#------------------------------------------------------------------------------
#$Date: 2016-03-23 01:31:04 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179144 $
#$URL: svn://www.crystallography.net/cod/cif/4/31/05/4310506.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_4310506
loop_
_publ_author_name
'Yan-Dan Chen'
'Yong-Hai Qin'
'Li-Yi Zhang'
'Lin-Xi Shi'
'Zhong-Ning Chen'
_publ_contact_author
;
Zhong-Ning Chen
Fujian Institute of Research on the Structure of Matter, 
Chinese Academy of Sciences, Fuzhou, Fujian 350002, China.
;
_publ_contact_author_email       '  czn@ms.fjirsm.ac.cn '
_publ_section_title
;
 Luminescent Heterotrinuclear Complexes with Pt(diimine)(dithiolate) and
 Metal Diphosphine as Components
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              1197
_journal_page_last               1205
_journal_paper_doi               10.1021/ic034848a
_journal_volume                  43
_journal_year                    2004
_chemical_formula_sum            'C71 H61 Ag2 F12 N3 P4 Pt S2 Sb2'
_chemical_formula_weight         2026.56
_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                92.1060(10)
_cell_angle_beta                 106.10
_cell_angle_gamma                111.31
_cell_formula_units_Z            2
_cell_length_a                   12.9887(2)
_cell_length_b                   14.6457(2)
_cell_length_c                   22.38830(10)
_cell_measurement_reflns_used    7625
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      25.25
_cell_measurement_theta_min      .96
_cell_volume                     3766.82(8)
_computing_cell_refinement       'Siemens SMART & SAINT'
_computing_data_collection       'Siemens SMART'
_computing_data_reduction        'Siemens XPREP'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'Siemens SHELXTL'
_computing_structure_solution    'Siemens SHELXTL'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.962
_diffrn_measured_fraction_theta_max 0.962
_diffrn_measurement_device_type  'Siemens SMART CCD'
_diffrn_measurement_method       'phi and omega scans'
_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  0.0389
_diffrn_reflns_av_sigmaI/netI    0.0639
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            19544
_diffrn_reflns_theta_full        25.25
_diffrn_reflns_theta_max         25.25
_diffrn_reflns_theta_min         0.96
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  .
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    3.281
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  .6054
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   'SADABS (Sheldrick, 1996)'
_exptl_crystal_colour            'orange yellow'
_exptl_crystal_density_diffrn    1.787
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       cuboid
_exptl_crystal_F_000             1964
_exptl_crystal_size_max          .62
_exptl_crystal_size_mid          .24
_exptl_crystal_size_min          .22
_refine_diff_density_max         1.426
_refine_diff_density_min         -1.615
_refine_diff_density_rms         0.180
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.156
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     873
_refine_ls_number_reflns         13127
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.156
_refine_ls_R_factor_all          0.1071
_refine_ls_R_factor_gt           0.0687
_refine_ls_shift/su_max          0.005
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0571P)²+23.8148P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1439
_refine_ls_wR_factor_ref         0.1717
_reflns_number_gt                9489
_reflns_number_total             13127
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic034848asi20031125_072525_5.cif
_cod_data_source_block           6_(Compound9)
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_cell_volume        3766.99(8)
_cod_database_code               4310506
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
Pt Pt 0.54970(4) 0.57329(3) -0.39989(2) 0.04933(15) Uani 1 1 d . . .
Ag1 Ag 0.55480(8) 0.58497(7) -0.24082(5) 0.0553(3) Uani 0.95 1 d P . .
Ag1' Ag 0.5697(15) 0.6451(11) -0.2710(8) 0.045(4) Uani 0.05 1 d P . .
Ag2 Ag 0.66219(7) 0.46666(6) -0.29177(4) 0.0464(2) Uani 1 1 d . . .
Sb1 Sb 0.21504(9) 0.76233(7) 0.47201(5) 0.0821(3) Uani 1 1 d . . .
Sb2 Sb 0.77824(14) 0.97018(9) 0.15456(8) 0.1352(6) Uani 1 1 d . . .
S1 S 0.4103(3) 0.5609(3) -0.35455(16) 0.0649(8) Uani 1 1 d . . .
S2 S 0.5001(2) 0.4076(2) -0.40518(13) 0.0502(7) Uani 1 1 d . . .
P1 P 0.4701(3) 0.4455(2) -0.18668(14) 0.0493(7) Uani 1 1 d . . .
P2 P 0.5707(2) 0.31625(19) -0.24497(13) 0.0419(6) Uani 1 1 d . . .
P3 P 0.7277(3) 0.7407(2) -0.21123(15) 0.0568(8) Uani 1 1 d . . .
P4 P 0.8455(2) 0.61452(19) -0.25568(12) 0.0401(6) Uani 1 1 d . . .
F1 F 0.3391(10) 0.8798(7) 0.4779(6) 0.127(4) Uani 1 1 d . . .
F2 F 0.0919(11) 0.6476(8) 0.4716(7) 0.177(6) Uani 1 1 d . . .
F3 F 0.1328(11) 0.8336(9) 0.4862(8) 0.169(5) Uani 1 1 d . . .
F4 F 0.2751(11) 0.7738(9) 0.5588(6) 0.154(5) Uani 1 1 d . . .
F5 F 0.3001(14) 0.6938(8) 0.4574(10) 0.208(8) Uani 1 1 d . . .
F6 F 0.1663(18) 0.7519(17) 0.3919(8) 0.265(10) Uani 1 1 d . . .
F11 F 0.7781(16) 0.8934(10) 0.2182(9) 0.203(8) Uani 1 1 d . . .
F12 F 0.9044(14) 1.0747(9) 0.2030(7) 0.198(7) Uani 1 1 d . . .
