#------------------------------------------------------------------------------
#$Date: 2016-03-24 16:31:00 +0100 (jue 24 de mar de 2016) $
#$Revision: 179688 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/10/7001054.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_7001054
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                113.1231(12)
_cell_angle_beta                 95.5306(10)
_cell_angle_gamma                109.5776(11)
_cell_formula_units_Z            2
_cell_length_a                   10.8463(2)
_cell_length_b                   11.8202(2)
_cell_length_c                   14.1697(3)
_cell_measurement_temperature    156(2)
_cell_volume                     1518.65(6)
_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      156(2)
_diffrn_measured_fraction_theta_full 0.987
_diffrn_measured_fraction_theta_max 0.987
_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  0.021
_diffrn_reflns_av_sigmaI/netI    0.0163
_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            44220
_diffrn_reflns_theta_full        32.43
_diffrn_reflns_theta_max         32.43
_diffrn_reflns_theta_min         2.05
_exptl_absorpt_coefficient_mu    5.061
_exptl_absorpt_correction_T_max  1.000
_exptl_absorpt_correction_T_min  0.748
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   'HKL SCALEPACK (Otwinowski & Minor, 1997)'
_exptl_crystal_colour            green
_exptl_crystal_density_diffrn    1.655
_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         1.030
_refine_diff_density_min         -0.711
_refine_diff_density_rms         0.084
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.147
_refine_ls_hydrogen_treatment    refxyz
_refine_ls_matrix_type           full
_refine_ls_number_parameters     451
_refine_ls_number_reflns         10785
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.147
_refine_ls_R_factor_all          0.0148
_refine_ls_R_factor_gt           0.0146
_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)+(0.0018P)²+1.6673P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0411
_refine_ls_wR_factor_ref         0.0412
_reflns_number_gt                10706
_reflns_number_total             10785
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b820066a.txt
_cod_data_source_block           156Kon
_cod_original_cell_volume        1518.65(5)
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7001054
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 0.211205(5) 0.245454(6) 0.275427(4) 0.01794(2) Uani 1 1 d . . .
P1 P 0.30610(4) 0.09646(4) 0.27611(3) 0.01678(6) Uani 1 1 d . . .
C111 C 0.25521(15) 0.00351(15) 0.35144(12) 0.0176(2) Uani 1 1 d . . .
C112 C 0.34107(17) -0.04296(18) 0.38999(14) 0.0237(3) Uani 1 1 d . . .
H112 H 0.430(2) -0.024(2) 0.377(2) 0.028 Uiso 1 1 d . . .
C113 C 0.29954(19) -0.11487(19) 0.44664(15) 0.0268(3) Uani 1 1 d . . .
H113 H 0.354(3) -0.148(3) 0.472(2) 0.032 Uiso 1 1 d . . .
C114 C 0.17328(18) -0.13962(18) 0.46656(14) 0.0255(3) Uani 1 1 d . . .
H114 H 0.142(3) -0.190(3) 0.504(2) 0.031 Uiso 1 1 d . . .
C115 C 0.08759(18) -0.09370(17) 0.42880(15) 0.0247(3) Uani 1 1 d . . .
H115 H -0.001(3) -0.111(2) 0.443(2) 0.030 Uiso 1 1 d . . .
C116 C 0.12840(16) -0.02165(16) 0.37187(13) 0.0207(3) Uani 1 1 d . . .
H116 H 0.071(2) 0.013(2) 0.3524(19) 0.025 Uiso 1 1 d . . .
C121 C 0.28901(16) -0.02768(16) 0.14311(12) 0.0206(3) Uani 1 1 d . . .
C122 C 0.2789(3) -0.15623(19) 0.12004(16) 0.0376(5) Uani 1 1 d . . .
H122 H 0.273(3) -0.184(3) 0.173(2) 0.045 Uiso 1 1 d . . .
C123 C 0.2731(3) -0.2445(2) 0.01795(18) 0.0468(6) Uani 1 1 d . . .
H123 H 0.261(3) -0.338(3) 0.002(3) 0.056 Uiso 1 1 d . . .
C124 C 0.2764(3) -0.2054(2) -0.06144(17) 0.0421(5) Uani 1 1 d . . .
H124 H 0.271(3) -0.266(3) -0.131(3) 0.050 Uiso 1 1 d . . .
C125 C 0.2856(3) -0.0780(3) -0.03945(18) 0.0470(6) Uani 1 1 d . . .
