#------------------------------------------------------------------------------
#$Date: 2016-03-24 17:31:00 +0200 (Thu, 24 Mar 2016) $
#$Revision: 179688 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/10/7001059.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_7001059
loop_
_publ_author_name
'Hoshino, Manabu'
'Uekusa, Hidehiro'
'Sonoda, Shintaro'
'Otsuka, Takuhiro'
'Kaizu, Youkoh'
_publ_section_title
;
 Photocrystallographic analysis of [AuCl(PPh3)2] for elucidation of the
 crystal packing effect on the photophysical properties
;
_journal_issue                   16
_journal_name_full               'Dalton Transactions'
_journal_page_first              3085
_journal_page_last               3091
_journal_paper_doi               10.1039/b820066a
_journal_year                    2009
_chemical_formula_sum            'C36 H30 Au Cl P2'
_chemical_formula_weight         756.96
_chemical_name_systematic
;
?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                113.6079(10)
_cell_angle_beta                 95.0211(8)
_cell_angle_gamma                109.4016(9)
_cell_formula_units_Z            2
_cell_length_a                   10.8864(2)
_cell_length_b                   11.84780(10)
_cell_length_c                   14.2488(2)
_cell_measurement_temperature    215(2)
_cell_volume                     1535.78(4)
_computing_cell_refinement       'HKL Research, Inc. HKL-2000'
_computing_data_collection       'Rigaku RAPID AUTO'
_computing_data_reduction        'HKL Research, Inc. HKL-2000'
_computing_molecular_graphics    'ORTEP-3 for Windows (Farrugia, 1998)'
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SIR2002 (Giacovazzo, 2003)'
_diffrn_ambient_temperature      215(2)
_diffrn_measured_fraction_theta_full 0.993
_diffrn_measured_fraction_theta_max 0.993
_diffrn_measurement_device_type  'Rigaku RAXIS-RAPID Imaging Plate'
_diffrn_measurement_method       'omega scan'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'Rigaku rotating anode Ultrax18'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.022
_diffrn_reflns_av_sigmaI/netI    0.0154
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            48846
_diffrn_reflns_theta_full        32.32
_diffrn_reflns_theta_max         32.32
_diffrn_reflns_theta_min         2.05
_exptl_absorpt_coefficient_mu    5.005
_exptl_absorpt_correction_T_max  1.000
_exptl_absorpt_correction_T_min  0.745
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   'HKL SCALEPACK (Otwinowski & Minor, 1997)'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.637
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             744
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.20
_refine_diff_density_max         1.218
_refine_diff_density_min         -0.739
_refine_diff_density_rms         0.065
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.114
_refine_ls_hydrogen_treatment    refxyz
_refine_ls_matrix_type           full
_refine_ls_number_parameters     451
_refine_ls_number_reflns         10875
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.114
_refine_ls_R_factor_all          0.0165
_refine_ls_R_factor_gt           0.0159
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0078P)²+1.0965P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0400
_refine_ls_wR_factor_ref         0.0403
_reflns_number_gt                10672
_reflns_number_total             10875
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b820066a.txt
_cod_data_source_block           215Koff
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7001059
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-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
_atom_site_disorder_assembly
_atom_site_disorder_group
Au1 Au 0.211987(5) 0.242821(6) 0.274868(4) 0.02644(2) Uani 1 1 d . . .
P1 P 0.30766(4) 0.09459(4) 0.27645(3) 0.02456(6) Uani 1 1 d . . .
C111 C 0.25677(15) 0.00272(15) 0.35189(12) 0.0257(2) Uani 1 1 d . . .
C112 C 0.34211(17) -0.04287(18) 0.39077(14) 0.0331(3) Uani 1 1 d . . .
H112 H 0.433(2) -0.022(2) 0.3793(18) 0.040 Uiso 1 1 d . . .
C113 C 0.30047(19) -0.1140(2) 0.44776(16) 0.0374(3) Uani 1 1 d . . .
H113 H 0.357(2) -0.145(2) 0.473(2) 0.045 Uiso 1 1 d . . .