F13 F 0.6543(19) 0.8654(16) 0.1060(13) 0.349(16) Uani 1 1 d . . .
F14 F 0.684(2) 1.0143(16) 0.1797(12) 0.284(12) Uani 1 1 d . . .
F15 F 0.7746(18) 1.0455(16) 0.0904(8) 0.278(12) Uani 1 1 d . . .
F16 F 0.876(2) 0.9233(13) 0.1317(10) 0.273(12) Uani 1 1 d . . .
N1 N 0.5980(9) 0.7234(7) -0.4047(5) 0.062(3) Uani 1 1 d . . .
N01 N 0.436(4) 0.765(2) -0.123(2) 0.31(2) Uani 1 1 d . . .
N2 N 0.6813(8) 0.5966(7) -0.4384(4) 0.053(2) Uani 1 1 d . . .
C1 C 0.3298(10) 0.4311(10) -0.3640(6) 0.061(3) Uani 1 1 d . . .
C2 C 0.3691(9) 0.3655(8) -0.3854(5) 0.052(3) Uani 1 1 d . . .
C02 C 0.483(4) 0.842(3) -0.096(2) 0.217(16) Uani 1 1 d . . .
C3 C 0.3008(11) 0.2627(9) -0.3941(5) 0.064(3) Uani 1 1 d . . .
H3A H 0.3248 0.2175 -0.4105 0.076 Uiso 1 1 calc R . .
C03 C 0.567(5) 0.943(3) -0.066(2) 0.41(4) Uani 1 1 d . . .
H03A H 0.5406 0.9677 -0.0354 0.613 Uiso 1 1 calc R . .
H03B H 0.5743 0.9862 -0.0972 0.613 Uiso 1 1 calc R . .
H03C H 0.6416 0.9410 -0.0455 0.613 Uiso 1 1 calc R . .
C4 C 0.1996(12) 0.2289(12) -0.3786(6) 0.080(4) Uani 1 1 d . . .
C5 C 0.1616(13) 0.2948(15) -0.3554(7) 0.091(5) Uani 1 1 d . . .
H5A H 0.0935 0.2723 -0.3444 0.110 Uiso 1 1 calc R . .
C6 C 0.2268(12) 0.3952(13) -0.3487(6) 0.079(4) Uani 1 1 d . . .
H6A H 0.2012 0.4401 -0.3334 0.095 Uiso 1 1 calc R . .
C7 C 0.1250(18) 0.1213(15) -0.3858(11) 0.155(10) Uani 1 1 d . . .
H7A H 0.1604 0.0822 -0.4010 0.233 Uiso 1 1 calc R . .
H7B H 0.0496 0.1077 -0.4151 0.233 Uiso 1 1 calc R . .
H7C H 0.1169 0.1050 -0.3457 0.233 Uiso 1 1 calc R . .
C11 C 0.5444(14) 0.7817(9) -0.3938(7) 0.079(4) Uani 1 1 d . . .
H11A H 0.4772 0.7558 -0.3823 0.095 Uiso 1 1 calc R . .
C12 C 0.591(2) 0.8831(13) -0.4001(9) 0.112(6) Uani 1 1 d . . .
H12A H 0.5522 0.9231 -0.3936 0.135 Uiso 1 1 calc R . .
C13 C 0.688(2) 0.9224(11) -0.4150(8) 0.109(7) Uani 1 1 d . . .
H13A H 0.7179 0.9898 -0.4175 0.131 Uiso 1 1 calc R . .
C14 C 0.7440(15) 0.8633(10) -0.4268(7) 0.083(5) Uani 1 1 d . . .
C15 C 0.848(2) 0.8966(13) -0.4444(8) 0.112(7) Uani 1 1 d . . .
H15A H 0.8832 0.9636 -0.4466 0.134 Uiso 1 1 calc R . .
C16 C 0.8954(15) 0.8346(15) -0.4580(8) 0.108(7) Uani 1 1 d . . .
H16A H 0.9653 0.8601 -0.4669 0.129 Uiso 1 1 calc R . .
C17 C 0.8402(13) 0.7278(11) -0.4590(6) 0.075(4) Uani 1 1 d . . .
C18 C 0.8766(12) 0.6587(14) -0.4793(6) 0.086(5) Uani 1 1 d . . .
H18A H 0.9422 0.6790 -0.4926 0.104 Uiso 1 1 calc R . .
C19 C 0.8155(13) 0.5587(13) -0.4799(6) 0.080(4) Uani 1 1 d . . .
H19A H 0.8378 0.5109 -0.4945 0.096 Uiso 1 1 calc R . .
C20 C 0.7187(11) 0.5316(10) -0.4577(5) 0.064(3) Uani 1 1 d . . .
H20A H 0.6792 0.4649 -0.4565 0.076 Uiso 1 1 calc R . .
C21 C 0.7406(10) 0.6946(9) -0.4393(5) 0.058(3) Uani 1 1 d . . .
C22 C 0.6956(12) 0.7633(10) -0.4221(5) 0.066(4) Uani 1 1 d . . .
C110 C 0.4458(9) 0.3220(8) -0.2241(5) 0.047(3) Uani 1 1 d . . .
H11B H 0.4266 0.2748 -0.1957 0.056 Uiso 1 1 calc R . .
H11C H 0.3793 0.3019 -0.2619 0.056 Uiso 1 1 calc R . .
C111 C 0.3258(11) 0.4362(10) -0.1887(5) 0.062(3) Uani 1 1 d . . .
C112 C 0.3021(14) 0.5214(11) -0.1933(6) 0.078(4) Uani 1 1 d . . .