H125 H 0.295(3) -0.044(3) -0.089(3) 0.056 Uiso 1 1 d . . .
C126 C 0.2919(3) 0.0107(2) 0.06245(16) 0.0360(4) Uani 1 1 d . . .
H126 H 0.303(3) 0.101(3) 0.079(2) 0.043 Uiso 1 1 d . . .
C131 C 0.48769(15) 0.19045(15) 0.33302(12) 0.0186(2) Uani 1 1 d . . .
C132 C 0.58254(17) 0.15027(19) 0.28590(14) 0.0254(3) Uani 1 1 d . . .
H132 H 0.554(3) 0.070(3) 0.223(2) 0.030 Uiso 1 1 d . . .
C133 C 0.72020(18) 0.2287(2) 0.33270(15) 0.0302(4) Uani 1 1 d . . .
H133 H 0.787(3) 0.202(3) 0.303(2) 0.036 Uiso 1 1 d . . .
C134 C 0.76341(18) 0.3471(2) 0.42568(15) 0.0287(3) Uani 1 1 d . . .
H134 H 0.859(3) 0.401(3) 0.459(2) 0.034 Uiso 1 1 d . . .
C135 C 0.66951(19) 0.38765(19) 0.47354(15) 0.0286(3) Uani 1 1 d . . .
H135 H 0.693(3) 0.468(3) 0.533(2) 0.034 Uiso 1 1 d . . .
C136 C 0.53197(18) 0.30959(17) 0.42726(14) 0.0251(3) Uani 1 1 d . . .
H136 H 0.467(3) 0.338(2) 0.458(2) 0.030 Uiso 1 1 d . . .
P2 P 0.23108(4) 0.39018(4) 0.20035(3) 0.01828(7) Uani 1 1 d . . .
C211 C 0.39818(15) 0.52847(16) 0.26040(12) 0.0201(3) Uani 1 1 d . . .
C212 C 0.50583(19) 0.5033(2) 0.29577(18) 0.0313(4) Uani 1 1 d . . .
H212 H 0.491(3) 0.417(3) 0.285(2) 0.038 Uiso 1 1 d . . .
C213 C 0.6340(2) 0.6071(2) 0.34739(19) 0.0367(4) Uani 1 1 d . . .
H213 H 0.708(3) 0.590(3) 0.373(2) 0.044 Uiso 1 1 d . . .
C214 C 0.65598(19) 0.7358(2) 0.36287(16) 0.0336(4) Uani 1 1 d . . .
H214 H 0.742(3) 0.803(3) 0.397(2) 0.040 Uiso 1 1 d . . .
C215 C 0.5514(2) 0.76137(19) 0.32717(18) 0.0342(4) Uani 1 1 d . . .
H215 H 0.566(3) 0.850(3) 0.338(2) 0.041 Uiso 1 1 d . . .
C216 C 0.42195(18) 0.65859(18) 0.27670(16) 0.0280(3) Uani 1 1 d . . .
H216 H 0.349(3) 0.678(3) 0.255(2) 0.034 Uiso 1 1 d . . .
C221 C 0.11160(16) 0.46781(16) 0.20665(13) 0.0200(3) Uani 1 1 d . . .
C222 C 0.09336(19) 0.52440(19) 0.13938(15) 0.0271(3) Uani 1 1 d . . .
H222 H 0.145(3) 0.518(3) 0.086(2) 0.033 Uiso 1 1 d . . .
C223 C 0.0047(2) 0.5873(2) 0.14937(16) 0.0305(4) Uani 1 1 d . . .
H223 H -0.007(3) 0.624(3) 0.103(2) 0.037 Uiso 1 1 d . . .
C224 C -0.0670(2) 0.59311(19) 0.22574(16) 0.0298(3) Uani 1 1 d . . .
H224 H -0.129(3) 0.633(3) 0.231(2) 0.036 Uiso 1 1 d . . .
C225 C -0.0501(2) 0.5368(2) 0.29256(16) 0.0299(3) Uani 1 1 d . . .
H225 H -0.101(3) 0.542(3) 0.345(2) 0.036 Uiso 1 1 d . . .
C226 C 0.03862(17) 0.47370(18) 0.28274(14) 0.0237(3) Uani 1 1 d . . .
H226 H 0.050(2) 0.436(2) 0.327(2) 0.028 Uiso 1 1 d . . .
C231 C 0.22075(17) 0.30709(17) 0.05961(13) 0.0228(3) Uani 1 1 d . . .
