#------------------------------------------------------------------------------
#$Date: 2016-03-23 22:09:31 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179469 $
#$URL: svn://www.crystallography.net/cod/cif/4/33/66/4336646.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_4336646
loop_
_publ_author_name
'Chi Zhang'
'Kai-Ni Wang'
'Min Ji'
'Yong-Lin An'
_publ_section_title
;
 Mild Solvothermal Syntheses of Thioargentates A-Ag-S (A = K, Rb, Cs) and
 A-Ag-Ge-S (A = Na, Rb): Crucial Role of Excess Sulfur
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              12367
_journal_page_last               12371
_journal_paper_doi               10.1021/ic402092r
_journal_volume                  52
_journal_year                    2013
_chemical_formula_sum            'Ag5 K S3'
_chemical_formula_weight         674.66
_chemical_name_common            Compound-1
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           190
_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_Hall  'P -6c -2c'
_symmetry_space_group_name_H-M   'P -6 2 c'
_atom_sites_solution_hydrogens   none
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            6
_cell_length_a                   13.2208(12)
_cell_length_b                   13.2208(12)
_cell_length_c                   7.9479(14)
_cell_measurement_temperature    296
_cell_volume                     1203.1(3)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'Bruker SHELXTL'
_computing_structure_solution    'Bruker SHELXTL'
_diffrn_ambient_temperature      296
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0280
_diffrn_reflns_av_sigmaI/netI    0.0196
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_l_max       8
_diffrn_reflns_limit_l_min       -9
_diffrn_reflns_number            5096
_diffrn_reflns_theta_full        24.98
_diffrn_reflns_theta_max         24.98
_diffrn_reflns_theta_min         3.08
_exptl_absorpt_coefficient_mu    13.189
_exptl_absorpt_correction_T_max  0.2596
_exptl_absorpt_correction_T_min  0.1195
_exptl_absorpt_correction_type   empirical
_exptl_crystal_colour            'dark red-black'
_exptl_crystal_density_diffrn    5.587
_exptl_crystal_description       block
_exptl_crystal_F_000             1812
_exptl_crystal_size_max          0.28
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.14
_refine_diff_density_max         1.367
_refine_diff_density_min         -3.253
_refine_diff_density_rms         0.763
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.41(13)
_refine_ls_extinction_coef       0.0116(5)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.333
_refine_ls_hydrogen_treatment    none
_refine_ls_matrix_type           full
_refine_ls_number_parameters     48
_refine_ls_number_reflns         771
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.333
_refine_ls_R_factor_all          0.0344
_refine_ls_R_factor_gt           0.0336
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0395P)²+2.1661P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0789
_refine_ls_wR_factor_ref         0.0797
_reflns_number_gt                751
_reflns_number_total             771
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic402092r_si_001_1.cif
_cod_data_source_block           1
_cod_database_code               4336646
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+y, -x, -z+1/2'
'-y, x-y, z'
'x, y, -z+1/2'
'-x+y, -x, z'
'-y, x-y, -z+1/2'
'y, x, z+1/2'
'x-y, -y, -z'
'-x, -x+y, z+1/2'
'y, x, -z'
'x-y, -y, z+1/2'
'-x, -x+y, -z'
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
Ag1 Ag 0.00449(7) 0.29541(9) 0.2500 0.0354(3) Uani 1 2 d S
Ag2 Ag 0.36718(8) 0.37063(9) 0.2500 0.0387(4) Uani 1 2 d S
Ag3 Ag 0.0000 0.46388(9) 0.0000 0.0322(3) Uani 1 2 d S
Ag4 Ag 0.18451(7) 0.33479(7) 0.50189(5) 0.0350(3) Uani 1 1 d .
K1 K 0.3333 0.6667 -0.0011(3) 0.0238(7) Uani 1 3 d S
K3 K 0.0000 0.0000 0.0000 0.0247(10) Uani 1 6 d S
S1 S 0.2205(2) 0.44878(19) 0.2500 0.0222(6) Uani 1 2 d S
S2 S -0.1169(2) 0.4159(2) 0.2500 0.0220(6) Uiso 1 2 d S
S10 S -0.1364(2) 0.0799(2) 0.2500 0.0212(6) Uani 1 2 d S
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
K K 0.2009 0.2494 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
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
S10 Ag1 S1 143.68(9) . .
S10 Ag1 S2 109.81(8) . .
S1 Ag1 S2 106.51(9) . .
S10 Ag1 Ag4 106.02(5) . .
S1 Ag1 Ag4 51.28(3) . .
S2 Ag1 Ag4 123.15(4) . .