H11D H 0.3605 0.5810 -0.1941 0.094 Uiso 1 1 calc R . .
C113 C 0.1929(17) 0.5189(16) -0.1967(7) 0.097(6) Uani 1 1 d . . .
H11E H 0.1779 0.5762 -0.2008 0.116 Uiso 1 1 calc R . .
C114 C 0.1088(17) 0.434(2) -0.1943(9) 0.122(8) Uani 1 1 d . . .
H11F H 0.0366 0.4323 -0.1944 0.147 Uiso 1 1 calc R . .
C115 C 0.1308(15) 0.3479(16) -0.1916(10) 0.116(7) Uani 1 1 d . . .
H11G H 0.0711 0.2881 -0.1927 0.139 Uiso 1 1 calc R . .
C116 C 0.2394(14) 0.3493(12) -0.1873(8) 0.093(5) Uani 1 1 d . . .
H11H H 0.2536 0.2917 -0.1834 0.112 Uiso 1 1 calc R . .
C120 C 0.8305(10) 0.7347(7) -0.2516(5) 0.049(3) Uani 1 1 d . . .
H12B H 0.9063 0.7863 -0.2300 0.059 Uiso 1 1 calc R . .
H12C H 0.8054 0.7486 -0.2940 0.059 Uiso 1 1 calc R . .
C121 C 0.5474(12) 0.4514(10) -0.1041(6) 0.062(3) Uani 1 1 d . . .
C122 C 0.4936(15) 0.3893(14) -0.0664(7) 0.098(5) Uani 1 1 d . . .
H12D H 0.4172 0.3436 -0.0833 0.118 Uiso 1 1 calc R . .
C123 C 0.554(2) 0.3959(18) -0.0043(9) 0.124(7) Uani 1 1 d . . .
H12E H 0.5176 0.3559 0.0212 0.149 Uiso 1 1 calc R . .
C124 C 0.667(2) 0.461(2) 0.0202(8) 0.125(8) Uani 1 1 d . . .
H12F H 0.7077 0.4640 0.0620 0.149 Uiso 1 1 calc R . .
C125 C 0.7178(18) 0.5193(18) -0.0161(10) 0.127(7) Uani 1 1 d . . .
H12G H 0.7949 0.5632 0.0010 0.152 Uiso 1 1 calc R . .
C126 C 0.6599(13) 0.5166(13) -0.0776(7) 0.098(5) Uani 1 1 d . . .
H12H H 0.6974 0.5594 -0.1016 0.118 Uiso 1 1 calc R . .
C131 C 0.5039(9) 0.2004(7) -0.3011(5) 0.044(2) Uani 1 1 d . . .
C132 C 0.5409(11) 0.1944(9) -0.3524(6) 0.060(3) Uani 1 1 d . . .
H13B H 0.6029 0.2473 -0.3575 0.072 Uiso 1 1 calc R . .
C133 C 0.4849(15) 0.1083(12) -0.3968(7) 0.086(5) Uani 1 1 d . . .
H13C H 0.5079 0.1043 -0.4322 0.103 Uiso 1 1 calc R . .
C134 C 0.3968(14) 0.0308(11) -0.3880(8) 0.088(5) Uani 1 1 d . . .
H13D H 0.3602 -0.0266 -0.4176 0.105 Uiso 1 1 calc R . .
C135 C 0.3611(12) 0.0355(10) -0.3368(8) 0.082(4) Uani 1 1 d . . .
H13E H 0.3001 -0.0184 -0.3317 0.099 Uiso 1 1 calc R . .
C136 C 0.4148(10) 0.1199(8) -0.2922(6) 0.057(3) Uani 1 1 d . . .
H13F H 0.3915 0.1227 -0.2567 0.068 Uiso 1 1 calc R . .
C141 C 0.6590(10) 0.2828(8) -0.1780(5) 0.053(3) Uani 1 1 d . . .
C142 C 0.7675(12) 0.2911(12) -0.1780(7) 0.087(4) Uani 1 1 d . . .
H14A H 0.7954 0.3188 -0.2099 0.105 Uiso 1 1 calc R . .
C143 C 0.8368(16) 0.2593(15) -0.1320(10) 0.110(6) Uani 1 1 d . . .
H14B H 0.9094 0.2644 -0.1334 0.132 Uiso 1 1 calc R . .
C144 C 0.7981(19) 0.2215(15) -0.0856(9) 0.107(6) Uani 1 1 d . . .
H14C H 0.8452 0.2013 -0.0542 0.129 Uiso 1 1 calc R . .
C145 C 0.6926(18) 0.2118(13) -0.0829(8) 0.103(5) Uani 1 1 d . . .
H14D H 0.6670 0.1850 -0.0501 0.124 Uiso 1 1 calc R . .
C146 C 0.6210(13) 0.2426(11) -0.1302(7) 0.078(4) Uani 1 1 d . . .
H14E H 0.5476 0.2355 -0.1289 0.093 Uiso 1 1 calc R . .
C151 C 0.8082(11) 0.7817(8) -0.1273(6) 0.057(3) Uani 1 1 d . . .
C152 C 0.7456(15) 0.7613(13) -0.0867(8) 0.101(5) Uani 1 1 d . . .
H15B H 0.6665 0.7220 -0.1021 0.122 Uiso 1 1 calc R . .
C153 C 0.796(2) 0.7976(16) -0.0216(9) 0.126(7) Uani 1 1 d . . .
H15C H 0.7507 0.7870 0.0050 0.151 Uiso 1 1 calc R . .
C154 C 0.9135(16) 0.8484(12) 0.0012(7) 0.093(5) Uani 1 1 d . . .
H15D H 0.9501 0.8700 0.0442 0.112 Uiso 1 1 calc R . .