C232 C 0.3242(3) 0.3491(3) 0.01524(18) 0.0469(6) Uani 1 1 d . . .
H232 H 0.399(3) 0.421(3) 0.053(3) 0.056 Uiso 1 1 d . . .
C233 C 0.3127(3) 0.2760(3) -0.0920(2) 0.0620(9) Uani 1 1 d . . .
H233 H 0.384(4) 0.302(4) -0.122(3) 0.074 Uiso 1 1 d . . .
C234 C 0.1998(3) 0.1600(3) -0.15513(17) 0.0456(6) Uani 1 1 d . . .
H234 H 0.194(3) 0.108(3) -0.229(3) 0.055 Uiso 1 1 d . . .
C235 C 0.0956(2) 0.1179(3) -0.11194(17) 0.0408(5) Uani 1 1 d . . .
H235 H 0.016(3) 0.036(3) -0.155(2) 0.049 Uiso 1 1 d . . .
C236 C 0.1057(2) 0.1907(2) -0.00511(16) 0.0343(4) Uani 1 1 d . . .
H236 H 0.036(3) 0.160(3) 0.027(2) 0.041 Uiso 1 1 d . . .
Cl1 Cl 0.06783(5) 0.26588(5) 0.40797(4) 0.02851(8) 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 136.711(14) . . ?
P2 Au1 Cl1 114.193(14) . . ?
P1 Au1 Cl1 108.738(14) . . ?
P2 Au1 Au1 80.119(10) . 2 ?
P1 Au1 Au1 89.576(10) . 2 ?
Cl1 Au1 Au1 111.437(12) . 2 ?
C111 P1 C131 103.99(7) . . ?
C111 P1 C121 106.12(7) . . ?
C131 P1 C121 104.35(7) . . ?
C111 P1 Au1 119.46(5) . . ?
C131 P1 Au1 108.41(5) . . ?
C121 P1 Au1 113.13(6) . . ?
C116 C111 C112 119.21(14) . . ?
C116 C111 P1 119.49(12) . . ?
C112 C111 P1 121.30(11) . . ?
C113 C112 C111 120.30(15) . . ?
C113 C112 H112 120.4(15) . . ?
C111 C112 H112 119.3(15) . . ?
C114 C113 C112 120.17(16) . . ?
C114 C113 H113 118.1(16) . . ?
C112 C113 H113 121.7(16) . . ?
C113 C114 C115 119.91(15) . . ?
C113 C114 H114 122.0(15) . . ?
C115 C114 H114 118.1(15) . . ?
C114 C115 C116 120.28(15) . . ?
C114 C115 H115 119.6(15) . . ?
C116 C115 H115 120.1(15) . . ?
C115 C116 C111 120.12(15) . . ?
C115 C116 H116 117.8(15) . . ?
C111 C116 H116 122.0(15) . . ?
C126 C121 C122 118.72(16) . . ?
C126 C121 P1 118.10(14) . . ?
C122 C121 P1 123.13(13) . . ?
C121 C122 C123 120.56(19) . . ?
C121 C122 H122 119.3(18) . . ?
C123 C122 H122 120.1(18) . . ?
C124 C123 C122 120.3(2) . . ?
C124 C123 H123 120.3(19) . . ?
C122 C123 H123 119.3(19) . . ?
C123 C124 C125 119.58(19) . . ?
C123 C124 H124 120.3(19) . . ?
C125 C124 H124 120.1(19) . . ?
C124 C125 C126 120.4(2) . . ?
C124 C125 H125 123(2) . . ?
C126 C125 H125 116(2) . . ?
C121 C126 C125 120.5(2) . . ?
C121 C126 H126 118.5(17) . . ?
C125 C126 H126 121.0(17) . . ?
C132 C131 C136 119.58(15) . . ?
C132 C131 P1 123.10(12) . . ?
C136 C131 P1 117.31(12) . . ?
C133 C132 C131 120.05(16) . . ?
C133 C132 H132 119.4(15) . . ?
C131 C132 H132 120.6(15) . . ?
C134 C133 C132 120.08(17) . . ?
C134 C133 H133 118.3(16) . . ?
C132 C133 H133 121.6(16) . . ?
C133 C134 C135 120.26(16) . . ?
C133 C134 H134 120.2(16) . . ?
C135 C134 H134 119.5(16) . . ?
C136 C135 C134 119.88(17) . . ?
