28(15) . 1_545 ?
S3 S9 W1 105.69(14) 1_455 1_545 ?
S8 S9 W1 71.65(14) . 1_545 ?
Sb2 S9 S2 93.50(7) . . ?
S3 S9 S2 119.29(8) 1_455 . ?
S8 S9 S2 58.92(6) . . ?
W1 S9 S2 130.55(15) 1_545 . ?
Sb7 S9 K2 103.47(8) . 2_666 ?
Sb2 S9 K2 97.22(8) . 2_666 ?
S3 S9 K2 74.20(8) 1_455 2_666 ?
S8 S9 K2 84.45(8) . 2_666 ?
W1 S9 K2 114.12(13) 1_545 2_666 ?
S2 S9 K2 64.30(7) . 2_666 ?
Sb7 S9 S6 92.85(7) . . ?
S3 S9 S6 59.67(6) 1_455 . ?
S8 S9 S6 119.12(7) . . ?
W1 S9 S6 164.52(14) 1_545 . ?
S2 S9 S6 61.49(6) . . ?
K2 S9 S6 59.31(7) 2_666 . ?
Sb7 S9 S11 107.68(8) . 1_445 ?
Sb2 S9 S11 63.07(6) . 1_445 ?
S3 S9 S11 72.04(6) 1_455 1_445 ?
S8 S9 S11 127.20(8) . 1_445 ?
W1 S9 S11 72.04(13) 1_545 1_445 ?
S2 S9 S11 138.91(7) . 1_445 ?
K2 S9 S11 146.00(9) 2_666 1_445 ?
S6 S9 S11 105.35(7) . 1_445 ?
Sb7 S9 K2 146.56(10) . 1_445 ?
Sb2 S9 K2 99.05(8) . 1_445 ?
S3 S9 K2 60.85(7) 1_455 1_445 ?
S8 S9 K2 111.71(8) . 1_445 ?
S2 S9 K2 160.07(8) . 1_445 ?
K2 S9 K2 98.59(8) 2_666 1_445 ?
S6 S9 K2 120.13(9) . 1_445 ?
S11 S9 K2 61.02(6) 1_445 1_445 ?
Sb6 S10 Sb1 101.83(8) . . ?
Sb6 S10 S7 48.00(6) . 1_455 ?
Sb1 S10 S7 148.75(9) . 1_455 ?
Sb6 S10 S5 149.40(9) . . ?
Sb1 S10 S5 49.05(5) . . ?
S7 S10 S5 156.61(9) 1_455 . ?
Sb6 S10 K2 112.65(9) . 2_666 ?
Sb1 S10 K2 119.53(10) . 2_666 ?
S7 S10 K2 85.14(8) 1_455 2_666 ?
S5 S10 K2 93.14(8) . 2_666 ?
Sb1 S10 S11 92.37(7) . 1_455 ?
S7 S10 S11 60.07(6) 1_455 1_455 ?
S5 S10 S11 120.34(7) . 1_455 ?
K2 S10 S11 144.94(9) 2_666 1_455 ?
Sb6 S10 W1 112.79(14) . . ?
Sb1 S10 W1 90.50(13) . . ?
S7 S10 W1 94.74(14) 1_455 . ?
S5 S10 W1 65.28(13) . . ?
K2 S10 W1 116.98(12) 2_666 . ?
S11 S10 W1 73.44(12) 1_455 . ?
Sb6 S10 S4 91.87(7) . . ?
S7 S10 S4 120.23(8) 1_455 . ?
S5 S10 S4 60.52(6) . . ?
K2 S10 S4 153.44(10) 2_666 . ?
S11 S10 S4 61.40(6) 1_455 . ?
W1 S10 S4 57.55(11) . . ?
Sb6 S10 S7 143.86(9) . 2_666 ?
Sb1 S10 S7 111.91(8) . 2_666 ?
S7 S10 S7 96.39(7) 1_455 2_666 ?
S5 S10 S7 62.90(6) . 2_666 ?
K2 S10 S7 61.24(6) 2_666 2_666 ?
S11 S10 S7 122.68(7) 1_455 2_666 ?
