#------------------------------------------------------------------------------
#$Date: 2016-03-24 17:31:00 +0200 (Thu, 24 Mar 2016) $
#$Revision: 179688 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/10/7001057.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_7001057
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                112.9509(10)
_cell_angle_beta                 95.6325(8)
_cell_angle_gamma                109.6808(9)
_cell_formula_units_Z            2
_cell_length_a                   10.8426(2)
_cell_length_b                   11.82480(10)
_cell_length_c                   14.1569(2)
_cell_measurement_temperature    118(2)
_cell_volume                     1517.64(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      118(2)
_diffrn_measured_fraction_theta_full 0.991
_diffrn_measured_fraction_theta_max 0.991
_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    0.0162
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -15
_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            43895
_diffrn_reflns_theta_full        32.33
_diffrn_reflns_theta_max         32.33
_diffrn_reflns_theta_min         2.05
_exptl_absorpt_coefficient_mu    5.065
_exptl_absorpt_correction_T_max  1.000
_exptl_absorpt_correction_T_min  0.729
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   'HKL SCALEPACK (Otwinowski & Minor, 1997)'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.656
_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         0.710
_refine_diff_density_min         -0.647
_refine_diff_density_rms         0.082
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.127
_refine_ls_hydrogen_treatment    refxyz
_refine_ls_matrix_type           full
_refine_ls_number_parameters     451
_refine_ls_number_reflns         10750
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.127
_refine_ls_R_factor_all          0.0137
_refine_ls_R_factor_gt           0.0136
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0124P)²+1.4455P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0399
_refine_ls_wR_factor_ref         0.0399
_reflns_number_gt                10701
_reflns_number_total             10750
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b820066a.txt
_cod_data_source_block           118Koff
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7001057
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 0.210809(5) 0.247144(5) 0.275801(4) 0.01330(2) Uani 1 1 d . . .
P1 P 0.30528(3) 0.09764(3) 0.27593(3) 0.01272(6) Uani 1 1 d . . .
C111 C 0.25413(13) 0.00370(13) 0.35094(11) 0.0134(2) Uani 1 1 d . . .
C112 C 0.34071(15) -0.04237(16) 0.38960(12) 0.0185(2) Uani 1 1 d . . .
H112 H 0.430(2) -0.023(2) 0.3758(19) 0.022 Uiso 1 1 d . . .
C113 C 0.29934(16) -0.11509(16) 0.44642(13) 0.0200(3) Uani 1 1 d . . .
H113 H 0.358(2) -0.146(2) 0.4735(19) 0.024 Uiso 1 1 d . . .
C114 C 0.17212(16) -0.14068(15) 0.46596(12) 0.0194(3) Uani 1 1 d . . .
H114 H 0.143(2) -0.192(2) 0.5036(19) 0.023 Uiso 1 1 d . . .
C115 C 0.08593(15) -0.09418(15) 0.42815(13) 0.0186(2) Uani 1 1 d . . .
H115 H -0.003(2) -0.113(2) 0.4420(19) 0.022 Uiso 1 1 d . . .
C116 C 0.12700(14) -0.02156(14) 0.37144(11) 0.0152(2) Uani 1 1 d . . .
H116 H 0.068(2) 0.008(2) 0.3510(18) 0.018 Uiso 1 1 d . . .
C121 C 0.28764(14) -0.02584(14) 0.14278(11) 0.0157(2) Uani 1 1 d . . .
C122 C 0.2756(2) -0.15547(16) 0.11950(14) 0.0275(3) Uani 1 1 d . . .
H122 H 0.272(3) -0.185(3) 0.173(2) 0.033 Uiso 1 1 d . . .
C123 C 0.2691(3) -0.24321(18) 0.01690(15) 0.0348(4) Uani 1 1 d . . .
H123 H 0.265(3) -0.332(3) 0.003(2) 0.042 Uiso 1 1 d . . .
C124 C 0.2743(2) -0.20280(19) -0.06233(14) 0.0313(4) Uani 1 1 d . . .
H124 H 0.268(3) -0.265(3) -0.131(2) 0.038 Uiso 1 1 d . . .
C125 C 0.2851(3) -0.0748(2) -0.03980(15) 0.0344(4) Uani 1 1 d . . .
H125 H 0.290(3) -0.045(3) -0.090(2) 0.041 Uiso 1 1 d . . .