C114 C 0.1744(2) -0.13840(18) 0.46714(15) 0.0371(3) Uani 1 1 d . . .
H114 H 0.148(2) -0.184(2) 0.5074(19) 0.045 Uiso 1 1 d . . .
C115 C 0.08960(18) -0.09264(18) 0.42976(15) 0.0354(3) Uani 1 1 d . . .
H115 H 0.001(2) -0.109(2) 0.4439(19) 0.042 Uiso 1 1 d . . .
C116 C 0.13029(16) -0.02218(16) 0.37223(14) 0.0301(3) Uani 1 1 d . . .
H116 H 0.074(2) 0.013(2) 0.3547(18) 0.036 Uiso 1 1 d . . .
C121 C 0.29216(16) -0.03052(16) 0.14433(12) 0.0304(3) Uani 1 1 d . . .
C122 C 0.2843(3) -0.1580(2) 0.12154(17) 0.0543(6) Uani 1 1 d . . .
H122 H 0.279(3) -0.187(3) 0.175(2) 0.065 Uiso 1 1 d . . .
C123 C 0.2791(4) -0.2463(2) 0.0192(2) 0.0698(8) Uani 1 1 d . . .
H123 H 0.266(3) -0.335(4) 0.004(3) 0.084 Uiso 1 1 d . . .
C124 C 0.2798(3) -0.2092(3) -0.05987(18) 0.0604(6) Uani 1 1 d . . .
H124 H 0.274(3) -0.268(3) -0.127(3) 0.072 Uiso 1 1 d . . .
C125 C 0.2875(4) -0.0837(3) -0.03804(19) 0.0695(8) Uani 1 1 d . . .
H125 H 0.294(3) -0.052(3) -0.087(3) 0.083 Uiso 1 1 d . . .
C126 C 0.2923(3) 0.0054(3) 0.06300(17) 0.0531(6) Uani 1 1 d . . .
H126 H 0.301(3) 0.090(3) 0.077(2) 0.064 Uiso 1 1 d . . .
C131 C 0.48790(15) 0.18938(15) 0.33317(12) 0.0263(3) Uani 1 1 d . . .
C132 C 0.58343(17) 0.1498(2) 0.28650(14) 0.0360(3) Uani 1 1 d . . .
H132 H 0.554(2) 0.065(2) 0.224(2) 0.043 Uiso 1 1 d . . .
C133 C 0.72013(18) 0.2289(2) 0.33311(16) 0.0430(4) Uani 1 1 d . . .
H133 H 0.787(3) 0.205(3) 0.305(2) 0.052 Uiso 1 1 d . . .
C134 C 0.76147(18) 0.3475(2) 0.42550(16) 0.0418(4) Uani 1 1 d . . .
H134 H 0.856(3) 0.399(3) 0.457(2) 0.050 Uiso 1 1 d . . .
C135 C 0.6674(2) 0.3874(2) 0.47296(15) 0.0408(4) Uani 1 1 d . . .
H135 H 0.692(3) 0.469(3) 0.533(2) 0.049 Uiso 1 1 d . . .
C136 C 0.53102(18) 0.30833(18) 0.42707(14) 0.0350(3) Uani 1 1 d . . .
H136 H 0.467(2) 0.336(2) 0.4574(19) 0.042 Uiso 1 1 d . . .
P2 P 0.23252(4) 0.38629(4) 0.19931(3) 0.02664(7) Uani 1 1 d . . .
C211 C 0.39887(15) 0.52349(16) 0.25882(12) 0.0290(3) Uani 1 1 d . . .
C212 C 0.50621(19) 0.4980(2) 0.2922(2) 0.0448(4) Uani 1 1 d . . .
H212 H 0.494(3) 0.415(3) 0.281(2) 0.054 Uiso 1 1 d . . .
C213 C 0.6334(2) 0.6013(3) 0.3437(2) 0.0537(6) Uani 1 1 d . . .
H213 H 0.704(3) 0.581(3) 0.364(2) 0.064 Uiso 1 1 d . . .