W1 S10 S7 56.16(11) . 2_666 ?
S4 S10 S7 104.86(7) . 2_666 ?
Sb6 S10 As8 73.16(6) . . ?
Sb1 S10 As8 67.55(5) . . ?
S7 S10 As8 103.79(7) 1_455 . ?
S5 S10 As8 98.48(7) . . ?
K2 S10 As8 76.81(7) 2_666 . ?
S11 S10 As8 105.66(6) 1_455 . ?
W1 S10 As8 158.04(13) . . ?
S4 S10 As8 102.17(6) . . ?
S7 S10 As8 131.39(6) 2_666 . ?
As6 S11 As5 98.14(8) 1_655 1_655 ?
Sb6 S11 As5 98.14(8) 1_655 1_655 ?
As6 S11 Sb5 98.14(8) 1_655 1_655 ?
Sb6 S11 Sb5 98.14(8) 1_655 1_655 ?
As5 S11 S7 140.18(9) 1_655 . ?
Sb5 S11 S7 140.18(9) 1_655 . ?
As6 S11 As2 175.67(10) 1_655 1_665 ?
Sb6 S11 As2 175.67(10) 1_655 1_665 ?
As5 S11 As2 84.32(6) 1_655 1_665 ?
Sb5 S11 As2 84.32(6) 1_655 1_665 ?
S7 S11 As2 133.66(7) . 1_665 ?
As6 S11 Sb2 175.67(10) 1_655 1_665 ?
Sb6 S11 Sb2 175.67(10) 1_655 1_665 ?
As5 S11 Sb2 84.32(6) 1_655 1_665 ?
Sb5 S11 Sb2 84.32(6) 1_655 1_665 ?
S7 S11 Sb2 133.66(7) . 1_665 ?
As6 S11 S13 59.21(6) 1_655 1_656 ?
Sb6 S11 S13 59.21(6) 1_655 1_656 ?
S7 S11 S13 104.01(7) . 1_656 ?
As2 S11 S13 122.32(7) 1_665 1_656 ?
Sb2 S11 S13 122.32(7) 1_665 1_656 ?
As5 S11 S10 87.88(7) 1_655 1_655 ?
Sb5 S11 S10 87.88(7) 1_655 1_655 ?
S7 S11 S10 55.21(6) . 1_655 ?
As2 S11 S10 143.19(8) 1_665 1_655 ?
Sb2 S11 S10 143.19(8) 1_665 1_655 ?
S13 S11 S10 66.94(6) 1_656 1_655 ?
As6 S11 As4 69.63(6) 1_655 . ?
Sb6 S11 As4 69.63(6) 1_655 . ?
As5 S11 As4 158.59(9) 1_655 . ?
Sb5 S11 As4 158.59(9) 1_655 . ?
As2 S11 As4 106.91(6) 1_665 . ?
Sb2 S11 As4 106.91(6) 1_665 . ?
S13 S11 As4 120.99(7) 1_656 . ?
S10 S11 As4 93.02(6) 1_655 . ?
As6 S11 S4 91.25(7) 1_655 1_655 ?
Sb6 S11 S4 91.25(7) 1_655 1_655 ?
S7 S11 S4 114.72(8) . 1_655 ?
As2 S11 S4 92.88(6) 1_665 1_655 ?
Sb2 S11 S4 92.88(6) 1_665 1_655 ?
S13 S11 S4 57.62(6) 1_656 1_655 ?
S10 S11 S4 60.61(6) 1_655 1_655 ?
As4 S11 S4 152.77(7) . 1_655 ?
As6 S11 S9 144.62(10) 1_655 1_665 ?
Sb6 S11 S9 144.62(10) 1_655 1_665 ?
As5 S11 S9 78.37(7) 1_655 1_665 ?
Sb5 S11 S9 78.37(7) 1_655 1_665 ?
S7 S11 S9 121.11(7) . 1_665 ?
S13 S11 S9 116.76(8) 1_656 1_665 ?
S10 S11 S9 103.86(7) 1_655 1_665 ?
As4 S11 S9 121.92(6) . 1_665 ?