C126 C 0.2915(2) 0.01387(19) 0.06230(13) 0.0270(3) Uani 1 1 d . . .
H126 H 0.303(3) 0.105(3) 0.077(2) 0.032 Uiso 1 1 d . . .
C131 C 0.48728(14) 0.19095(14) 0.33258(11) 0.0145(2) Uani 1 1 d . . .
C132 C 0.58203(15) 0.15013(16) 0.28540(12) 0.0191(3) Uani 1 1 d . . .
H132 H 0.551(2) 0.068(2) 0.2211(19) 0.023 Uiso 1 1 d . . .
C133 C 0.72047(16) 0.22809(18) 0.33255(13) 0.0223(3) Uani 1 1 d . . .
H133 H 0.785(2) 0.202(2) 0.300(2) 0.027 Uiso 1 1 d . . .
C134 C 0.76470(15) 0.34705(17) 0.42622(13) 0.0215(3) Uani 1 1 d . . .
H134 H 0.861(2) 0.400(2) 0.4597(19) 0.026 Uiso 1 1 d . . .
C135 C 0.67097(17) 0.38773(16) 0.47371(13) 0.0219(3) Uani 1 1 d . . .
H135 H 0.699(2) 0.473(2) 0.534(2) 0.026 Uiso 1 1 d . . .
C136 C 0.53273(15) 0.31002(15) 0.42738(12) 0.0186(2) Uani 1 1 d . . .
H136 H 0.469(2) 0.339(2) 0.4584(19) 0.022 Uiso 1 1 d . . .
P2 P 0.23010(4) 0.39257(4) 0.20096(3) 0.01374(6) Uani 1 1 d . . .
C211 C 0.39763(14) 0.53124(15) 0.26112(11) 0.0158(2) Uani 1 1 d . . .
C212 C 0.50553(16) 0.50677(18) 0.29772(15) 0.0232(3) Uani 1 1 d . . .
H212 H 0.491(3) 0.424(3) 0.290(2) 0.028 Uiso 1 1 d . . .
C213 C 0.63405(17) 0.6104(2) 0.34931(15) 0.0272(3) Uani 1 1 d . . .
H213 H 0.708(3) 0.597(3) 0.377(2) 0.033 Uiso 1 1 d . . .
C214 C 0.65642(16) 0.73938(18) 0.36386(13) 0.0252(3) Uani 1 1 d . . .
H214 H 0.744(3) 0.806(3) 0.400(2) 0.030 Uiso 1 1 d . . .
C215 C 0.55110(17) 0.76427(17) 0.32652(15) 0.0261(3) Uani 1 1 d . . .
H215 H 0.563(3) 0.851(3) 0.336(2) 0.031 Uiso 1 1 d . . .
C216 C 0.42131(16) 0.66126(16) 0.27604(13) 0.0215(3) Uani 1 1 d . . .
H216 H 0.349(2) 0.683(2) 0.2531(19) 0.026 Uiso 1 1 d . . .
C221 C 0.10965(14) 0.46924(14) 0.20709(11) 0.0152(2) Uani 1 1 d . . .
C222 C 0.09133(16) 0.52631(17) 0.13976(13) 0.0205(3) Uani 1 1 d . . .
H222 H 0.143(2) 0.521(2) 0.0856(19) 0.025 Uiso 1 1 d . . .
C223 C 0.00182(18) 0.58870(17) 0.14975(13) 0.0231(3) Uani 1 1 d . . .
H223 H -0.007(3) 0.628(3) 0.106(2) 0.028 Uiso 1 1 d . . .
C224 C -0.07072(17) 0.59307(17) 0.22574(14) 0.0225(3) Uani 1 1 d . . .
H224 H -0.132(3) 0.638(3) 0.233(2) 0.027 Uiso 1 1 d . . .
C225 C -0.05346(17) 0.53599(17) 0.29241(14) 0.0228(3) Uani 1 1 d . . .
H225 H -0.101(3) 0.541(2) 0.345(2) 0.027 Uiso 1 1 d . . .
C226 C 0.03637(15) 0.47416(15) 0.28318(12) 0.0182(2) Uani 1 1 d . . .
H226 H 0.047(2) 0.432(2) 0.3263(18) 0.022 Uiso 1 1 d . . .
C231 C 0.21945(15) 0.30953(15) 0.05981(11) 0.0175(2) Uani 1 1 d . . .
C232 C 0.3234(2) 0.3527(2) 0.01562(15) 0.0339(4) Uani 1 1 d . . .