C136 C135 H135 116.6(16) . . ?
C134 C135 H135 123.4(16) . . ?
C135 C136 C131 120.15(16) . . ?
C135 C136 H136 120.4(15) . . ?
C131 C136 H136 119.4(15) . . ?
C221 P2 C231 104.44(8) . . ?
C221 P2 C211 105.74(7) . . ?
C231 P2 C211 105.48(7) . . ?
C221 P2 Au1 119.50(5) . . ?
C231 P2 Au1 111.13(6) . . ?
C211 P2 Au1 109.54(5) . . ?
C216 C211 C212 118.76(16) . . ?
C216 C211 P2 123.10(13) . . ?
C212 C211 P2 118.08(13) . . ?
C213 C212 C211 120.37(19) . . ?
C213 C212 H212 120.3(17) . . ?
C211 C212 H212 119.4(17) . . ?
C214 C213 C212 120.16(19) . . ?
C214 C213 H213 119.6(17) . . ?
C212 C213 H213 120.2(17) . . ?
C215 C214 C213 119.99(18) . . ?
C215 C214 H214 121.1(18) . . ?
C213 C214 H214 118.9(18) . . ?
C214 C215 C216 120.40(19) . . ?
C214 C215 H215 120.5(17) . . ?
C216 C215 H215 119.1(17) . . ?
C211 C216 C215 120.31(18) . . ?
C211 C216 H216 120.1(16) . . ?
C215 C216 H216 119.6(16) . . ?
C226 C221 C222 119.35(15) . . ?
C226 C221 P2 118.68(12) . . ?
C222 C221 P2 121.96(13) . . ?
C223 C222 C221 120.21(17) . . ?
C223 C222 H222 122.1(16) . . ?
C221 C222 H222 117.7(16) . . ?
C222 C223 C224 119.96(17) . . ?
C222 C223 H223 118.9(17) . . ?
C224 C223 H223 121.1(17) . . ?
C225 C224 C223 120.30(17) . . ?
C225 C224 H224 120.0(17) . . ?
C223 C224 H224 119.7(17) . . ?
C224 C225 C226 119.88(18) . . ?
C224 C225 H225 118.9(16) . . ?
C226 C225 H225 121.2(16) . . ?
C225 C226 C221 120.30(16) . . ?
C225 C226 H226 120.2(15) . . ?
C221 C226 H226 119.5(15) . . ?
C232 C231 C236 118.64(17) . . ?
C232 C231 P2 123.46(14) . . ?
C236 C231 P2 117.79(13) . . ?
C231 C232 C233 120.4(2) . . ?
C231 C232 H232 122(2) . . ?
C233 C232 H232 118(2) . . ?
C234 C233 C232 120.7(2) . . ?
C234 C233 H233 118(2) . . ?
C232 C233 H233 121(2) . . ?
C233 C234 C235 119.4(2) . . ?
C233 C234 H234 120.1(19) . . ?
C235 C234 H234 120.5(19) . . ?
C234 C235 C236 120.4(2) . . ?
C234 C235 H235 120.3(18) . . ?
C236 C235 H235 119.3(18) . . ?
C235 C236 C231 120.49(19) . . ?
C235 C236 H236 121.1(17) . . ?
C231 C236 H236 118.3(17) . . ?
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 2.3089(4) . ?
Au1 P1 2.3211(4) . ?
Au1 Cl1 2.5420(4) . ?
Au1 Au1 7.4366(2) 2 ?
P1 C111 1.8109(15) . ?
P1 C131 1.8132(15) . ?
P1 C121 1.8214(16) . ?
C111 C116 1.391(2) . ?
C111 C112 1.396(2) . ?
C112 C113 1.385(2) . ?
C112 H112 0.97(2) . ?
C113 C114 1.383(2) . ?
C113 H113 0.92(3) . ?
C114 C115 1.384(3) . ?
C114 H114 0.95(3) . ?
C115 C116 1.388(2) . ?
C115 H115 0.97(2) . ?
C116 H116 0.92(2) . ?
C121 C126 1.385(2) . ?
C121 C122 1.385(3) . ?
C122 C123 1.392(3) . ?
C122 H122 0.94(3) . ?
C123 C124 1.373(3) . ?
C123 H123 0.99(3) . ?
C124 C125 1.378(4) . ?
C124 H124 0.94(3) . ?
C125 C126 1.390(3) . ?
C125 H125 0.93(3) . ?