S4 S11 S9 63.96(6) 1_655 1_665 ?
As8 S12 As2 85.10(7) 1_554 1_554 ?
As8 S12 Sb2 85.10(7) 1_554 1_554 ?
As8 S12 As7 83.15(7) 1_554 1_554 ?
As2 S12 As7 76.95(5) 1_554 1_554 ?
Sb2 S12 As7 76.95(5) 1_554 1_554 ?
As8 S12 Sb7 83.15(7) 1_554 1_554 ?
As2 S12 Sb7 76.95(5) 1_554 1_554 ?
Sb2 S12 Sb7 76.95(5) 1_554 1_554 ?
As8 S12 As4 142.08(9) 1_554 2_666 ?
As2 S12 As4 122.14(7) 1_554 2_666 ?
Sb2 S12 As4 122.14(7) 1_554 2_666 ?
As7 S12 As4 125.65(8) 1_554 2_666 ?
Sb7 S12 As4 125.65(8) 1_554 2_666 ?
As8 S12 Sb1 100.69(8) 1_554 2_666 ?
As2 S12 Sb1 152.40(8) 1_554 2_666 ?
Sb2 S12 Sb1 152.40(8) 1_554 2_666 ?
As7 S12 Sb1 77.00(6) 1_554 2_666 ?
Sb7 S12 Sb1 77.00(6) 1_554 2_666 ?
As4 S12 Sb1 68.06(5) 2_666 2_666 ?
As8 S12 As1 100.69(8) 1_554 2_666 ?
As2 S12 As1 152.40(8) 1_554 2_666 ?
Sb2 S12 As1 152.40(8) 1_554 2_666 ?
As7 S12 As1 77.00(6) 1_554 2_666 ?
Sb7 S12 As1 77.00(6) 1_554 2_666 ?
As4 S12 As1 68.06(5) 2_666 2_666 ?
As7 S12 S6 85.63(6) 1_554 1_554 ?
Sb7 S12 S6 85.63(6) 1_554 1_554 ?
As4 S12 S6 145.41(9) 2_666 1_554 ?
Sb1 S12 S6 141.68(8) 2_666 1_554 ?
As1 S12 S6 141.68(8) 2_666 1_554 ?
As2 S12 S2 86.45(6) 1_554 1_554 ?
Sb2 S12 S2 86.45(6) 1_554 1_554 ?
As4 S12 S2 148.44(9) 2_666 1_554 ?
Sb1 S12 S2 80.38(7) 2_666 1_554 ?
As1 S12 S2 80.38(7) 2_666 1_554 ?
S6 S12 S2 64.25(6) 1_554 1_554 ?
As8 S12 As6 102.69(8) 1_554 2_566 ?
As2 S12 As6 75.59(5) 1_554 2_566 ?
Sb2 S12 As6 75.59(5) 1_554 2_566 ?
As7 S12 As6 151.26(7) 1_554 2_566 ?
Sb7 S12 As6 151.26(7) 1_554 2_566 ?
As4 S12 As6 64.95(5) 2_666 2_566 ?
Sb1 S12 As6 128.02(6) 2_666 2_566 ?
As1 S12 As6 128.02(6) 2_666 2_566 ?
S6 S12 As6 80.48(7) 1_554 2_566 ?
S2 S12 As6 142.61(8) 1_554 2_566 ?
As8 S12 Sb6 102.69(8) 1_554 2_566 ?
As2 S12 Sb6 75.59(5) 1_554 2_566 ?
Sb2 S12 Sb6 75.59(5) 1_554 2_566 ?
As7 S12 Sb6 151.26(7) 1_554 2_566 ?
Sb7 S12 Sb6 151.26(7) 1_554 2_566 ?
As4 S12 Sb6 64.95(5) 2_666 2_566 ?
Sb1 S12 Sb6 128.02(6) 2_666 2_566 ?
As1 S12 Sb6 128.02(6) 2_666 2_566 ?
S6 S12 Sb6 80.48(7) 1_554 2_566 ?
S2 S12 Sb6 142.61(8) 1_554 2_566 ?
As5 S13 Sb1 84.69(6) 1_554 1_554 ?