S10 Ag1 Ag4 106.02(5) . 4
S1 Ag1 Ag4 51.28(3) . 4
S2 Ag1 Ag4 123.15(4) . 4
Ag4 Ag1 Ag4 85.46(4) . 4
S10 Ag1 Ag4 50.63(3) . 9_554
S1 Ag1 Ag4 138.830(17) . 9_554
S2 Ag1 Ag4 80.28(5) . 9_554
Ag4 Ag1 Ag4 153.95(5) . 9_554
Ag4 Ag1 Ag4 90.42(3) 4 9_554
S10 Ag1 Ag4 50.63(3) . 12_556
S1 Ag1 Ag4 138.830(17) . 12_556
S2 Ag1 Ag4 80.28(5) . 12_556
Ag4 Ag1 Ag4 90.42(3) . 12_556
Ag4 Ag1 Ag4 153.95(5) 4 12_556
Ag4 Ag1 Ag4 82.08(3) 9_554 12_556
S10 Ag1 Ag3 124.29(4) . 4
S1 Ag1 Ag3 80.79(5) . 4
S2 Ag1 Ag3 48.88(3) . 4
Ag4 Ag1 Ag3 74.56(2) . 4
Ag4 Ag1 Ag3 129.09(3) 4 4
Ag4 Ag1 Ag3 126.07(4) 9_554 4
Ag4 Ag1 Ag3 73.81(2) 12_556 4
S10 Ag1 Ag3 124.29(4) . .
S1 Ag1 Ag3 80.79(5) . .
S2 Ag1 Ag3 48.88(3) . .
Ag4 Ag1 Ag3 129.09(3) . .
Ag4 Ag1 Ag3 74.57(2) 4 .
Ag4 Ag1 Ag3 73.81(2) 9_554 .
Ag4 Ag1 Ag3 126.07(4) 12_556 .
Ag3 Ag1 Ag3 82.70(4) 4 .
S2 Ag2 S1 133.59(8) 3_665 .
S2 Ag2 S10 125.85(9) 3_665 2
S1 Ag2 S10 100.57(7) . 2
S2 Ag2 Ag3 51.19(3) 3_665 6_665
S1 Ag2 Ag3 98.16(4) . 6_665
S10 Ag2 Ag3 133.77(3) 2 6_665
S2 Ag2 Ag3 51.19(3) 3_665 3_665
S1 Ag2 Ag3 98.16(4) . 3_665
S10 Ag2 Ag3 133.77(3) 2 3_665
Ag3 Ag2 Ag3 83.89(4) 6_665 3_665
S2 Ag2 Ag4 135.59(3) 3_665 4
S1 Ag2 Ag4 50.35(3) . 4
S10 Ag2 Ag4 75.21(4) 2 4
Ag3 Ag2 Ag4 144.61(4) 6_665 4
Ag3 Ag2 Ag4 85.36(2) 3_665 4
S2 Ag2 Ag4 135.59(3) 3_665 .
S1 Ag2 Ag4 50.35(3) . .
S10 Ag2 Ag4 75.21(4) 2 .
Ag3 Ag2 Ag4 85.36(2) 6_665 .
Ag3 Ag2 Ag4 144.61(4) 3_665 .
Ag4 Ag2 Ag4 84.18(3) 4 .
S2 Ag2 Ag4 94.35(5) 3_665 7_554
S1 Ag2 Ag4 119.50(4) . 7_554
S10 Ag2 Ag4 49.15(3) 2 7_554
Ag3 Ag2 Ag4 141.85(3) 6_665 7_554
Ag3 Ag2 Ag4 84.91(2) 3_665 7_554
Ag4 Ag2 Ag4 70.01(3) 4 7_554
Ag4 Ag2 Ag4 122.40(4) . 7_554
S2 Ag2 Ag4 94.35(5) 3_665 10_556
S1 Ag2 Ag4 119.50(4) . 10_556
S10 Ag2 Ag4 49.15(3) 2 10_556
Ag3 Ag2 Ag4 84.91(2) 6_665 10_556
Ag3 Ag2 Ag4 141.85(3) 3_665 10_556
Ag4 Ag2 Ag4 122.40(4) 4 10_556
Ag4 Ag2 Ag4 70.01(3) . 10_556
Ag4 Ag2 Ag4 81.79(3) 7_554 10_556
S2 Ag3 S2 173.42(13) 9_554 .
S2 Ag3 Ag2 120.22(7) 9_554 2_565
S2 Ag3 Ag2 53.93(6) . 2_565
S2 Ag3 Ag2 53.93(6) 9_554 8_565
S2 Ag3 Ag2 120.22(7) . 8_565
Ag2 Ag3 Ag2 83.91(4) 2_565 8_565
S2 Ag3 Ag1 60.36(6) 9_554 9_554
S2 Ag3 Ag1 125.49(7) . 9_554
Ag2 Ag3 Ag1 179.37(3) 2_565 9_554
Ag2 Ag3 Ag1 96.68(2) 8_565 9_554
S2 Ag3 Ag1 125.49(7) 9_554 .