C214 C 0.6555(2) 0.7295(2) 0.36107(17) 0.0478(5) Uani 1 1 d . . .
H214 H 0.740(3) 0.796(3) 0.397(2) 0.057 Uiso 1 1 d . . .
C215 C 0.5513(2) 0.7562(2) 0.32781(19) 0.0488(5) Uani 1 1 d . . .
H215 H 0.564(3) 0.847(3) 0.341(2) 0.059 Uiso 1 1 d . . .
C216 C 0.42305(19) 0.65453(19) 0.27771(17) 0.0401(4) Uani 1 1 d . . .
H216 H 0.349(3) 0.677(3) 0.259(2) 0.048 Uiso 1 1 d . . .
C221 C 0.11413(15) 0.46524(16) 0.20606(12) 0.0285(3) Uani 1 1 d . . .
C222 C 0.0969(2) 0.5212(2) 0.13907(15) 0.0388(4) Uani 1 1 d . . .
H222 H 0.148(2) 0.514(2) 0.087(2) 0.047 Uiso 1 1 d . . .
C223 C 0.0091(2) 0.5851(2) 0.14935(17) 0.0434(4) Uani 1 1 d . . .
H223 H -0.003(3) 0.619(3) 0.103(2) 0.052 Uiso 1 1 d . . .
C224 C -0.0620(2) 0.5930(2) 0.22571(17) 0.0425(4) Uani 1 1 d . . .
H224 H -0.123(3) 0.637(3) 0.230(2) 0.051 Uiso 1 1 d . . .
C225 C -0.0455(2) 0.5382(2) 0.29244(17) 0.0427(4) Uani 1 1 d . . .
H225 H -0.095(3) 0.541(3) 0.347(2) 0.051 Uiso 1 1 d . . .
C226 C 0.04202(18) 0.47360(18) 0.28257(14) 0.0341(3) Uani 1 1 d . . .
H226 H 0.051(2) 0.434(2) 0.3258(19) 0.041 Uiso 1 1 d . . .
C231 C 0.22257(17) 0.30209(18) 0.05855(13) 0.0326(3) Uani 1 1 d . . .
C232 C 0.3248(3) 0.3432(3) 0.01405(19) 0.0677(8) Uani 1 1 d . . .
H232 H 0.400(3) 0.411(3) 0.050(3) 0.081 Uiso 1 1 d . . .
C233 C 0.3128(3) 0.2698(4) -0.0935(2) 0.0909(13) Uani 1 1 d . . .
H233 H 0.382(4) 0.295(4) -0.121(3) 0.109 Uiso 1 1 d . . .
C234 C 0.2007(3) 0.1558(3) -0.15579(19) 0.0675(8) Uani 1 1 d . . .
H234 H 0.192(3) 0.105(3) -0.228(3) 0.081 Uiso 1 1 d . . .
C235 C 0.0980(3) 0.1147(3) -0.11230(18) 0.0608(6) Uani 1 1 d . . .
H235 H 0.018(3) 0.034(3) -0.156(3) 0.073 Uiso 1 1 d . . .
C236 C 0.1081(2) 0.1878(2) -0.00586(17) 0.0494(5) Uani 1 1 d . . .
H236 H 0.042(3) 0.155(3) 0.025(2) 0.059 Uiso 1 1 d . . .
Cl1 Cl 0.06759(5) 0.26473(5) 0.40672(4) 0.04210(10) Uani 1 1 d . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 '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'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Au Au -2.0133 8.8022 '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
_geom_angle_publ_flag
P2 Au1 P1 136.569(13) . . ?
P2 Au1 Cl1 114.249(14) . . ?
P1 Au1 Cl1 108.805(14) . . ?
P2 Au1 Au1 79.238(10) . 2 ?
P1 Au1 Au1 91.039(10) . 2 ?
Cl1 Au1 Au1 110.792(13) . 2 ?
C111 P1 C131 104.09(7) . . ?
C111 P1 C121 105.98(7) . . ?