Sb5 S13 Sb1 84.69(6) 1_554 1_554 ?
As5 S13 As1 84.69(6) 1_554 1_554 ?
Sb5 S13 As1 84.69(6) 1_554 1_554 ?
As5 S13 As6 83.22(6) 1_554 1_554 ?
Sb5 S13 As6 83.22(6) 1_554 1_554 ?
Sb1 S13 As6 76.92(5) 1_554 1_554 ?
As1 S13 As6 76.92(5) 1_554 1_554 ?
As5 S13 Sb6 83.22(6) 1_554 1_554 ?
Sb5 S13 Sb6 83.22(6) 1_554 1_554 ?
Sb1 S13 Sb6 76.92(5) 1_554 1_554 ?
As1 S13 Sb6 76.92(5) 1_554 1_554 ?
As5 S13 As3 79.46(6) 1_554 2_676 ?
Sb5 S13 As3 79.46(6) 1_554 2_676 ?
Sb1 S13 As3 136.36(8) 1_554 2_676 ?
As1 S13 As3 136.36(8) 1_554 2_676 ?
As6 S13 As3 139.67(8) 1_554 2_676 ?
Sb6 S13 As3 139.67(8) 1_554 2_676 ?
As5 S13 Sb2 94.42(7) 1_554 2_566 ?
Sb5 S13 Sb2 94.42(7) 1_554 2_566 ?
Sb1 S13 Sb2 154.69(7) 1_554 2_566 ?
As1 S13 Sb2 154.69(7) 1_554 2_566 ?
As6 S13 Sb2 77.86(6) 1_554 2_566 ?
Sb6 S13 Sb2 77.86(6) 1_554 2_566 ?
As3 S13 Sb2 67.59(5) 2_676 2_566 ?
As5 S13 As2 94.42(7) 1_554 2_566 ?
Sb5 S13 As2 94.42(7) 1_554 2_566 ?
Sb1 S13 As2 154.69(7) 1_554 2_566 ?
As1 S13 As2 154.69(7) 1_554 2_566 ?
As6 S13 As2 77.86(6) 1_554 2_566 ?
Sb6 S13 As2 77.86(6) 1_554 2_566 ?
As3 S13 As2 67.59(5) 2_676 2_566 ?
As5 S13 As7 94.04(7) 1_554 2_666 ?
Sb5 S13 As7 94.04(7) 1_554 2_666 ?
Sb1 S13 As7 76.29(5) 1_554 2_666 ?
As1 S13 As7 76.29(5) 1_554 2_666 ?
As6 S13 As7 153.21(7) 1_554 2_666 ?
Sb6 S13 As7 153.21(7) 1_554 2_666 ?
As3 S13 As7 64.73(4) 2_676 2_666 ?
Sb2 S13 As7 128.92(6) 2_566 2_666 ?
As2 S13 As7 128.92(6) 2_566 2_666 ?
As5 S13 Sb7 94.04(7) 1_554 2_666 ?
Sb5 S13 Sb7 94.04(7) 1_554 2_666 ?
Sb1 S13 Sb7 76.29(5) 1_554 2_666 ?
As1 S13 Sb7 76.29(5) 1_554 2_666 ?
As6 S13 Sb7 153.21(7) 1_554 2_666 ?
Sb6 S13 Sb7 153.21(7) 1_554 2_666 ?
As3 S13 Sb7 64.73(4) 2_676 2_666 ?
Sb2 S13 Sb7 128.92(6) 2_566 2_666 ?
As2 S13 Sb7 128.92(6) 2_566 2_666 ?
As6 S13 S4 85.80(6) 1_554 1_554 ?
Sb6 S13 S4 85.80(6) 1_554 1_554 ?
As3 S13 S4 104.64(7) 2_676 1_554 ?
Sb2 S13 S4 136.01(7) 2_566 1_554 ?
As2 S13 S4 136.01(7) 2_566 1_554 ?
As7 S13 S4 74.61(6) 2_666 1_554 ?
Sb7 S13 S4 74.61(6) 2_666 1_554 ?
W1 K1 S1 76.53(16) 2_666 2_666 ?