S2 Ag3 Ag1 60.36(6) . .
Ag2 Ag3 Ag1 96.68(2) 2_565 .
Ag2 Ag3 Ag1 179.37(3) 8_565 .
Ag1 Ag3 Ag1 82.74(4) 9_554 .
S2 Ag3 Ag4 112.11(6) 9_554 9_554
S2 Ag3 Ag4 73.54(6) . 9_554
Ag2 Ag3 Ag4 127.443(18) 2_565 9_554
Ag2 Ag3 Ag4 126.72(2) 8_565 9_554
Ag1 Ag3 Ag4 52.00(2) 9_554 9_554
Ag1 Ag3 Ag4 53.04(2) . 9_554
S2 Ag3 Ag4 73.54(6) 9_554 4
S2 Ag3 Ag4 112.11(6) . 4
Ag2 Ag3 Ag4 126.72(2) 2_565 4
Ag2 Ag3 Ag4 127.443(18) 8_565 4
Ag1 Ag3 Ag4 53.04(2) 9_554 4
Ag1 Ag3 Ag4 52.00(2) . 4
Ag4 Ag3 Ag4 71.65(3) 9_554 4
S10 Ag4 S1 176.60(9) 9 .
S10 Ag4 Ag1 121.04(6) 9 .
S1 Ag4 Ag1 55.63(6) . .
S10 Ag4 Ag2 125.74(7) 9 .
S1 Ag4 Ag2 56.75(6) . .
Ag1 Ag4 Ag2 95.17(2) . .
S10 Ag4 Ag1 53.89(6) 9 9
S1 Ag4 Ag1 123.54(7) . 9
Ag1 Ag4 Ag1 83.78(3) . 9
Ag2 Ag4 Ag1 178.08(4) . 9
S10 Ag4 Ag2 59.04(6) 9 7
S1 Ag4 Ag2 124.32(7) . 7
Ag1 Ag4 Ag2 177.31(4) . 7
Ag2 Ag4 Ag2 82.99(3) . 7
Ag1 Ag4 Ag2 98.00(2) 9 7
S10 Ag4 Ag4 70.80(6) 9 10_556
S1 Ag4 Ag4 111.33(6) . 10_556
Ag1 Ag4 Ag4 122.67(3) . 10_556
Ag2 Ag4 Ag4 55.34(2) . 10_556
Ag1 Ag4 Ag4 123.99(3) 9 10_556
Ag2 Ag4 Ag4 54.65(2) 7 10_556
S10 Ag4 Ag3 106.93(6) 9 4
S1 Ag4 Ag3 70.69(6) . 4
Ag1 Ag4 Ag3 53.44(2) . 4
Ag2 Ag4 Ag3 127.32(2) . 4
Ag1 Ag4 Ag3 53.15(2) 9 4
Ag2 Ag4 Ag3 129.25(2) 7 4
Ag4 Ag4 Ag3 174.127(16) 10_556 4
Ag4 S1 Ag4 112.64(10) 4 .
Ag4 S1 Ag1 73.09(6) 4 .
Ag4 S1 Ag1 73.09(6) . .
Ag4 S1 Ag2 72.91(6) 4 .
Ag4 S1 Ag2 72.91(6) . .
Ag1 S1 Ag2 116.36(9) . .
Ag3 S2 Ag3 111.80(10) 4 .
Ag3 S2 Ag2 74.88(7) 4 2_565
Ag3 S2 Ag2 74.88(7) . 2_565
Ag3 S2 Ag1 70.76(6) 4 .
Ag3 S2 Ag1 70.76(6) . .
Ag2 S2 Ag1 116.26(9) 2_565 .
Ag4 S10 Ag4 110.62(10) 9_554 12_556
Ag4 S10 Ag1 75.48(6) 9_554 .
Ag4 S10 Ag1 75.48(6) 12_556 .
Ag4 S10 Ag2 71.81(6) 9_554 3
Ag4 S10 Ag2 71.81(6) 12_556 3
Ag1 S10 Ag2 120.61(9) . 3
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 S10 2.506(2) .
Ag1 S1 2.545(3) .
Ag1 S2 2.769(3) .
Ag1 Ag4 2.9504(10) .
Ag1 Ag4 2.9504(10) 4
Ag1 Ag4 3.0032(9) 9_554
Ag1 Ag4 3.0032(9) 12_556
Ag1 Ag3 3.0074(10) 4
Ag1 Ag3 3.0074(10) .