C131 P1 C121 104.49(7) . . ?
C111 P1 Au1 119.56(5) . . ?
C131 P1 Au1 108.30(5) . . ?
C121 P1 Au1 113.09(6) . . ?
C116 C111 C112 119.11(14) . . ?
C116 C111 P1 119.45(12) . . ?
C112 C111 P1 121.44(11) . . ?
C113 C112 C111 120.39(15) . . ?
C113 C112 H112 120.3(14) . . ?
C111 C112 H112 119.3(14) . . ?
C114 C113 C112 119.92(16) . . ?
C114 C113 H113 119.5(15) . . ?
C112 C113 H113 120.6(15) . . ?
C115 C114 C113 120.11(16) . . ?
C115 C114 H114 120.5(15) . . ?
C113 C114 H114 119.4(15) . . ?
C114 C115 C116 120.26(15) . . ?
C114 C115 H115 120.3(15) . . ?
C116 C115 H115 119.5(15) . . ?
C115 C116 C111 120.20(15) . . ?
C115 C116 H116 117.1(14) . . ?
C111 C116 H116 122.5(14) . . ?
C122 C121 C126 118.30(17) . . ?
C122 C121 P1 123.47(14) . . ?
C126 C121 P1 118.20(14) . . ?
C121 C122 C123 120.2(2) . . ?
C121 C122 H122 120.2(18) . . ?
C123 C122 H122 119.6(18) . . ?
C124 C123 C122 120.8(2) . . ?
C124 C123 H123 120(2) . . ?
C122 C123 H123 119(2) . . ?
C125 C124 C123 119.4(2) . . ?
C125 C124 H124 120(2) . . ?
C123 C124 H124 120(2) . . ?
C124 C125 C126 120.7(2) . . ?
C124 C125 H125 123(2) . . ?
C126 C125 H125 117(2) . . ?
C121 C126 C125 120.6(2) . . ?
C121 C126 H126 119.3(19) . . ?
C125 C126 H126 120.0(19) . . ?
C136 C131 C132 119.16(15) . . ?
C136 C131 P1 117.60(12) . . ?
C132 C131 P1 123.23(12) . . ?
C133 C132 C131 120.20(17) . . ?
C133 C132 H132 120.3(14) . . ?
C131 C132 H132 119.4(14) . . ?
C134 C133 C132 120.04(18) . . ?
C134 C133 H133 117.5(16) . . ?
C132 C133 H133 122.5(16) . . ?
C133 C134 C135 120.26(17) . . ?
C133 C134 H134 118.7(16) . . ?
C135 C134 H134 121.0(16) . . ?
C134 C135 C136 119.88(18) . . ?
C134 C135 H135 122.1(16) . . ?
C136 C135 H135 117.9(16) . . ?
C135 C136 C131 120.46(17) . . ?
C135 C136 H136 120.3(15) . . ?
C131 C136 H136 119.2(15) . . ?
C221 P2 C211 105.78(7) . . ?
C221 P2 C231 104.28(8) . . ?
C211 P2 C231 105.57(7) . . ?
C221 P2 Au1 119.54(5) . . ?
C211 P2 Au1 109.27(5) . . ?
C231 P2 Au1 111.42(6) . . ?
C216 C211 C212 118.11(16) . . ?
C216 C211 P2 123.26(13) . . ?
C212 C211 P2 118.54(13) . . ?
C213 C212 C211 120.6(2) . . ?
C213 C212 H212 118.8(17) . . ?
C211 C212 H212 120.6(17) . . ?
C214 C213 C212 120.5(2) . . ?
C214 C213 H213 120.7(19) . . ?
C212 C213 H213 118.8(19) . . ?
C213 C214 C215 119.75(19) . . ?
C213 C214 H214 118.4(18) . . ?
C215 C214 H214 121.9(18) . . ?
C214 C215 C216 120.5(2) . . ?
C214 C215 H215 121.6(17) . . ?
C216 C215 H215 117.9(17) . . ?
C215 C216 C211 120.54(19) . . ?