H232 H 0.398(3) 0.431(3) 0.054(2) 0.041 Uiso 1 1 d . . .
C233 C 0.3126(2) 0.2791(3) -0.09167(16) 0.0449(6) Uani 1 1 d . . .
H233 H 0.387(3) 0.305(3) -0.121(3) 0.054 Uiso 1 1 d . . .
C234 C 0.1987(2) 0.1623(2) -0.15509(14) 0.0341(4) Uani 1 1 d . . .
H234 H 0.197(3) 0.111(3) -0.228(2) 0.041 Uiso 1 1 d . . .
C235 C 0.0942(2) 0.1191(2) -0.11163(14) 0.0295(4) Uani 1 1 d . . .
H235 H 0.017(3) 0.035(3) -0.154(2) 0.035 Uiso 1 1 d . . .
C236 C 0.10418(17) 0.19272(18) -0.00466(13) 0.0252(3) Uani 1 1 d . . .
H236 H 0.031(3) 0.164(3) 0.025(2) 0.030 Uiso 1 1 d . . .
Cl1 Cl 0.06810(4) 0.26687(4) 0.40890(3) 0.02104(6) 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 136.900(13) . . ?
P2 Au1 Cl1 114.145(12) . . ?
P1 Au1 Cl1 108.609(12) . . ?
P2 Au1 Au1 80.530(9) . 2 ?
P1 Au1 Au1 88.884(9) . 2 ?
Cl1 Au1 Au1 111.773(10) . 2 ?
C131 P1 C111 104.01(6) . . ?
C131 P1 C121 104.22(6) . . ?
C111 P1 C121 106.04(6) . . ?
C131 P1 Au1 108.52(5) . . ?
C111 P1 Au1 119.53(5) . . ?
C121 P1 Au1 113.14(5) . . ?
C116 C111 C112 119.46(13) . . ?
C116 C111 P1 119.43(10) . . ?
C112 C111 P1 121.11(10) . . ?
C113 C112 C111 120.30(13) . . ?
C113 C112 H112 120.7(14) . . ?
C111 C112 H112 119.0(14) . . ?
C114 C113 C112 119.93(14) . . ?
C114 C113 H113 119.5(15) . . ?
C112 C113 H113 120.5(15) . . ?
C113 C114 C115 119.93(14) . . ?
C113 C114 H114 120.0(15) . . ?
C115 C114 H114 120.1(15) . . ?
C116 C115 C114 120.24(13) . . ?
C116 C115 H115 120.5(14) . . ?
C114 C115 H115 119.3(14) . . ?
C115 C116 C111 120.13(13) . . ?
C115 C116 H116 116.0(14) . . ?
C111 C116 H116 123.9(14) . . ?
C126 C121 C122 119.09(14) . . ?
C126 C121 P1 117.98(12) . . ?
C122 C121 P1 122.89(12) . . ?
C121 C122 C123 120.09(16) . . ?
C121 C122 H122 120.3(16) . . ?
C123 C122 H122 119.6(16) . . ?
C124 C123 C122 120.54(18) . . ?
C124 C123 H123 120.9(17) . . ?
C122 C123 H123 118.5(18) . . ?
C123 C124 C125 119.54(16) . . ?
C123 C124 H124 118.7(18) . . ?
C125 C124 H124 121.8(18) . . ?
C124 C125 C126 120.54(17) . . ?
C124 C125 H125 121.5(18) . . ?
C126 C125 H125 117.9(18) . . ?
C121 C126 C125 120.18(17) . . ?
C121 C126 H126 120.5(16) . . ?
C125 C126 H126 119.2(16) . . ?
C132 C131 C136 119.45(13) . . ?
C132 C131 P1 123.14(11) . . ?
C136 C131 P1 117.40(11) . . ?
C133 C132 C131 120.00(14) . . ?
C133 C132 H132 120.8(14) . . ?
C131 C132 H132 119.2(14) . . ?
C134 C133 C132 120.14(15) . . ?
C134 C133 H133 119.2(15) . . ?
C132 C133 H133 120.7(15) . . ?
C135 C134 C133 120.09(14) . . ?
C135 C134 H134 119.7(15) . . ?
C133 C134 H134 120.1(14) . . ?
C134 C135 C136 120.05(15) . . ?
C134 C135 H135 121.4(15) . . ?
C136 C135 H135 118.3(15) . . ?