Ag2 S2 2.489(3) 3_665
Ag2 S1 2.613(3) .
Ag2 S10 2.719(3) 2
Ag2 Ag3 2.9727(12) 6_665
Ag2 Ag3 2.9727(12) 3_665
Ag2 Ag4 2.9867(10) 4
Ag2 Ag4 2.9867(10) .
Ag2 Ag4 3.0122(10) 7_554
Ag2 Ag4 3.0122(10) 10_556
Ag3 S2 2.3996(14) 9_554
Ag3 S2 2.3996(14) .
Ag3 Ag2 2.9727(12) 2_565
Ag3 Ag2 2.9727(12) 8_565
Ag3 Ag1 3.0074(10) 9_554
Ag3 Ag4 3.6092(13) 9_554
Ag3 Ag4 3.6092(13) 4
Ag4 S10 2.3982(14) 9
Ag4 S1 2.4058(14) .
Ag4 Ag1 3.0032(9) 9
Ag4 Ag2 3.0122(10) 7
Ag4 Ag4 3.4415(17) 10_556
Ag4 Ag3 3.6092(13) 4
S1 Ag4 2.4058(14) 4
S2 Ag3 2.3996(14) 4
S2 Ag2 2.489(3) 2_565
S10 Ag4 2.3982(14) 9_554
S10 Ag4 2.3982(14) 12_556
S10 Ag2 2.719(3) 3
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_4
S10 Ag1 Ag3 S2 -96.47(9) . 9_554
S1 Ag1 Ag3 S2 54.86(8) . 9_554
S2 Ag1 Ag3 S2 176.44(7) . 9_554
Ag4 Ag1 Ag3 S2 73.38(8) . 9_554
Ag4 Ag1 Ag3 S2 2.64(7) 4 9_554
Ag4 Ag1 Ag3 S2 -92.41(7) 9_554 9_554
Ag4 Ag1 Ag3 S2 -159.52(7) 12_556 9_554
Ag3 Ag1 Ag3 S2 136.65(7) 4 9_554
S10 Ag1 Ag3 S2 87.09(9) . .
S1 Ag1 Ag3 S2 -121.58(8) . .
Ag4 Ag1 Ag3 S2 -103.07(7) . .
Ag4 Ag1 Ag3 S2 -173.80(7) 4 .
Ag4 Ag1 Ag3 S2 91.15(6) 9_554 .
Ag4 Ag1 Ag3 S2 24.04(7) 12_556 .
Ag3 Ag1 Ag3 S2 -39.79(6) 4 .
S10 Ag1 Ag3 Ag2 128.62(6) . 2_565
S1 Ag1 Ag3 Ag2 -80.05(4) . 2_565
S2 Ag1 Ag3 Ag2 41.53(6) . 2_565
Ag4 Ag1 Ag3 Ag2 -61.53(4) . 2_565
Ag4 Ag1 Ag3 Ag2 -132.27(3) 4 2_565
Ag4 Ag1 Ag3 Ag2 132.68(2) 9_554 2_565
Ag4 Ag1 Ag3 Ag2 65.57(3) 12_556 2_565
Ag3 Ag1 Ag3 Ag2 1.744(19) 4 2_565
S10 Ag1 Ag3 Ag2 -72(2) . 8_565
S1 Ag1 Ag3 Ag2 79(2) . 8_565
S2 Ag1 Ag3 Ag2 -159(2) . 8_565
Ag4 Ag1 Ag3 Ag2 97(2) . 8_565
Ag4 Ag1 Ag3 Ag2 27(2) 4 8_565
Ag4 Ag1 Ag3 Ag2 -68(2) 9_554 8_565
Ag4 Ag1 Ag3 Ag2 -135(2) 12_556 8_565
Ag3 Ag1 Ag3 Ag2 161(2) 4 8_565
S10 Ag1 Ag3 Ag1 -51.15(5) . 9_554
S1 Ag1 Ag3 Ag1 100.18(5) . 9_554
S2 Ag1 Ag3 Ag1 -138.24(6) . 9_554
Ag4 Ag1 Ag3 Ag1 118.70(5) . 9_554
Ag4 Ag1 Ag3 Ag1 47.963(19) 4 9_554
Ag4 Ag1 Ag3 Ag1 -47.088(19) 9_554 9_554
Ag4 Ag1 Ag3 Ag1 -114.20(4) 12_556 9_554
Ag3 Ag1 Ag3 Ag1 -178.03(3) 4 9_554
S10 Ag1 Ag3 Ag4 -4.06(6) . 9_554
S1 Ag1 Ag3 Ag4 147.27(5) . 9_554
S2 Ag1 Ag3 Ag4 -91.15(6) . 9_554
Ag4 Ag1 Ag3 Ag4 165.78(5) . 9_554
Ag4 Ag1 Ag3 Ag4 95.05(3) 4 9_554
Ag4 Ag1 Ag3 Ag4 -67.11(3) 12_556 9_554
Ag3 Ag1 Ag3 Ag4 -130.94(3) 4 9_554