C215 C216 H216 119.1(15) . . ?
C211 C216 H216 120.3(15) . . ?
C226 C221 C222 119.28(16) . . ?
C226 C221 P2 118.75(12) . . ?
C222 C221 P2 121.94(13) . . ?
C223 C222 C221 120.20(18) . . ?
C223 C222 H222 122.2(15) . . ?
C221 C222 H222 117.6(15) . . ?
C224 C223 C222 120.06(17) . . ?
C224 C223 H223 120.6(17) . . ?
C222 C223 H223 119.4(17) . . ?
C225 C224 C223 120.19(18) . . ?
C225 C224 H224 121.8(16) . . ?
C223 C224 H224 118.0(16) . . ?
C224 C225 C226 120.17(19) . . ?
C224 C225 H225 122.0(16) . . ?
C226 C225 H225 117.8(16) . . ?
C221 C226 C225 120.08(16) . . ?
C221 C226 H226 119.5(15) . . ?
C225 C226 H226 120.4(15) . . ?
C232 C231 C236 118.51(18) . . ?
C232 C231 P2 123.43(15) . . ?
C236 C231 P2 118.01(14) . . ?
C231 C232 C233 120.3(2) . . ?
C231 C232 H232 123(2) . . ?
C233 C232 H232 116(2) . . ?
C234 C233 C232 120.7(3) . . ?
C234 C233 H233 119(3) . . ?
C232 C233 H233 120(3) . . ?
C233 C234 C235 119.4(2) . . ?
C233 C234 H234 122(2) . . ?
C235 C234 H234 119(2) . . ?
C234 C235 C236 120.4(2) . . ?
C234 C235 H235 119.9(19) . . ?
C236 C235 H235 119.7(19) . . ?
C231 C236 C235 120.7(2) . . ?
C231 C236 H236 118.9(18) . . ?
C235 C236 H236 120.0(18) . . ?
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
Au1 P2 2.3138(4) . ?
Au1 P1 2.3265(4) . ?
Au1 Cl1 2.5428(4) . ?
Au1 Au1 7.46294(18) 2 ?
P1 C111 1.8133(15) . ?
P1 C131 1.8154(15) . ?
P1 C121 1.8201(16) . ?
C111 C116 1.391(2) . ?
C111 C112 1.395(2) . ?
C112 C113 1.390(2) . ?
C112 H112 0.98(2) . ?
C113 C114 1.382(3) . ?
C113 H113 0.93(3) . ?
C114 C115 1.381(3) . ?
C114 H114 0.94(3) . ?
C115 C116 1.390(2) . ?
C115 H115 0.97(2) . ?
C116 H116 0.92(2) . ?
C121 C122 1.382(3) . ?
C121 C126 1.385(3) . ?
C122 C123 1.396(3) . ?
C122 H122 0.96(3) . ?
C123 C124 1.363(4) . ?
C123 H123 0.95(4) . ?
C124 C125 1.363(4) . ?
C124 H124 0.91(3) . ?
C125 C126 1.387(3) . ?
C125 H125 0.91(4) . ?
C126 H126 0.91(3) . ?
C131 C136 1.392(2) . ?
C131 C132 1.393(2) . ?
C132 C133 1.391(3) . ?
C132 H132 0.96(2) . ?
C133 C134 1.380(3) . ?
C133 H133 0.93(3) . ?
C134 C135 1.384(3) . ?
C134 H134 0.95(3) . ?
C135 C136 1.388(3) . ?
C135 H135 0.93(3) . ?
C136 H136 0.93(2) . ?
P2 C221 1.8155(16) . ?
P2 C211 1.8200(16) . ?
P2 C231 1.8214(17) . ?
C211 C216 1.390(2) . ?
C211 C212 1.391(2) . ?
C212 C213 1.389(3) . ?
C212 H212 0.90(3) . ?
C213 C214 1.367(4) . ?
C213 H213 0.93(3) . ?
C214 C215 1.370(3) . ?
C214 H214 0.92(3) . ?