W1 K1 S6 79.68(16) 2_666 1_655 ?
S1 K1 S6 152.88(11) 2_666 1_655 ?
W1 K1 S5 103.23(16) 2_666 . ?
S1 K1 S5 67.93(7) 2_666 . ?
S6 K1 S5 131.10(9) 1_655 . ?
W1 K1 S7 66.48(15) 2_666 . ?
S1 K1 S7 104.16(8) 2_666 . ?
S6 K1 S7 77.59(7) 1_655 . ?
S5 K1 S7 60.54(6) . . ?
W1 K1 S3 68.52(15) 2_666 . ?
S1 K1 S3 98.86(8) 2_666 . ?
S6 K1 S3 59.89(6) 1_655 . ?
S5 K1 S3 166.19(10) . . ?
S7 K1 S3 122.00(10) . . ?
W1 K1 S8 103.00(16) 2_666 . ?
S1 K1 S8 61.90(6) 2_666 . ?
S6 K1 S8 112.01(8) 1_655 . ?
S5 K1 S8 114.57(9) . . ?
S7 K1 S8 165.00(10) . . ?
S3 K1 S8 59.07(6) . . ?
W1 K1 S2 149.81(17) 2_666 . ?
S1 K1 S2 73.98(7) 2_666 . ?
S6 K1 S2 126.91(10) 1_655 . ?
S5 K1 S2 71.39(7) . . ?
S7 K1 S2 127.48(9) . . ?
S3 K1 S2 109.81(8) . . ?
S8 K1 S2 56.78(6) . . ?
W1 K1 S13 128.33(16) 2_666 2_666 ?
S1 K1 S13 122.51(8) 2_666 2_666 ?
S6 K1 S13 64.78(6) 1_655 2_666 ?
S5 K1 S13 128.30(10) . 2_666 ?
S7 K1 S13 132.67(9) . 2_666 ?
S3 K1 S13 61.59(6) . 2_666 ?
S8 K1 S13 62.08(6) . 2_666 ?
S2 K1 S13 65.70(7) . 2_666 ?
W1 K1 As4 94.37(14) 2_666 . ?
S1 K1 As4 95.69(7) 2_666 . ?
S6 K1 As4 98.93(7) 1_655 . ?
S5 K1 As4 32.57(4) . . ?
S7 K1 As4 32.67(4) . . ?
S3 K1 As4 154.02(9) . . ?
S8 K1 As4 146.60(9) . . ?
S2 K1 As4 94.83(7) . . ?
S13 K1 As4 125.94(8) 2_666 . ?
W1 K1 As8 142.80(16) 2_666 2_667 ?
S1 K1 As8 137.87(9) 2_666 2_667 ?
S6 K1 As8 68.82(6) 1_655 2_667 ?
S5 K1 As8 84.21(7) . 2_667 ?
S7 K1 As8 87.27(7) . 2_667 ?
S3 K1 As8 109.12(7) . 2_667 ?
S8 K1 As8 106.76(8) . 2_667 ?
S2 K1 As8 67.28(7) . 2_667 ?
S13 K1 As8 53.65(5) 2_666 2_667 ?
As4 K1 As8 72.30(5) . 2_667 ?
W1 K1 S12 126.73(15) 2_666 2_666 ?
S1 K1 S12 125.39(8) 2_666 2_666 ?
S6 K1 S12 79.72(7) 1_655 2_666 ?
S5 K1 S12 59.23(6) . 2_666 ?
S7 K1 S12 61.32(6) . 2_666 ?
S3 K1 S12 134.55(9) . 2_666 ?
S8 K1 S12 130.26(9) . 2_666 ?
S2 K1 S12 77.16(7) . 2_666 ?
S13 K1 S12 83.77(7) 2_666 2_666 ?
As4 K1 S12 42.19(4) . 2_666 ?
As8 K1 S12 30.11(3) 2_667 2_666 ?
W1 K2 S1 151.86(18) 1_655 . ?
W1 K2 S10 94.62(16) 1_655 2_666 ?
S1 K2 S10 91.45(9) . 2_666 ?