S10 Ag1 Ag3 Ag4 -99.11(6) . 4
S1 Ag1 Ag3 Ag4 52.22(4) . 4
S2 Ag1 Ag3 Ag4 173.80(7) . 4
Ag4 Ag1 Ag3 Ag4 70.73(4) . 4
Ag4 Ag1 Ag3 Ag4 -95.05(3) 9_554 4
Ag4 Ag1 Ag3 Ag4 -162.16(4) 12_556 4
Ag3 Ag1 Ag3 Ag4 134.01(2) 4 4
S10 Ag1 Ag4 S10 -33.25(7) . 9
S1 Ag1 Ag4 S10 179.16(9) . 9
S2 Ag1 Ag4 S10 94.25(10) . 9
Ag4 Ag1 Ag4 S10 -138.64(6) 4 9
Ag4 Ag1 Ag4 S10 -57.01(9) 9_554 9
Ag4 Ag1 Ag4 S10 15.61(8) 12_556 9
Ag3 Ag1 Ag4 S10 88.67(7) 4 9
Ag3 Ag1 Ag4 S10 155.47(6) . 9
S10 Ag1 Ag4 S1 147.59(8) . .
S2 Ag1 Ag4 S1 -84.91(9) . .
Ag4 Ag1 Ag4 S1 42.21(7) 4 .
Ag4 Ag1 Ag4 S1 123.83(8) 9_554 .
Ag4 Ag1 Ag4 S1 -163.55(7) 12_556 .
Ag3 Ag1 Ag4 S1 -90.48(7) 4 .
Ag3 Ag1 Ag4 S1 -23.69(7) . .
S10 Ag1 Ag4 Ag2 104.39(5) . .
S1 Ag1 Ag4 Ag2 -43.21(7) . .
S2 Ag1 Ag4 Ag2 -128.11(6) . .
Ag4 Ag1 Ag4 Ag2 -1.00(4) 4 .
Ag4 Ag1 Ag4 Ag2 80.62(5) 9_554 .
Ag4 Ag1 Ag4 Ag2 153.25(3) 12_556 .
Ag3 Ag1 Ag4 Ag2 -133.69(3) 4 .
Ag3 Ag1 Ag4 Ag2 -66.89(5) . .
S10 Ag1 Ag4 Ag1 -74.01(5) . 9
S1 Ag1 Ag4 Ag1 138.40(7) . 9
S2 Ag1 Ag4 Ag1 53.49(6) . 9
Ag4 Ag1 Ag4 Ag1 -179.391(9) 4 9
Ag4 Ag1 Ag4 Ag1 -97.77(7) 9_554 9
Ag4 Ag1 Ag4 Ag1 -25.15(5) 12_556 9
Ag3 Ag1 Ag4 Ag1 47.92(3) 4 9
Ag3 Ag1 Ag4 Ag1 114.71(2) . 9
S10 Ag1 Ag4 Ag2 57.6(7) . 7
S1 Ag1 Ag4 Ag2 -90.0(7) . 7
S2 Ag1 Ag4 Ag2 -174.9(7) . 7
Ag4 Ag1 Ag4 Ag2 -47.8(7) 4 7
Ag4 Ag1 Ag4 Ag2 33.8(7) 9_554 7
Ag4 Ag1 Ag4 Ag2 106.4(7) 12_556 7
Ag3 Ag1 Ag4 Ag2 179(99) 4 7
Ag3 Ag1 Ag4 Ag2 -113.7(7) . 7
S10 Ag1 Ag4 Ag4 52.73(5) . 10_556
S1 Ag1 Ag4 Ag4 -94.87(7) . 10_556
S2 Ag1 Ag4 Ag4 -179.77(5) . 10_556
Ag4 Ag1 Ag4 Ag4 -52.66(3) 4 10_556
Ag4 Ag1 Ag4 Ag4 28.96(6) 9_554 10_556
Ag4 Ag1 Ag4 Ag4 101.59(2) 12_556 10_556
Ag3 Ag1 Ag4 Ag4 174.650(19) 4 10_556
Ag3 Ag1 Ag4 Ag4 -118.55(4) . 10_556
S10 Ag1 Ag4 Ag3 -121.92(5) . 4
S1 Ag1 Ag4 Ag3 90.48(7) . 4
S2 Ag1 Ag4 Ag3 5.58(5) . 4
Ag4 Ag1 Ag4 Ag3 132.69(3) 4 4
Ag4 Ag1 Ag4 Ag3 -145.69(6) 9_554 4
Ag4 Ag1 Ag4 Ag3 -73.06(3) 12_556 4
Ag3 Ag1 Ag4 Ag3 66.80(4) . 4
S2 Ag2 Ag4 S10 -67.13(13) 3_665 9
S1 Ag2 Ag4 S10 177.18(10) . 9
S10 Ag2 Ag4 S10 59.45(6) 2 9
Ag3 Ag2 Ag4 S10 -78.21(7) 6_665 9
Ag3 Ag2 Ag4 S10 -150.84(7) 3_665 9
Ag4 Ag2 Ag4 S10 135.65(6) 4 9
Ag4 Ag2 Ag4 S10 73.79(7) 7_554 9
Ag4 Ag2 Ag4 S10 8.05(7) 10_556 9
S2 Ag2 Ag4 S1 115.70(11) 3_665 .