C155 C 0.9756(14) 0.8671(11) -0.0390(7) 0.084(4) Uani 1 1 d . . .
H15E H 1.0553 0.9041 -0.0234 0.100 Uiso 1 1 calc R . .
C156 C 0.9256(11) 0.8334(10) -0.1030(6) 0.065(3) Uani 1 1 d . . .
H15F H 0.9717 0.8458 -0.1293 0.077 Uiso 1 1 calc R . .
C161 C 0.7005(14) 0.8502(10) -0.2314(7) 0.080(4) Uani 1 1 d . . .
C162 C 0.5924(16) 0.8501(14) -0.2366(8) 0.103(6) Uani 1 1 d . . .
H16B H 0.5331 0.7917 -0.2349 0.124 Uiso 1 1 calc R . .
C163 C 0.570(2) 0.9359(19) -0.2443(11) 0.146(9) Uani 1 1 d . . .
H16C H 0.4984 0.9373 -0.2464 0.176 Uiso 1 1 calc R . .
C164 C 0.659(3) 1.0170(14) -0.2487(11) 0.137(9) Uani 1 1 d . . .
H16D H 0.6453 1.0747 -0.2536 0.164 Uiso 1 1 calc R . .
C165 C 0.765(2) 1.0218(19) -0.2468(11) 0.145(9) Uiso 1 1 d . . .
H16E H 0.8209 1.0794 -0.2520 0.174 Uiso 1 1 calc R . .
C166 C 0.7871(18) 0.9343(12) -0.2363(8) 0.107(6) Uani 1 1 d . . .
H16F H 0.8602 0.9346 -0.2329 0.129 Uiso 1 1 calc R . .
C171 C 0.9383(8) 0.6162(7) -0.1769(4) 0.038(2) Uani 1 1 d . . .
C172 C 0.8954(11) 0.5489(10) -0.1414(6) 0.076(4) Uani 1 1 d . . .
H17A H 0.8188 0.5032 -0.1569 0.091 Uiso 1 1 calc R . .
C173 C 0.9641(15) 0.5466(13) -0.0817(8) 0.098(5) Uiso 1 1 d . . .
H17B H 0.9331 0.4998 -0.0578 0.118 Uiso 1 1 calc R . .
C174 C 1.0762(12) 0.6127(10) -0.0585(6) 0.076(4) Uani 1 1 d . . .
H17C H 1.1225 0.6106 -0.0190 0.091 Uiso 1 1 calc R . .
C175 C 1.1205(12) 0.6822(12) -0.0936(6) 0.080(4) Uani 1 1 d . . .
H17D H 1.1968 0.7282 -0.0776 0.097 Uiso 1 1 calc R . .
C176 C 1.0527(10) 0.6846(9) -0.1524(5) 0.059(3) Uani 1 1 d . . .
H17E H 1.0836 0.7323 -0.1759 0.071 Uiso 1 1 calc R . .
C181 C 0.9432(10) 0.6251(8) -0.3020(5) 0.049(3) Uani 1 1 d . . .
C182 C 0.9447(11) 0.5380(9) -0.3271(5) 0.056(3) Uani 1 1 d . . .
H18B H 0.8899 0.4777 -0.3241 0.067 Uiso 1 1 calc R . .
C183 C 1.0250(12) 0.5383(11) -0.3562(6) 0.070(4) Uani 1 1 d . . .
H18C H 1.0251 0.4788 -0.3720 0.084 Uiso 1 1 calc R . .
C184 C 1.1026(14) 0.6241(15) -0.3617(7) 0.090(5) Uani 1 1 d . . .
H18D H 1.1568 0.6237 -0.3814 0.107 Uiso 1 1 calc R . .
C185 C 1.1043(14) 0.7145(14) -0.3386(7) 0.097(5) Uani 1 1 d . . .
H18E H 1.1584 0.7740 -0.3432 0.116 Uiso 1 1 calc R . .
C186 C 1.0241(12) 0.7145(9) -0.3085(6) 0.069(4) Uani 1 1 d . . .
H18F H 1.0244 0.7743 -0.2926 0.083 Uiso 1 1 calc R . .
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'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 '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'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Sb Sb -0.5866 1.5461 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pt Pt -1.7033 8.3905 '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
N2 Pt N1 79.9(4) . . ?
N2 Pt S2 95.1(3) . . ?
N1 Pt S2 173.6(3) . . ?
N2 Pt S1 175.4(3) . . ?
N1 Pt S1 95.7(3) . . ?
S2 Pt S1 89.32(12) . . ?
N2 Pt Ag1' 127.6(4) . . ?
N1 Pt Ag1' 80.6(4) . . ?
S2 Pt Ag1' 105.7(3) . . ?
S1 Pt Ag1' 49.5(3) . . ?
N2 Pt Ag2 91.8(2) . . ?
N1 Pt Ag2 128.6(3) . . ?
S2 Pt Ag2 55.12(7) . . ?
S1 Pt Ag2 89.66(8) . . ?
Ag1' Pt Ag2 64.8(3) . . ?
Ag1' Ag1 P3 56.1(9) . . ?
Ag1' Ag1 P1 165.6(9) . . ?
P3 Ag1 P1 135.68(11) . . ?
Ag1' Ag1 S1 58.8(9) . . ?
P3 Ag1 S1 114.80(11) . . ?
P1 Ag1 S1 109.30(11) . . ?
Ag1' Ag1 Ag2 98.5(8) . . ?
P3 Ag1 Ag2 95.74(8) . . ?
P1 Ag1 Ag2 88.91(7) . . ?
S1 Ag1 Ag2 89.20(8) . . ?