W1 K2 S6 77.33(16) 1_655 2_666 ?
S1 K2 S6 129.85(12) . 2_666 ?
S10 K2 S6 66.49(7) 2_666 2_666 ?
W1 K2 S9 107.99(17) 1_655 2_666 ?
S1 K2 S9 94.30(10) . 2_666 ?
S10 K2 S9 114.30(10) 2_666 2_666 ?
S6 K2 S9 60.42(7) 2_666 2_666 ?
W1 K2 S3 113.93(16) 1_655 1_565 ?
S1 K2 S3 59.38(7) . 1_565 ?
S10 K2 S3 150.20(12) 2_666 1_565 ?
S6 K2 S3 126.11(10) 2_666 1_565 ?
S9 K2 S3 66.22(7) 2_666 1_565 ?
W1 K2 S7 100.52(17) 1_655 . ?
S1 K2 S7 58.44(6) . . ?
S10 K2 S7 62.89(6) 2_666 . ?
S6 K2 S7 128.98(9) 2_666 . ?
S9 K2 S7 151.48(12) 2_666 . ?
S3 K2 S7 101.74(8) 1_565 . ?
W1 K2 S2 136.28(17) 1_655 2_666 ?
S1 K2 S2 70.44(8) . 2_666 ?
S10 K2 S2 63.87(7) 2_666 2_666 ?
S6 K2 S2 59.43(7) 2_666 2_666 ?
S9 K2 S2 57.25(7) 2_666 2_666 ?
S3 K2 S2 97.66(10) 1_565 2_666 ?
S7 K2 S2 101.73(9) . 2_666 ?
W1 K2 S9 62.01(14) 1_655 1_665 ?
S1 K2 S9 106.27(9) . 1_665 ?
S10 K2 S9 155.73(12) 2_666 1_665 ?
S6 K2 S9 110.91(9) 2_666 1_665 ?
S9 K2 S9 81.41(8) 2_666 1_665 ?
S3 K2 S9 51.95(6) 1_565 1_665 ?
S7 K2 S9 112.37(9) . 1_665 ?
S2 K2 S9 137.41(10) 2_666 1_665 ?
W1 K2 S11 78.51(16) 1_655 . ?
S1 K2 S11 73.81(7) . . ?
S10 K2 S11 112.79(9) 2_666 . ?
S6 K2 S11 155.65(12) 2_666 . ?
S9 K2 S11 131.59(9) 2_666 . ?
S3 K2 S11 67.55(6) 1_565 . ?
S7 K2 S11 53.51(6) . . ?
S2 K2 S11 143.90(10) 2_666 . ?
S9 K2 S11 58.93(6) 1_665 . ?
W1 K2 S3 58.61(15) 1_655 2_766 ?
S1 K2 S3 140.29(10) . 2_766 ?
S10 K2 S3 116.04(9) 2_666 2_766 ?
S6 K2 S3 52.17(6) 2_666 2_766 ?
S9 K2 S3 49.38(6) 2_666 2_766 ?
S3 K2 S3 87.51(7) 1_565 2_766 ?
S7 K2 S3 159.11(11) . 2_766 ?
S2 K2 S3 95.45(8) 2_666 2_766 ?
S9 K2 S3 59.10(6) 1_665 2_766 ?
S11 K2 S3 115.61(9) . 2_766 ?
W1 K2 As3 130.37(16) 1_655 . ?
S1 K2 As3 31.24(4) . . ?
S10 K2 As3 121.77(9) 2_666 . ?
S6 K2 As3 145.06(11) 2_666 . ?
S9 K2 As3 87.85(8) 2_666 . ?
S3 K2 As3 31.14(4) 1_565 . ?
S7 K2 As3 72.87(6) . . ?
S2 K2 As3 92.19(8) 2_666 . ?
S9 K2 As3 75.09(6) 1_665 . ?
S11 K2 As3 57.69(5) . . ?
S3 K2 As3 118.60(7) 2_766 . ?
N2 W1 N1 115.5(2) 1_455 2_666 ?
K2 W1 N1 115.5(2) 1_455 2_666 ?
N2 W1 K1 115.5(2) 1_455 2_666 ?