S10 Ag2 Ag4 S1 -117.73(7) 2 .
Ag3 Ag2 Ag4 S1 104.61(6) 6_665 .
Ag3 Ag2 Ag4 S1 31.99(7) 3_665 .
Ag4 Ag2 Ag4 S1 -41.53(6) 4 .
Ag4 Ag2 Ag4 S1 -103.39(6) 7_554 .
Ag4 Ag2 Ag4 S1 -169.13(6) 10_556 .
S2 Ag2 Ag4 Ag1 158.21(9) 3_665 .
S1 Ag2 Ag4 Ag1 42.51(6) . .
S10 Ag2 Ag4 Ag1 -75.21(5) 2 .
Ag3 Ag2 Ag4 Ag1 147.13(3) 6_665 .
Ag3 Ag2 Ag4 Ag1 74.50(6) 3_665 .
Ag4 Ag2 Ag4 Ag1 0.99(4) 4 .
Ag4 Ag2 Ag4 Ag1 -60.87(3) 7_554 .
Ag4 Ag2 Ag4 Ag1 -126.61(3) 10_556 .
S2 Ag2 Ag4 Ag1 -145.2(10) 3_665 9
S1 Ag2 Ag4 Ag1 99.1(10) . 9
S10 Ag2 Ag4 Ag1 -18.6(10) 2 9
Ag3 Ag2 Ag4 Ag1 -156.3(10) 6_665 9
Ag3 Ag2 Ag4 Ag1 131.1(10) 3_665 9
Ag4 Ag2 Ag4 Ag1 57.6(10) 4 9
Ag4 Ag2 Ag4 Ag1 -4.3(10) 7_554 9
Ag4 Ag2 Ag4 Ag1 -70.0(10) 10_556 9
S2 Ag2 Ag4 Ag2 -23.77(9) 3_665 7
S1 Ag2 Ag4 Ag2 -139.46(6) . 7
S10 Ag2 Ag4 Ag2 102.81(5) 2 7
Ag3 Ag2 Ag4 Ag2 -34.85(2) 6_665 7
Ag3 Ag2 Ag4 Ag2 -107.48(4) 3_665 7
Ag4 Ag2 Ag4 Ag2 179.01(2) 4 7
Ag4 Ag2 Ag4 Ag2 117.15(4) 7_554 7
Ag4 Ag2 Ag4 Ag2 51.41(3) 10_556 7
S2 Ag2 Ag4 Ag4 -75.18(9) 3_665 10_556
S1 Ag2 Ag4 Ag4 169.13(6) . 10_556
S10 Ag2 Ag4 Ag4 51.40(4) 2 10_556
Ag3 Ag2 Ag4 Ag4 -86.26(2) 6_665 10_556
Ag3 Ag2 Ag4 Ag4 -158.88(6) 3_665 10_556
Ag4 Ag2 Ag4 Ag4 127.60(3) 4 10_556
Ag4 Ag2 Ag4 Ag4 65.74(3) 7_554 10_556
S2 Ag2 Ag4 Ag3 111.30(9) 3_665 4
S1 Ag2 Ag4 Ag3 -4.40(6) . 4
S10 Ag2 Ag4 Ag3 -122.12(5) 2 4
Ag3 Ag2 Ag4 Ag3 100.21(3) 6_665 4
Ag3 Ag2 Ag4 Ag3 27.59(7) 3_665 4
Ag4 Ag2 Ag4 Ag3 -45.92(5) 4 4
Ag4 Ag2 Ag4 Ag3 -107.78(4) 7_554 4
Ag4 Ag2 Ag4 Ag3 -173.53(2) 10_556 4
S10 Ag4 S1 Ag4 -75.1(13) 9 4
Ag1 Ag4 S1 Ag4 -62.86(9) . 4
Ag2 Ag4 S1 Ag4 62.52(9) . 4
Ag1 Ag4 S1 Ag4 -115.21(9) 9 4
Ag2 Ag4 S1 Ag4 113.88(9) 7 4
Ag4 Ag4 S1 Ag4 52.93(11) 10_556 4
Ag3 Ag4 S1 Ag4 -121.18(11) 4 4
S10 Ag4 S1 Ag1 -12.3(12) 9 .