C126 H126 0.96(3) . ?
C131 C132 1.393(2) . ?
C131 C136 1.394(2) . ?
C132 C133 1.388(2) . ?
C132 H132 0.94(3) . ?
C133 C134 1.381(3) . ?
C133 H133 0.96(3) . ?
C134 C135 1.390(3) . ?
C134 H134 0.97(3) . ?
C135 C136 1.386(2) . ?
C135 H135 0.92(3) . ?
C136 H136 0.95(3) . ?
P2 C221 1.8123(16) . ?
P2 C231 1.8164(17) . ?
P2 C211 1.8182(16) . ?
C211 C216 1.389(2) . ?
C211 C212 1.393(2) . ?
C212 C213 1.389(3) . ?
C212 H212 0.92(3) . ?
C213 C214 1.380(3) . ?
C213 H213 0.97(3) . ?
C214 C215 1.369(3) . ?
C214 H214 0.92(3) . ?
C215 C216 1.392(3) . ?
C215 H215 0.95(3) . ?
C216 H216 0.95(3) . ?
C221 C226 1.392(2) . ?
C221 C222 1.396(2) . ?
C222 C223 1.386(3) . ?
C222 H222 0.98(3) . ?
C223 C224 1.386(3) . ?
C223 H223 0.93(3) . ?
C224 C225 1.384(3) . ?
C224 H224 0.93(3) . ?
C225 C226 1.389(2) . ?
C225 H225 0.96(3) . ?
C226 H226 0.93(3) . ?
C231 C232 1.382(3) . ?
C231 C236 1.389(3) . ?
C232 C233 1.391(3) . ?
C232 H232 0.88(3) . ?
C233 C234 1.371(4) . ?
C233 H233 0.94(4) . ?
C234 C235 1.376(3) . ?
C234 H234 0.97(3) . ?
C235 C236 1.388(3) . ?
C235 H235 0.96(3) . ?
C236 H236 0.96(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(3) 2.75(2) 3.5486(17) 142(2) 2_556
C116 H116 Cl1 0.92(2) 2.80(2) 3.5270(16) 137.3(18) .
C226 H226 Cl1 0.93(3) 2.72(3) 3.6221(17) 165(2) .
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 179.55(6) . . . . ?
Cl1 Au1 P1 C111 7.14(6) . . . . ?
Au1 Au1 P1 C111 -105.41(6) 2 . . . ?
P2 Au1 P1 C131 60.81(6) . . . . ?
Cl1 Au1 P1 C131 -111.60(5) . . . . ?
Au1 Au1 P1 C131 135.85(5) 2 . . . ?
P2 Au1 P1 C121 -54.42(6) . . . . ?
Cl1 Au1 P1 C121 133.17(6) . . . . ?
Au1 Au1 P1 C121 20.62(6) 2 . . . ?
C131 P1 C111 C116 146.58(13) . . . . ?
C121 P1 C111 C116 -103.67(13) . . . . ?
Au1 P1 C111 C116 25.61(15) . . . . ?
C131 P1 C111 C112 -33.09(15) . . . . ?
C121 P1 C111 C112 76.66(15) . . . . ?
Au1 P1 C111 C112 -154.07(12) . . . . ?
C116 C111 C112 C113 0.9(3) . . . . ?
P1 C111 C112 C113 -179.44(14) . . . . ?
C111 C112 C113 C114 -0.8(3) . . . . ?
C112 C113 C114 C115 0.7(3) . . . . ?
C113 C114 C115 C116 -0.7(3) . . . . ?
C114 C115 C116 C111 0.7(3) . . . . ?
C112 C111 C116 C115 -0.8(2) . . . . ?
P1 C111 C116 C115 179.49(13) . . . . ?
C111 P1 C121 C126 165.72(15) . . . . ?
C131 P1 C121 C126 -84.78(17) . . . . ?
Au1 P1 C121 C126 32.85(17) . . . . ?
C111 P1 C121 C122 -16.96(19) . . . . ?
C131 P1 C121 C122 92.54(18) . . . . ?
Au1 P1 C121 C122 -149.83(16) . . . . ?
C126 C121 C122 C123 0.7(3) . . . . ?
P1 C121 C122 C123 -176.6(2) . . . . ?
C121 C122 C123 C124 -0.5(4) . . . . ?
C122 C123 C124 C125 0.0(4) . . . . ?
C123 C124 C125 C126 0.2(4) . . . . ?