Ag1 Ag1' P3 96.8(11) . . ?
Ag1 Ag1' S1 96.1(10) . . ?
P3 Ag1' S1 166.2(9) . . ?
Ag1 Ag1' Pt 113.2(9) . . ?
P3 Ag1' Pt 119.9(7) . . ?
S1 Ag1' Pt 49.5(3) . . ?
Ag1 Ag1' Ag2 61.9(7) . . ?
P3 Ag1' Ag2 94.3(5) . . ?
S1 Ag1' Ag2 87.5(5) . . ?
Pt Ag1' Ag2 61.7(3) . . ?
P4 Ag2 P2 134.69(9) . . ?
P4 Ag2 S2 129.04(9) . . ?
P2 Ag2 S2 96.04(9) . . ?
P4 Ag2 Ag1 87.11(7) . . ?
P2 Ag2 Ag1 94.06(7) . . ?
S2 Ag2 Ag1 94.99(7) . . ?
P4 Ag2 Pt 91.32(6) . . ?
P2 Ag2 Pt 131.41(7) . . ?
S2 Ag2 Pt 43.85(6) . . ?
Ag1 Ag2 Pt 69.71(3) . . ?
P4 Ag2 Ag1' 77.9(3) . . ?
P2 Ag2 Ag1' 112.9(3) . . ?
S2 Ag2 Ag1' 87.5(3) . . ?
Ag1 Ag2 Ag1' 19.6(3) . . ?
Pt Ag2 Ag1' 53.5(3) . . ?
F6 Sb1 F3 95.1(10) . . ?
F6 Sb1 F5 84.6(10) . . ?
F3 Sb1 F5 178.5(6) . . ?
F6 Sb1 F2 91.8(8) . . ?
F3 Sb1 F2 88.9(6) . . ?
F5 Sb1 F2 92.6(6) . . ?
F6 Sb1 F1 91.7(8) . . ?
F3 Sb1 F1 89.2(5) . . ?
F5 Sb1 F1 89.3(5) . . ?
F2 Sb1 F1 176.2(5) . . ?
F6 Sb1 F4 177.1(9) . . ?
F3 Sb1 F4 87.3(7) . . ?
F5 Sb1 F4 93.0(8) . . ?
F2 Sb1 F4 89.8(6) . . ?
F1 Sb1 F4 86.8(5) . . ?
F14 Sb2 F13 90.0(12) . . ?
F14 Sb2 F12 90.9(11) . . ?
F13 Sb2 F12 179.1(11) . . ?
F14 Sb2 F16 177.7(10) . . ?
F13 Sb2 F16 90.5(11) . . ?
F12 Sb2 F16 88.5(9) . . ?
F14 Sb2 F15 90.1(10) . . ?
F13 Sb2 F15 92.2(11) . . ?
F12 Sb2 F15 87.9(8) . . ?
F16 Sb2 F15 92.1(10) . . ?
F14 Sb2 F11 89.1(7) . . ?
F13 Sb2 F11 86.7(10) . . ?
F12 Sb2 F11 93.3(8) . . ?
F16 Sb2 F11 88.8(8) . . ?
F15 Sb2 F11 178.6(8) . . ?
C1 S1 Ag1' 123.2(6) . . ?
C1 S1 Pt 103.8(4) . . ?
Ag1' S1 Pt 81.0(4) . . ?
C1 S1 Ag1 98.8(4) . . ?
Ag1' S1 Ag1 25.1(4) . . ?
Pt S1 Ag1 92.23(11) . . ?
C2 S2 Pt 103.8(4) . . ?
C2 S2 Ag2 102.2(4) . . ?
Pt S2 Ag2 81.03(9) . . ?
C111 P1 C121 105.5(6) . . ?
C111 P1 C110 104.1(5) . . ?
C121 P1 C110 104.3(5) . . ?
C111 P1 Ag1 108.9(4) . . ?
C121 P1 Ag1 117.7(5) . . ?
C110 P1 Ag1 115.1(4) . . ?
C141 P2 C131 101.5(5) . . ?
C141 P2 C110 107.3(5) . . ?
C131 P2 C110 102.2(5) . . ?
C141 P2 Ag2 120.1(4) . . ?
C131 P2 Ag2 113.3(4) . . ?
C110 P2 Ag2 110.6(4) . . ?
C161 P3 C120 105.1(7) . . ?
C161 P3 C151 100.0(6) . . ?
C120 P3 C151 107.7(5) . . ?
C161 P3 Ag1' 93.6(7) . . ?
C120 P3 Ag1' 103.3(6) . . ?
C151 P3 Ag1' 141.4(6) . . ?
C161 P3 Ag1 115.2(5) . . ?
C120 P3 Ag1 110.3(4) . . ?
C151 P3 Ag1 117.4(4) . . ?
Ag1' P3 Ag1 27.0(4) . . ?
C181 P4 C171 101.4(5) . . ?
C181 P4 C120 105.5(5) . . ?
C171 P4 C120 104.5(5) . . ?
C181 P4 Ag2 114.6(4) . . ?
C171 P4 Ag2 113.5(3) . . ?
C120 P4 Ag2 115.8(4) . . ?
C11 N1 C22 118.9(11) . . ?
C11 N1 Pt 127.8(10) . . ?
C22 N1 Pt 113.3(8) . . ?
C20 N2 C21 118.3(11) . . ?
C20 N2 Pt 128.9(8) . . ?
C21 N2 Pt 112.6(8) . . ?
C2 C1 C6 119.3(13) . . ?
C2 C1 S1 120.5(9) . . ?
C6 C1 S1 120.1(11) . . ?
C1 C2 C3 118.9(11) . . ?
C1 C2 S2 121.0(9) . . ?