Ag2 Ag4 S1 Ag1 125.38(6) . .
Ag1 Ag4 S1 Ag1 -52.35(6) 9 .
Ag2 Ag4 S1 Ag1 176.74(5) 7 .
Ag4 Ag4 S1 Ag1 115.79(5) 10_556 .
Ag3 Ag4 S1 Ag1 -58.33(4) 4 .
S10 Ag4 S1 Ag2 -137.6(12) 9 .
Ag1 Ag4 S1 Ag2 -125.38(6) . .
Ag1 Ag4 S1 Ag2 -177.73(4) 9 .
Ag2 Ag4 S1 Ag2 51.36(6) 7 .
Ag4 Ag4 S1 Ag2 -9.59(5) 10_556 .
Ag3 Ag4 S1 Ag2 176.30(5) 4 .
S10 Ag1 S1 Ag4 60.43(4) . 4
S2 Ag1 S1 Ag4 -119.57(4) . 4
Ag4 Ag1 S1 Ag4 120.86(9) . 4
Ag4 Ag1 S1 Ag4 -25.48(12) 9_554 4
Ag4 Ag1 S1 Ag4 146.34(8) 12_556 4
Ag3 Ag1 S1 Ag4 -161.58(5) 4 4
Ag3 Ag1 S1 Ag4 -77.55(4) . 4
S10 Ag1 S1 Ag4 -60.43(4) . .
S2 Ag1 S1 Ag4 119.57(4) . .
Ag4 Ag1 S1 Ag4 -120.86(9) 4 .
Ag4 Ag1 S1 Ag4 -146.34(8) 9_554 .
Ag4 Ag1 S1 Ag4 25.48(12) 12_556 .
Ag3 Ag1 S1 Ag4 77.55(4) 4 .
Ag3 Ag1 S1 Ag4 161.58(5) . .
S10 Ag1 S1 Ag2 0.0 . .
S2 Ag1 S1 Ag2 180.0 . .
Ag4 Ag1 S1 Ag2 60.43(4) . .
Ag4 Ag1 S1 Ag2 -60.43(4) 4 .
Ag4 Ag1 S1 Ag2 -85.91(9) 9_554 .
Ag4 Ag1 S1 Ag2 85.91(9) 12_556 .
Ag3 Ag1 S1 Ag2 137.985(18) 4 .
Ag3 Ag1 S1 Ag2 -137.985(18) . .
S2 Ag2 S1 Ag4 119.47(4) 3_665 4
S10 Ag2 S1 Ag4 -60.53(4) 2 4
Ag3 Ag2 S1 Ag4 161.94(4) 6_665 4
Ag3 Ag2 S1 Ag4 77.00(5) 3_665 4
Ag4 Ag2 S1 Ag4 -121.06(8) . 4
Ag4 Ag2 S1 Ag4 -11.75(6) 7_554 4
Ag4 Ag2 S1 Ag4 -109.31(5) 10_556 4
S2 Ag2 S1 Ag4 -119.47(4) 3_665 .
S10 Ag2 S1 Ag4 60.53(4) 2 .
Ag3 Ag2 S1 Ag4 -77.00(5) 6_665 .
Ag3 Ag2 S1 Ag4 -161.94(4) 3_665 .
Ag4 Ag2 S1 Ag4 121.06(8) 4 .
Ag4 Ag2 S1 Ag4 109.31(5) 7_554 .
Ag4 Ag2 S1 Ag4 11.75(6) 10_556 .
S2 Ag2 S1 Ag1 180.0 3_665 .
S10 Ag2 S1 Ag1 0.0 2 .
Ag3 Ag2 S1 Ag1 -137.53(2) 6_665 .
Ag3 Ag2 S1 Ag1 137.53(2) 3_665 .
Ag4 Ag2 S1 Ag1 60.53(4) 4 .
Ag4 Ag2 S1 Ag1 -60.53(4) . .
Ag4 Ag2 S1 Ag1 48.78(4) 7_554 .
Ag4 Ag2 S1 Ag1 -48.78(4) 10_556 .