C122 C121 C126 C125 -0.4(3) . . . . ?
P1 C121 C126 C125 177.0(2) . . . . ?
C124 C125 C126 C121 0.0(4) . . . . ?
C111 P1 C131 C132 100.25(15) . . . . ?
C121 P1 C131 C132 -10.80(16) . . . . ?
Au1 P1 C131 C132 -131.63(13) . . . . ?
C111 P1 C131 C136 -81.07(14) . . . . ?
C121 P1 C131 C136 167.88(13) . . . . ?
Au1 P1 C131 C136 47.05(14) . . . . ?
C136 C131 C132 C133 0.0(3) . . . . ?
P1 C131 C132 C133 178.62(14) . . . . ?
C131 C132 C133 C134 -0.4(3) . . . . ?
C132 C133 C134 C135 0.8(3) . . . . ?
C133 C134 C135 C136 -0.6(3) . . . . ?
C134 C135 C136 C131 0.2(3) . . . . ?
C132 C131 C136 C135 0.2(3) . . . . ?
P1 C131 C136 C135 -178.55(14) . . . . ?
P1 Au1 P2 C221 169.96(6) . . . . ?
Cl1 Au1 P2 C221 -17.92(6) . . . . ?
Au1 Au1 P2 C221 91.26(6) 2 . . . ?
P1 Au1 P2 C231 48.23(6) . . . . ?
Cl1 Au1 P2 C231 -139.65(6) . . . . ?
Au1 Au1 P2 C231 -30.48(6) 2 . . . ?
P1 Au1 P2 C211 -67.93(6) . . . . ?
Cl1 Au1 P2 C211 104.19(6) . . . . ?
Au1 Au1 P2 C211 -146.64(6) 2 . . . ?
C221 P2 C211 C216 -16.25(17) . . . . ?
C231 P2 C211 C216 94.05(16) . . . . ?
Au1 P2 C211 C216 -146.26(14) . . . . ?
C221 P2 C211 C212 160.84(14) . . . . ?
C231 P2 C211 C212 -88.86(15) . . . . ?
Au1 P2 C211 C212 30.83(15) . . . . ?
C216 C211 C212 C213 0.7(3) . . . . ?
P2 C211 C212 C213 -176.50(16) . . . . ?
C211 C212 C213 C214 -0.8(3) . . . . ?
C212 C213 C214 C215 -0.1(3) . . . . ?
C213 C214 C215 C216 1.0(3) . . . . ?
C212 C211 C216 C215 0.2(3) . . . . ?
P2 C211 C216 C215 177.30(15) . . . . ?
C214 C215 C216 C211 -1.1(3) . . . . ?
C231 P2 C221 C226 144.83(14) . . . . ?
C211 P2 C221 C226 -104.13(14) . . . . ?
Au1 P2 C221 C226 19.84(15) . . . . ?
C231 P2 C221 C222 -36.75(16) . . . . ?
C211 P2 C221 C222 74.28(16) . . . . ?
Au1 P2 C221 C222 -161.75(12) . . . . ?
C226 C221 C222 C223 0.8(3) . . . . ?
P2 C221 C222 C223 -177.56(15) . . . . ?
C221 C222 C223 C224 -0.6(3) . . . . ?
C222 C223 C224 C225 0.3(3) . . . . ?
C223 C224 C225 C226 -0.3(3) . . . . ?
C224 C225 C226 C221 0.6(3) . . . . ?
C222 C221 C226 C225 -0.8(3) . . . . ?
P2 C221 C226 C225 177.61(14) . . . . ?
C221 P2 C231 C232 110.8(2) . . . . ?
C211 P2 C231 C232 -0.4(2) . . . . ?
Au1 P2 C231 C232 -119.1(2) . . . . ?
C221 P2 C231 C236 -73.12(17) . . . . ?
C211 P2 C231 C236 175.67(16) . . . . ?
Au1 P2 C231 C236 57.03(17) . . . . ?
C236 C231 C232 C233 0.0(4) . . . . ?
P2 C231 C232 C233 176.1(3) . . . . ?
C231 C232 C233 C234 -1.0(5) . . . . ?
C232 C233 C234 C235 1.6(5) . . . . ?
C233 C234 C235 C236 -1.2(5) . . . . ?
C234 C235 C236 C231 0.2(4) . . . . ?
C232 C231 C236 C235 0.4(3) . . . . ?
P2 C231 C236 C235 -175.89(19) . . . . ?