C135 C136 C131 120.27(14) . . ?
C135 C136 H136 120.1(14) . . ?
C131 C136 H136 119.6(14) . . ?
C221 P2 C211 105.95(7) . . ?
C221 P2 C231 104.46(7) . . ?
C211 P2 C231 105.53(7) . . ?
C221 P2 Au1 119.48(5) . . ?
C211 P2 Au1 109.53(5) . . ?
C231 P2 Au1 110.92(5) . . ?
C216 C211 C212 118.88(14) . . ?
C216 C211 P2 122.93(11) . . ?
C212 C211 P2 118.13(12) . . ?
C213 C212 C211 120.61(16) . . ?
C213 C212 H212 119.7(16) . . ?
C211 C212 H212 119.7(16) . . ?
C214 C213 C212 120.02(16) . . ?
C214 C213 H213 118.1(16) . . ?
C212 C213 H213 121.9(16) . . ?
C215 C214 C213 119.86(15) . . ?
C215 C214 H214 122.9(17) . . ?
C213 C214 H214 117.2(16) . . ?
C214 C215 C216 120.50(16) . . ?
C214 C215 H215 121.6(16) . . ?
C216 C215 H215 117.9(16) . . ?
C215 C216 C211 120.10(15) . . ?
C215 C216 H216 118.4(15) . . ?
C211 C216 H216 121.5(15) . . ?
C226 C221 C222 119.48(13) . . ?
C226 C221 P2 118.67(11) . . ?
C222 C221 P2 121.83(11) . . ?
C223 C222 C221 120.05(14) . . ?
C223 C222 H222 121.2(15) . . ?
C221 C222 H222 118.8(15) . . ?
C224 C223 C222 120.05(15) . . ?
C224 C223 H223 121.2(16) . . ?
C222 C223 H223 118.7(16) . . ?
C223 C224 C225 120.14(15) . . ?
C223 C224 H224 119.8(15) . . ?
C225 C224 H224 120.1(15) . . ?
C224 C225 C226 120.07(15) . . ?
C224 C225 H225 119.6(16) . . ?
C226 C225 H225 120.3(16) . . ?
C225 C226 C221 120.21(14) . . ?
C225 C226 H226 121.2(14) . . ?
C221 C226 H226 118.5(14) . . ?
C232 C231 C236 119.00(15) . . ?
C232 C231 P2 123.22(12) . . ?
C236 C231 P2 117.67(12) . . ?
C231 C232 C233 120.31(17) . . ?
C231 C232 H232 121.9(18) . . ?
C233 C232 H232 117.8(18) . . ?
C234 C233 C232 120.50(18) . . ?
C234 C233 H233 119.1(19) . . ?
C232 C233 H233 120.1(19) . . ?
C233 C234 C235 119.48(17) . . ?
C233 C234 H234 118.3(17) . . ?
C235 C234 H234 122.2(17) . . ?
C234 C235 C236 120.22(17) . . ?
C234 C235 H235 120.5(16) . . ?
C236 C235 H235 119.2(16) . . ?
C231 C236 C235 120.48(16) . . ?
C231 C236 H236 119.4(16) . . ?
C235 C236 H236 120.1(16) . . ?
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 2.3121(4) . ?
Au1 P1 2.3230(4) . ?
Au1 Cl1 2.5439(3) . ?
Au1 Au1 7.44582(17) 2 ?
P1 C131 1.8131(14) . ?
P1 C111 1.8137(14) . ?
P1 C121 1.8211(14) . ?
C111 C116 1.3936(18) . ?
C111 C112 1.398(2) . ?
C112 C113 1.392(2) . ?
C112 H112 0.97(2) . ?
C113 C114 1.389(2) . ?
C113 H113 0.95(2) . ?
C114 C115 1.393(2) . ?
C114 H114 0.95(2) . ?
C115 C116 1.389(2) . ?
C115 H115 0.97(2) . ?
C116 H116 0.90(2) . ?
C121 C126 1.391(2) . ?
C121 C122 1.392(2) . ?
C122 C123 1.395(2) . ?
C122 H122 0.95(3) . ?
C123 C124 1.379(3) . ?
C123 H123 0.98(3) . ?
C124 C125 1.379(3) . ?
C124 H124 0.95(3) . ?
C125 C126 1.394(2) . ?
C125 H125 0.91(3) . ?
C126 H126 0.97(3) . ?
C131 C132 1.397(2) . ?