C3 C2 S2 120.1(10) . . ?
N01 C02 C03 166(6) . . ?
C4 C3 C2 120.8(14) . . ?
C4 C3 H3A 119.6 . . ?
C2 C3 H3A 119.6 . . ?
C02 C03 H03A 109.5 . . ?
C02 C03 H03B 109.5 . . ?
H03A C03 H03B 109.5 . . ?
C02 C03 H03C 109.5 . . ?
H03A C03 H03C 109.5 . . ?
H03B C03 H03C 109.5 . . ?
C3 C4 C5 120.4(15) . . ?
C3 C4 C7 123.2(18) . . ?
C5 C4 C7 116.4(17) . . ?
C4 C5 C6 118.6(15) . . ?
C4 C5 H5A 120.7 . . ?
C6 C5 H5A 120.7 . . ?
C5 C6 C1 121.9(15) . . ?
C5 C6 H6A 119.0 . . ?
C1 C6 H6A 119.0 . . ?
C4 C7 H7A 109.5 . . ?
C4 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
C4 C7 H7C 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
N1 C11 C12 119.3(16) . . ?
N1 C11 H11A 120.3 . . ?
C12 C11 H11A 120.3 . . ?
C13 C12 C11 121.7(19) . . ?
C13 C12 H12A 119.1 . . ?
C11 C12 H12A 119.1 . . ?
C12 C13 C14 119.8(16) . . ?
C12 C13 H13A 120.1 . . ?
C14 C13 H13A 120.1 . . ?
C13 C14 C22 117.8(17) . . ?
C13 C14 C15 125.0(16) . . ?
C22 C14 C15 117.2(17) . . ?
C16 C15 C14 122.2(17) . . ?
C16 C15 H15A 118.9 . . ?
C14 C15 H15A 118.9 . . ?
C15 C16 C17 121.6(18) . . ?
C15 C16 H16A 119.2 . . ?
C17 C16 H16A 119.2 . . ?
C18 C17 C21 118.6(14) . . ?
C18 C17 C16 124.8(17) . . ?
C21 C17 C16 116.6(16) . . ?
C17 C18 C19 119.9(14) . . ?
C17 C18 H18A 120.1 . . ?
C19 C18 H18A 120.1 . . ?
C18 C19 C20 118.1(15) . . ?
C18 C19 H19A 121.0 . . ?
C20 C19 H19A 121.0 . . ?
N2 C20 C19 123.1(13) . . ?
N2 C20 H20A 118.4 . . ?
C19 C20 H20A 118.4 . . ?
N2 C21 C17 122.0(13) . . ?
N2 C21 C22 117.8(12) . . ?
C17 C21 C22 120.2(12) . . ?
N1 C22 C14 122.4(14) . . ?
N1 C22 C21 115.5(11) . . ?
C14 C22 C21 121.9(15) . . ?
P2 C110 P1 114.2(6) . . ?
P2 C110 H11B 108.7 . . ?
P1 C110 H11B 108.7 . . ?
P2 C110 H11C 108.7 . . ?
P1 C110 H11C 108.7 . . ?
H11B C110 H11C 107.6 . . ?
C116 C111 C112 118.8(13) . . ?
C116 C111 P1 123.1(11) . . ?
C112 C111 P1 118.1(12) . . ?
C113 C112 C111 121.0(16) . . ?
C113 C112 H11D 119.5 . . ?
C111 C112 H11D 119.5 . . ?
C114 C113 C112 120.0(17) . . ?
C114 C113 H11E 120.0 . . ?
C112 C113 H11E 120.0 . . ?
C113 C114 C115 119.2(16) . . ?
C113 C114 H11F 120.4 . . ?
C115 C114 H11F 120.4 . . ?
C116 C115 C114 121.5(18) . . ?
C116 C115 H11G 119.3 . . ?
C114 C115 H11G 119.3 . . ?
C111 C116 C115 119.4(16) . . ?
C111 C116 H11H 120.3 . . ?
C115 C116 H11H 120.3 . . ?
P3 C120 P4 114.2(6) . . ?
P3 C120 H12B 108.7 . . ?
P4 C120 H12B 108.7 . . ?
P3 C120 H12C 108.7 . . ?
P4 C120 H12C 108.7 . . ?
H12B C120 H12C 107.6 . . ?
C126 C121 C122 118.2(14) . . ?
C126 C121 P1 120.7(11) . . ?
C122 C121 P1 121.1(11) . . ?
C123 C122 C121 119.7(18) . . ?
C123 C122 H12D 120.2 . . ?
C121 C122 H12D 120.2 . . ?
C124 C123 C122 120(2) . . ?
C124 C123 H12E 119.8 . . ?
C122 C123 H12E 119.8 . . ?
C125 C124 C123 119.6(19) . . ?
C125 C124 H12F 120.2 . . ?
C123 C124 H12F 120.2 . . ?
C124 C125 C126 122(2) . . ?
C124 C125 H12G 119.1 . . ?
C126 C125 H12G 119.1 . . ?
C121 C126 C125 120.3(18) . . ?
C121 C126 H12H 119.9 . . ?
C125 C126 H12H 119.9 . . ?
C132 C131 C136 120.1(10) . . ?
C132 C131 P2 119.9(9) . . ?
C136 C131 P2 120.0(8) . . ?
C131 C132 C133 119.5(12) . . ?
C131 C132 H13B 120.2 . . ?
C133 C132 H13B 120.2 . . ?
C134 C133 C132 119.8(14) . . ?
C134 C133 H13C 120.1 . . ?
C132 C133 H13C 120.1 . . ?
C133 C134 C135 121.1(13) . . ?
C133 C134 H13D 119.5 . . ?