S2 Ag3 S2 Ag3 -94.87(10) 9_554 4
Ag2 Ag3 S2 Ag3 -66.47(9) 2_565 4
Ag2 Ag3 S2 Ag3 -121.29(8) 8_565 4
Ag1 Ag3 S2 Ag3 113.21(8) 9_554 4
Ag1 Ag3 S2 Ag3 58.97(9) . 4
Ag4 Ag3 S2 Ag3 115.38(10) 9_554 4
Ag4 Ag3 S2 Ag3 53.70(12) 4 4
S2 Ag3 S2 Ag2 -28.40(4) 9_554 2_565
Ag2 Ag3 S2 Ag2 -54.81(7) 8_565 2_565
Ag1 Ag3 S2 Ag2 179.68(3) 9_554 2_565
Ag1 Ag3 S2 Ag2 125.44(6) . 2_565
Ag4 Ag3 S2 Ag2 -178.15(5) 9_554 2_565
Ag4 Ag3 S2 Ag2 120.17(4) 4 2_565
S2 Ag3 S2 Ag1 -153.84(3) 9_554 .
Ag2 Ag3 S2 Ag1 -125.44(6) 2_565 .
Ag2 Ag3 S2 Ag1 179.75(3) 8_565 .
Ag1 Ag3 S2 Ag1 54.24(7) 9_554 .
Ag4 Ag3 S2 Ag1 56.41(3) 9_554 .
Ag4 Ag3 S2 Ag1 -5.27(6) 4 .
S10 Ag1 S2 Ag3 118.71(4) . 4
S1 Ag1 S2 Ag3 -61.29(4) . 4
Ag4 Ag1 S2 Ag3 -7.14(7) . 4
Ag4 Ag1 S2 Ag3 -115.43(4) 4 4
Ag4 Ag1 S2 Ag3 160.49(5) 9_554 4
Ag4 Ag1 S2 Ag3 76.94(4) 12_556 4
Ag3 Ag1 S2 Ag3 -122.58(9) . 4
S10 Ag1 S2 Ag3 -118.71(4) . .
S1 Ag1 S2 Ag3 61.29(4) . .
Ag4 Ag1 S2 Ag3 115.43(4) . .
Ag4 Ag1 S2 Ag3 7.14(7) 4 .
Ag4 Ag1 S2 Ag3 -76.94(4) 9_554 .
Ag4 Ag1 S2 Ag3 -160.49(5) 12_556 .
Ag3 Ag1 S2 Ag3 122.58(9) 4 .
S10 Ag1 S2 Ag2 180.0 . 2_565
S1 Ag1 S2 Ag2 0.0 . 2_565
Ag4 Ag1 S2 Ag2 54.14(4) . 2_565
Ag4 Ag1 S2 Ag2 -54.14(4) 4 2_565
Ag4 Ag1 S2 Ag2 -138.227(17) 9_554 2_565
Ag4 Ag1 S2 Ag2 138.227(17) 12_556 2_565
Ag3 Ag1 S2 Ag2 61.29(4) 4 2_565
Ag3 Ag1 S2 Ag2 -61.29(4) . 2_565
S1 Ag1 S10 Ag4 -121.86(4) . 9_554
S2 Ag1 S10 Ag4 58.14(4) . 9_554
Ag4 Ag1 S10 Ag4 -166.77(4) . 9_554
Ag4 Ag1 S10 Ag4 -76.95(5) 4 9_554
Ag4 Ag1 S10 Ag4 116.29(8) 12_556 9_554
Ag3 Ag1 S10 Ag4 111.24(4) 4 9_554
Ag3 Ag1 S10 Ag4 5.04(7) . 9_554
S1 Ag1 S10 Ag4 121.86(4) . 12_556
S2 Ag1 S10 Ag4 -58.14(4) . 12_556
Ag4 Ag1 S10 Ag4 76.95(5) . 12_556
Ag4 Ag1 S10 Ag4 166.77(4) 4 12_556
Ag4 Ag1 S10 Ag4 -116.29(8) 9_554 12_556
Ag3 Ag1 S10 Ag4 -5.04(7) 4 12_556
Ag3 Ag1 S10 Ag4 -111.24(4) . 12_556
S1 Ag1 S10 Ag2 180.0 . 3
S2 Ag1 S10 Ag2 0.0 . 3
Ag4 Ag1 S10 Ag2 135.09(3) . 3
Ag4 Ag1 S10 Ag2 -135.09(3) 4 3
Ag4 Ag1 S10 Ag2 -58.14(4) 9_554 3
Ag4 Ag1 S10 Ag2 58.14(4) 12_556 3
Ag3 Ag1 S10 Ag2 53.10(4) 4 3
Ag3 Ag1 S10 Ag2 -53.10(4) . 3