K2 W1 K1 115.5(2) 1_455 2_666 ?
N2 W1 S7 92.21(19) 1_455 2_666 ?
K2 W1 S7 92.21(19) 1_455 2_666 ?
N1 W1 S7 64.93(14) 2_666 2_666 ?
K1 W1 S7 64.93(14) 2_666 2_666 ?
N2 W1 S4 116.4(2) 1_455 . ?
K2 W1 S4 116.4(2) 1_455 . ?
N1 W1 S4 128.0(3) 2_666 . ?
K1 W1 S4 128.0(3) 2_666 . ?
S7 W1 S4 114.73(19) 2_666 . ?
N2 W1 S9 73.12(17) 1_455 1_565 ?
K2 W1 S9 73.12(17) 1_455 1_565 ?
N1 W1 S9 126.7(2) 2_666 1_565 ?
K1 W1 S9 126.7(2) 2_666 1_565 ?
S7 W1 S9 164.0(3) 2_666 1_565 ?
S4 W1 S9 68.39(12) . 1_565 ?
N2 W1 S3 79.38(17) 1_455 2_666 ?
K2 W1 S3 79.38(17) 1_455 2_666 ?
N1 W1 S3 63.85(15) 2_666 2_666 ?
K1 W1 S3 63.85(15) 2_666 2_666 ?
S7 W1 S3 117.22(18) 2_666 2_666 ?
S4 W1 S3 124.66(19) . 2_666 ?
S9 W1 S3 67.08(12) 1_565 2_666 ?
N2 W1 S10 85.9(2) 1_455 . ?
K2 W1 S10 85.9(2) 1_455 . ?
N1 W1 S10 124.9(2) 2_666 . ?
K1 W1 S10 124.9(2) 2_666 . ?
S7 W1 S10 64.02(12) 2_666 . ?
S4 W1 S10 61.63(12) . . ?
S9 W1 S10 107.68(19) 1_565 . ?
S3 W1 S10 165.2(3) 2_666 . ?
N2 W1 S5 137.0(2) 1_455 . ?
K2 W1 S5 137.0(2) 1_455 . ?
N1 W1 S5 85.18(19) 2_666 . ?
K1 W1 S5 85.18(19) 2_666 . ?
S7 W1 S5 61.57(12) 2_666 . ?
S4 W1 S5 57.86(11) . . ?
S9 W1 S5 125.76(18) 1_565 . ?
S3 W1 S5 141.7(2) 2_666 . ?
S10 W1 S5 52.83(10) . . ?
N2 W1 S1 167.3(2) 1_455 . ?
K2 W1 S1 167.3(2) 1_455 . ?
N1 W1 S1 57.47(15) 2_666 . ?
K1 W1 S1 57.47(15) 2_666 . ?
S7 W1 S1 93.52(18) 2_666 . ?
S4 W1 S1 71.12(14) . . ?
S9 W1 S1 102.12(17) 1_565 . ?
S3 W1 S1 87.89(17) 2_666 . ?
S10 W1 S1 106.86(17) . . ?
S5 W1 S1 55.36(11) . . ?
N2 W1 S8 118.7(2) 1_455 1_565 ?
K2 W1 S8 118.7(2) 1_455 1_565 ?
N1 W1 S8 85.12(19) 2_666 1_565 ?
K1 W1 S8 85.12(19) 2_666 1_565 ?
S7 W1 S8 144.6(2) 2_666 1_565 ?
S4 W1 S8 68.58(12) . 1_565 ?
S9 W1 S8 51.30(10) 1_565 1_565 ?
S3 W1 S8 58.36(11) 2_666 1_565 ?
S10 W1 S8 130.20(18) . 1_565 ?
S5 W1 S8 99.33(17) . 1_565 ?
S1 W1 S8 52.83(11) . 1_565 ?
 
_diffrn_measured_fraction_theta_max    0.902
_diffrn_reflns_theta_full              31.76
_diffrn_measured_fraction_theta_full   0.902
_refine_diff_density_max    1.006
_refine_diff_density_min   -0.907
_refine_diff_density_rms    0.184