C135 C134 H13D 119.5 . . ?
C134 C135 C136 120.3(13) . . ?
C134 C135 H13E 119.8 . . ?
C136 C135 H13E 119.8 . . ?
C135 C136 C131 119.2(12) . . ?
C135 C136 H13F 120.4 . . ?
C131 C136 H13F 120.4 . . ?
C146 C141 C142 117.7(12) . . ?
C146 C141 P2 124.3(10) . . ?
C142 C141 P2 117.8(10) . . ?
C141 C142 C143 121.9(16) . . ?
C141 C142 H14A 119.1 . . ?
C143 C142 H14A 119.1 . . ?
C144 C143 C142 119.2(17) . . ?
C144 C143 H14B 120.4 . . ?
C142 C143 H14B 120.4 . . ?
C143 C144 C145 121.6(17) . . ?
C143 C144 H14C 119.2 . . ?
C145 C144 H14C 119.2 . . ?
C144 C145 C146 119.4(17) . . ?
C144 C145 H14D 120.3 . . ?
C146 C145 H14D 120.3 . . ?
C141 C146 C145 120.2(15) . . ?
C141 C146 H14E 119.9 . . ?
C145 C146 H14E 119.9 . . ?
C152 C151 C156 117.9(13) . . ?
C152 C151 P3 117.1(11) . . ?
C156 C151 P3 124.9(10) . . ?
C151 C152 C153 122.2(16) . . ?
C151 C152 H15B 118.9 . . ?
C153 C152 H15B 118.9 . . ?
C154 C153 C152 118.3(17) . . ?
C154 C153 H15C 120.8 . . ?
C152 C153 H15C 120.8 . . ?
C155 C154 C153 119.1(15) . . ?
C155 C154 H15D 120.4 . . ?
C153 C154 H15D 120.4 . . ?
C154 C155 C156 122.5(15) . . ?
C154 C155 H15E 118.8 . . ?
C156 C155 H15E 118.8 . . ?
C151 C156 C155 119.7(13) . . ?
C151 C156 H15F 120.1 . . ?
C155 C156 H15F 120.1 . . ?
C166 C161 C162 120.0(14) . . ?
C166 C161 P3 121.4(13) . . ?
C162 C161 P3 118.4(13) . . ?
C161 C162 C163 121(2) . . ?
C161 C162 H16B 119.5 . . ?
C163 C162 H16B 119.5 . . ?
C164 C163 C162 116(2) . . ?
C164 C163 H16C 121.8 . . ?
C162 C163 H16C 121.8 . . ?
C165 C164 C163 126(2) . . ?
C165 C164 H16D 117.0 . . ?
C163 C164 H16D 117.0 . . ?
C164 C165 C166 117(2) . . ?
C164 C165 H16E 121.6 . . ?
C166 C165 H16E 121.6 . . ?
C161 C166 C165 120(2) . . ?
C161 C166 H16F 120.2 . . ?
C165 C166 H16F 120.2 . . ?
C172 C171 C176 118.5(10) . . ?
C172 C171 P4 119.4(8) . . ?
C176 C171 P4 122.1(8) . . ?
C171 C172 C173 121.0(12) . . ?
C171 C172 H17A 119.5 . . ?
C173 C172 H17A 119.5 . . ?
C174 C173 C172 120.1(15) . . ?
C174 C173 H17B 119.9 . . ?
C172 C173 H17B 119.9 . . ?
C173 C174 C175 119.6(13) . . ?
C173 C174 H17C 120.2 . . ?
C175 C174 H17C 120.2 . . ?
C174 C175 C176 120.4(13) . . ?
C174 C175 H17D 119.8 . . ?
C176 C175 H17D 119.8 . . ?
C175 C176 C171 120.4(11) . . ?
C175 C176 H17E 119.8 . . ?
C171 C176 H17E 119.8 . . ?
C182 C181 C186 118.0(11) . . ?
C182 C181 P4 117.3(9) . . ?
C186 C181 P4 124.3(9) . . ?
C183 C182 C181 121.8(12) . . ?
C183 C182 H18B 119.1 . . ?
C181 C182 H18B 119.1 . . ?
C184 C183 C182 119.8(14) . . ?
C184 C183 H18C 120.1 . . ?
C182 C183 H18C 120.1 . . ?
C183 C184 C185 121.3(15) . . ?
C183 C184 H18D 119.3 . . ?
C185 C184 H18D 119.3 . . ?
C186 C185 C184 119.0(15) . . ?
C186 C185 H18E 120.5 . . ?
C184 C185 H18E 120.5 . . ?
C185 C186 C181 120.1(13) . . ?
C185 C186 H18F 120.0 . . ?
C181 C186 H18F 120.0 . . ?
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
Pt N2 2.049(10) . ?
Pt N1 2.071(10) . ?
Pt S2 2.263(3) . ?
Pt S1 2.266(3) . ?
Pt Ag1' 2.943(16) . ?
Pt Ag2 3.2261(9) . ?
Ag1 Ag1' 1.124(16) . ?
Ag1 P3 2.455(3) . ?
Ag1 P1 2.477(3) . ?
Ag1 S1 2.633(3) . ?
Ag1 Ag2 2.9567(12) . ?
Ag1' P3 2.053(17) . ?
Ag1' S1 2.265(18) . ?
Ag1' Ag2 3.315(14) . ?
Ag2 P4 2.464(3) . ?
Ag2 P2 2.514(3) . ?
Ag2 S2 2.679(3) . ?
Sb1 F6 1.709(17) . ?
Sb1 F3 1.819(10) . ?
Sb1 F5 1.822(11) . ?
Sb1 F2 1.849(10) . ?