C131 C136 1.398(2) . ?
C132 C133 1.393(2) . ?
C132 H132 0.95(2) . ?
C133 C134 1.390(2) . ?
C133 H133 0.94(2) . ?
C134 C135 1.388(2) . ?
C134 H134 0.97(2) . ?
C135 C136 1.389(2) . ?
C135 H135 0.96(2) . ?
C136 H136 0.95(2) . ?
P2 C221 1.8147(14) . ?
P2 C211 1.8206(14) . ?
P2 C231 1.8216(15) . ?
C211 C216 1.394(2) . ?
C211 C212 1.395(2) . ?
C212 C213 1.389(2) . ?
C212 H212 0.90(3) . ?
C213 C214 1.386(3) . ?
C213 H213 0.95(3) . ?
C214 C215 1.378(3) . ?
C214 H214 0.93(3) . ?
C215 C216 1.394(2) . ?
C215 H215 0.94(3) . ?
C216 H216 0.96(3) . ?
C221 C226 1.395(2) . ?
C221 C222 1.399(2) . ?
C222 C223 1.391(2) . ?
C222 H222 0.99(2) . ?
C223 C224 1.389(2) . ?
C223 H223 0.92(3) . ?
C224 C225 1.389(2) . ?
C224 H224 0.97(3) . ?
C225 C226 1.389(2) . ?
C225 H225 0.94(2) . ?
C226 H226 0.94(2) . ?
C231 C232 1.386(2) . ?
C231 C236 1.390(2) . ?
C232 C233 1.394(3) . ?
C232 H232 0.91(3) . ?
C233 C234 1.380(3) . ?
C233 H233 0.95(3) . ?
C234 C235 1.384(3) . ?
C234 H234 0.97(3) . ?
C235 C236 1.393(2) . ?
C235 H235 0.96(3) . ?
C236 H236 0.95(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 0.95(2) 2.76(2) 3.5354(15) 139.3(19) 2_556
C116 H116 Cl1 0.90(2) 2.84(2) 3.5277(14) 134.0(17) .
C226 H226 Cl1 0.94(2) 2.70(2) 3.6255(15) 167.5(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 C131 60.95(5) . . . . ?
Cl1 Au1 P1 C131 -111.58(5) . . . . ?
Au1 Au1 P1 C131 135.78(5) 2 . . . ?
P2 Au1 P1 C111 179.84(5) . . . . ?
Cl1 Au1 P1 C111 7.31(5) . . . . ?
Au1 Au1 P1 C111 -105.33(5) 2 . . . ?
P2 Au1 P1 C121 -54.19(5) . . . . ?
Cl1 Au1 P1 C121 133.28(5) . . . . ?
Au1 Au1 P1 C121 20.64(5) 2 . . . ?
C131 P1 C111 C116 146.71(11) . . . . ?
C121 P1 C111 C116 -103.72(12) . . . . ?
Au1 P1 C111 C116 25.55(13) . . . . ?
C131 P1 C111 C112 -32.52(13) . . . . ?
C121 P1 C111 C112 77.06(13) . . . . ?
Au1 P1 C111 C112 -153.68(10) . . . . ?
C116 C111 C112 C113 1.2(2) . . . . ?
P1 C111 C112 C113 -179.58(12) . . . . ?
C111 C112 C113 C114 -0.8(2) . . . . ?
C112 C113 C114 C115 0.4(2) . . . . ?
C113 C114 C115 C116 -0.4(2) . . . . ?
C114 C115 C116 C111 0.8(2) . . . . ?
C112 C111 C116 C115 -1.2(2) . . . . ?
P1 C111 C116 C115 179.56(11) . . . . ?
C131 P1 C121 C126 -84.39(14) . . . . ?
C111 P1 C121 C126 166.19(13) . . . . ?
Au1 P1 C121 C126 33.29(14) . . . . ?
C131 P1 C121 C122 93.20(15) . . . . ?
C111 P1 C121 C122 -16.23(16) . . . . ?
Au1 P1 C121 C122 -149.12(13) . . . . ?
C126 C121 C122 C123 0.7(3) . . . . ?
P1 C121 C122 C123 -176.85(16) . . . . ?
C121 C122 C123 C124 -0.1(3) . . . . ?
C122 C123 C124 C125 -0.5(4) . . . . ?
C123 C124 C125 C126 0.4(4) . . . . ?
C122 C121 C126 C125 -0.8(3) . . . . ?