C215 C216 1.389(3) . ?
C215 H215 0.97(3) . ?
C216 H216 0.97(3) . ?
C221 C226 1.389(2) . ?
C221 C222 1.395(2) . ?
C222 C223 1.387(3) . ?
C222 H222 0.96(3) . ?
C223 C224 1.381(3) . ?
C223 H223 0.92(3) . ?
C224 C225 1.378(3) . ?
C224 H224 0.97(3) . ?
C225 C226 1.391(2) . ?
C225 H225 0.98(3) . ?
C226 H226 0.93(2) . ?
C231 C232 1.374(3) . ?
C231 C236 1.383(3) . ?
C232 C233 1.394(3) . ?
C232 H232 0.86(3) . ?
C233 C234 1.362(4) . ?
C233 H233 0.90(4) . ?
C234 C235 1.369(4) . ?
C234 H234 0.94(3) . ?
C235 C236 1.385(3) . ?
C235 H235 0.97(3) . ?
C236 H236 0.94(3) . ?
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
C114 H114 Cl1 0.94(3) 2.80(2) 3.5739(17) 139.9(19) 2_556
C116 H116 Cl1 0.92(2) 2.80(2) 3.5391(17) 139.0(18) .
C226 H226 Cl1 0.93(2) 2.73(2) 3.6343(18) 166.0(19) .
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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
P2 Au1 P1 C111 179.40(6) . . . . ?
Cl1 Au1 P1 C111 7.19(6) . . . . ?
Au1 Au1 P1 C111 -105.22(6) 2 . . . ?
P2 Au1 P1 C131 60.57(6) . . . . ?
Cl1 Au1 P1 C131 -111.65(5) . . . . ?
Au1 Au1 P1 C131 135.94(5) 2 . . . ?
P2 Au1 P1 C121 -54.74(6) . . . . ?
Cl1 Au1 P1 C121 133.05(6) . . . . ?
Au1 Au1 P1 C121 20.64(6) 2 . . . ?
C131 P1 C111 C116 146.45(13) . . . . ?
C121 P1 C111 C116 -103.66(14) . . . . ?
Au1 P1 C111 C116 25.49(15) . . . . ?
C131 P1 C111 C112 -33.08(15) . . . . ?
C121 P1 C111 C112 76.81(15) . . . . ?
Au1 P1 C111 C112 -154.05(12) . . . . ?
C116 C111 C112 C113 0.9(3) . . . . ?
P1 C111 C112 C113 -179.53(14) . . . . ?
C111 C112 C113 C114 -0.7(3) . . . . ?
C112 C113 C114 C115 0.2(3) . . . . ?
C113 C114 C115 C116 0.2(3) . . . . ?
C114 C115 C116 C111 0.0(3) . . . . ?
C112 C111 C116 C115 -0.6(2) . . . . ?
P1 C111 C116 C115 179.89(13) . . . . ?
C111 P1 C121 C122 -17.7(2) . . . . ?
C131 P1 C121 C122 91.89(19) . . . . ?
Au1 P1 C121 C122 -150.55(18) . . . . ?
C111 P1 C121 C126 164.28(17) . . . . ?
C131 P1 C121 C126 -86.12(18) . . . . ?
Au1 P1 C121 C126 31.45(18) . . . . ?
C126 C121 C122 C123 1.1(4) . . . . ?
P1 C121 C122 C123 -176.9(2) . . . . ?
C121 C122 C123 C124 -0.9(5) . . . . ?
C122 C123 C124 C125 0.9(5) . . . . ?
C123 C124 C125 C126 -1.1(5) . . . . ?
C122 C121 C126 C125 -1.4(4) . . . . ?
P1 C121 C126 C125 176.7(2) . . . . ?
C124 C125 C126 C121 1.4(5) . . . . ?
C111 P1 C131 C136 -80.58(14) . . . . ?
C121 P1 C131 C136 168.44(13) . . . . ?
Au1 P1 C131 C136 47.64(14) . . . . ?
C111 P1 C131 C132 100.45(15) . . . . ?