P1 C121 C126 C125 176.89(16) . . . . ?
C124 C125 C126 C121 0.2(3) . . . . ?
C111 P1 C131 C132 99.68(13) . . . . ?
C121 P1 C131 C132 -11.23(14) . . . . ?
Au1 P1 C131 C132 -132.05(12) . . . . ?
C111 P1 C131 C136 -81.11(12) . . . . ?
C121 P1 C131 C136 167.98(11) . . . . ?
Au1 P1 C131 C136 47.16(12) . . . . ?
C136 C131 C132 C133 -0.3(2) . . . . ?
P1 C131 C132 C133 178.94(12) . . . . ?
C131 C132 C133 C134 -0.4(2) . . . . ?
C132 C133 C134 C135 0.7(3) . . . . ?
C133 C134 C135 C136 -0.4(2) . . . . ?
C134 C135 C136 C131 -0.3(2) . . . . ?
C132 C131 C136 C135 0.6(2) . . . . ?
P1 C131 C136 C135 -178.62(12) . . . . ?
P1 Au1 P2 C221 169.42(5) . . . . ?
Cl1 Au1 P2 C221 -18.33(6) . . . . ?
Au1 Au1 P2 C221 91.38(5) 2 . . . ?
P1 Au1 P2 C211 -68.19(5) . . . . ?
Cl1 Au1 P2 C211 104.05(5) . . . . ?
Au1 Au1 P2 C211 -146.24(5) 2 . . . ?
P1 Au1 P2 C231 47.89(6) . . . . ?
Cl1 Au1 P2 C231 -139.87(5) . . . . ?
Au1 Au1 P2 C231 -30.16(5) 2 . . . ?
C221 P2 C211 C216 -17.20(15) . . . . ?
C231 P2 C211 C216 93.22(14) . . . . ?
Au1 P2 C211 C216 -147.33(12) . . . . ?
C221 P2 C211 C212 160.08(12) . . . . ?
C231 P2 C211 C212 -89.51(13) . . . . ?
Au1 P2 C211 C212 29.95(13) . . . . ?
C216 C211 C212 C213 0.8(2) . . . . ?
P2 C211 C212 C213 -176.60(14) . . . . ?
C211 C212 C213 C214 -0.7(3) . . . . ?
C212 C213 C214 C215 -0.4(3) . . . . ?
C213 C214 C215 C216 1.3(3) . . . . ?
C214 C215 C216 C211 -1.2(3) . . . . ?
C212 C211 C216 C215 0.2(2) . . . . ?
P2 C211 C216 C215 177.42(13) . . . . ?
C211 P2 C221 C226 -104.21(12) . . . . ?
C231 P2 C221 C226 144.61(12) . . . . ?
Au1 P2 C221 C226 19.91(14) . . . . ?
C211 P2 C221 C222 74.05(14) . . . . ?
C231 P2 C221 C222 -37.13(14) . . . . ?
Au1 P2 C221 C222 -161.82(11) . . . . ?
C226 C221 C222 C223 0.7(2) . . . . ?
P2 C221 C222 C223 -177.52(13) . . . . ?
C221 C222 C223 C224 -0.8(3) . . . . ?
C222 C223 C224 C225 0.4(3) . . . . ?
C223 C224 C225 C226 -0.1(3) . . . . ?
C224 C225 C226 C221 0.1(2) . . . . ?
C222 C221 C226 C225 -0.4(2) . . . . ?
P2 C221 C226 C225 177.91(12) . . . . ?
C221 P2 C231 C232 110.81(17) . . . . ?
C211 P2 C231 C232 -0.67(18) . . . . ?
Au1 P2 C231 C232 -119.20(16) . . . . ?
C221 P2 C231 C236 -73.06(14) . . . . ?
C211 P2 C231 C236 175.46(13) . . . . ?
Au1 P2 C231 C236 56.93(14) . . . . ?
C236 C231 C232 C233 -0.6(3) . . . . ?
P2 C231 C232 C233 175.5(2) . . . . ?
C231 C232 C233 C234 -0.2(4) . . . . ?
C232 C233 C234 C235 0.6(4) . . . . ?
C233 C234 C235 C236 -0.2(4) . . . . ?
C232 C231 C236 C235 1.0(3) . . . . ?
P2 C231 C236 C235 -175.26(15) . . . . ?
C234 C235 C236 C231 -0.7(3) . . . . ?