C121 P1 C131 C132 -10.53(16) . . . . ?
Au1 P1 C131 C132 -131.33(13) . . . . ?
C136 C131 C132 C133 -0.4(3) . . . . ?
P1 C131 C132 C133 178.54(15) . . . . ?
C131 C132 C133 C134 -0.4(3) . . . . ?
C132 C133 C134 C135 0.8(3) . . . . ?
C133 C134 C135 C136 -0.5(3) . . . . ?
C134 C135 C136 C131 -0.4(3) . . . . ?
C132 C131 C136 C135 0.8(3) . . . . ?
P1 C131 C136 C135 -178.21(14) . . . . ?
P1 Au1 P2 C221 170.74(6) . . . . ?
Cl1 Au1 P2 C221 -17.35(6) . . . . ?
Au1 Au1 P2 C221 90.75(6) 2 . . . ?
P1 Au1 P2 C211 -67.31(6) . . . . ?
Cl1 Au1 P2 C211 104.60(6) . . . . ?
Au1 Au1 P2 C211 -147.30(6) 2 . . . ?
P1 Au1 P2 C231 48.95(6) . . . . ?
Cl1 Au1 P2 C231 -139.14(6) . . . . ?
Au1 Au1 P2 C231 -31.04(6) 2 . . . ?
C221 P2 C211 C216 -14.60(17) . . . . ?
C231 P2 C211 C216 95.57(16) . . . . ?
Au1 P2 C211 C216 -144.50(14) . . . . ?
C221 P2 C211 C212 161.95(15) . . . . ?
C231 P2 C211 C212 -87.89(16) . . . . ?
Au1 P2 C211 C212 32.04(16) . . . . ?
C216 C211 C212 C213 0.5(3) . . . . ?
P2 C211 C212 C213 -176.22(18) . . . . ?
C211 C212 C213 C214 -0.9(4) . . . . ?
C212 C213 C214 C215 0.2(4) . . . . ?
C213 C214 C215 C216 0.8(4) . . . . ?
C214 C215 C216 C211 -1.2(3) . . . . ?
C212 C211 C216 C215 0.5(3) . . . . ?
P2 C211 C216 C215 177.06(16) . . . . ?
C211 P2 C221 C226 -103.53(14) . . . . ?
C231 P2 C221 C226 145.39(14) . . . . ?
Au1 P2 C221 C226 20.13(16) . . . . ?
C211 P2 C221 C222 74.40(16) . . . . ?
C231 P2 C221 C222 -36.68(16) . . . . ?
Au1 P2 C221 C222 -161.94(13) . . . . ?
C226 C221 C222 C223 0.3(3) . . . . ?
P2 C221 C222 C223 -177.57(16) . . . . ?
C221 C222 C223 C224 -0.3(3) . . . . ?
C222 C223 C224 C225 0.4(3) . . . . ?
C223 C224 C225 C226 -0.6(3) . . . . ?
C222 C221 C226 C225 -0.5(3) . . . . ?
P2 C221 C226 C225 177.46(15) . . . . ?
C224 C225 C226 C221 0.7(3) . . . . ?
C221 P2 C231 C232 110.3(2) . . . . ?
C211 P2 C231 C232 -0.9(2) . . . . ?
Au1 P2 C231 C232 -119.4(2) . . . . ?
C221 P2 C231 C236 -72.28(18) . . . . ?
C211 P2 C231 C236 176.49(17) . . . . ?
Au1 P2 C231 C236 57.99(18) . . . . ?
C236 C231 C232 C233 -0.7(5) . . . . ?
P2 C231 C232 C233 176.7(3) . . . . ?
C231 C232 C233 C234 -0.7(7) . . . . ?
C232 C233 C234 C235 1.2(6) . . . . ?
C233 C234 C235 C236 -0.3(5) . . . . ?
C232 C231 C236 C235 1.5(4) . . . . ?
P2 C231 C236 C235 -176.0(2) . . . . ?
C234 C235 C236 C231 -1.1(4) . . . . ?