Sb1 F1 1.851(9) . ?
Sb1 F4 1.858(12) . ?
Sb2 F14 1.776(17) . ?
Sb2 F13 1.801(17) . ?
Sb2 F12 1.810(12) . ?
Sb2 F16 1.823(17) . ?
Sb2 F15 1.844(17) . ?
Sb2 F11 1.847(14) . ?
S1 C1 1.776(13) . ?
S2 C2 1.774(11) . ?
P1 C111 1.818(13) . ?
P1 C121 1.825(12) . ?
P1 C110 1.844(10) . ?
P2 C141 1.821(11) . ?
P2 C131 1.838(10) . ?
P2 C110 1.838(10) . ?
P3 C161 1.809(13) . ?
P3 C120 1.832(12) . ?
P3 C151 1.833(12) . ?
P4 C181 1.818(11) . ?
P4 C171 1.832(9) . ?
P4 C120 1.842(10) . ?
N1 C11 1.334(16) . ?
N1 C22 1.361(17) . ?
N01 C02 1.13(4) . ?
N2 C20 1.322(15) . ?
N2 C21 1.364(14) . ?
C1 C2 1.367(17) . ?
C1 C6 1.394(18) . ?
C2 C3 1.415(16) . ?
C02 C03 1.47(5) . ?
C3 C4 1.374(18) . ?
C3 H3A 0.9300 . ?
C03 H03A 0.9600 . ?
C03 H03B 0.9600 . ?
C03 H03C 0.9600 . ?
C4 C5 1.38(2) . ?
C4 C7 1.49(2) . ?
C5 C6 1.38(2) . ?
C5 H5A 0.9300 . ?
C6 H6A 0.9300 . ?
C7 H7A 0.9600 . ?
C7 H7B 0.9600 . ?
C7 H7C 0.9600 . ?
C11 C12 1.42(2) . ?
C11 H11A 0.9300 . ?
C12 C13 1.32(3) . ?
C12 H12A 0.9300 . ?
C13 C14 1.38(2) . ?
C13 H13A 0.9300 . ?
C14 C22 1.389(18) . ?
C14 C15 1.43(3) . ?
C15 C16 1.34(3) . ?
C15 H15A 0.9300 . ?
C16 C17 1.46(2) . ?
C16 H16A 0.9300 . ?
C17 C18 1.37(2) . ?
C17 C21 1.408(19) . ?
C18 C19 1.39(2) . ?
C18 H18A 0.9300 . ?
C19 C20 1.410(18) . ?
C19 H19A 0.9300 . ?
C20 H20A 0.9300 . ?
C21 C22 1.424(18) . ?
C110 H11B 0.9700 . ?
C110 H11C 0.9700 . ?
C111 C116 1.365(19) . ?
C111 C112 1.390(18) . ?
C112 C113 1.39(2) . ?
C112 H11D 0.9300 . ?
C113 C114 1.34(3) . ?
C113 H11E 0.9300 . ?
C114 C115 1.39(3) . ?
C114 H11F 0.9300 . ?
C115 C116 1.38(2) . ?
C115 H11G 0.9300 . ?
C116 H11H 0.9300 . ?
C120 H12B 0.9700 . ?
C120 H12C 0.9700 . ?
C121 C126 1.365(19) . ?
C121 C122 1.40(2) . ?
C122 C123 1.37(2) . ?
C122 H12D 0.9300 . ?
C123 C124 1.36(3) . ?
C123 H12E 0.9300 . ?
C124 C125 1.33(3) . ?
C124 H12F 0.9300 . ?
C125 C126 1.37(2) . ?
C125 H12G 0.9300 . ?
C126 H12H 0.9300 . ?
C131 C132 1.374(15) . ?
C131 C136 1.386(15) . ?
C132 C133 1.395(18) . ?
C132 H13B 0.9300 . ?
C133 C134 1.35(2) . ?
C133 H13C 0.9300 . ?
C134 C135 1.36(2) . ?
C134 H13D 0.9300 . ?
C135 C136 1.381(17) . ?
C135 H13E 0.9300 . ?
C136 H13F 0.9300 . ?
C141 C146 1.364(17) . ?
C141 C142 1.370(17) . ?
C142 C143 1.38(2) . ?
C142 H14A 0.9300 . ?
C143 C144 1.33(2) . ?
C143 H14B 0.9300 . ?
C144 C145 1.34(2) . ?
C144 H14C 0.9300 . ?
C145 C146 1.41(2) . ?
C145 H14D 0.9300 . ?
C146 H14E 0.9300 . ?
C151 C152 1.353(19) . ?
C151 C156 1.365(17) . ?
C152 C153 1.41(2) . ?
C152 H15B 0.9300 . ?
C153 C154 1.36(2) . ?
C153 H15C 0.9300 . ?
C154 C155 1.34(2) . ?
C154 H15D 0.9300 . ?
C155 C156 1.384(18) . ?
C155 H15E 0.9300 . ?
C156 H15F 0.9300 . ?
C161 C166 1.37(2) . ?
C161 C162 1.38(2) . ?
C162 C163 1.39(2) . ?
C162 H16B 0.9300 . ?
C163 C164 1.35(3) . ?
C163 H16C 0.9300 . ?
C164 C165 1.34(3) . ?
C164 H16D 0.9300 . ?
C165 C166 1.43(3) . ?
C165 H16E 0.9300 . ?
C166 H16F 0.9300 . ?
C171 C172 1.350(15) . ?
C171 C176 1.393(14) . ?
C172 C173 1.394(19) . ?
C172 H17A 0.9300 . ?
C173 C174 1.36(2) . ?
C173 H17B 0.9300 . ?
C174 C175 1.366(19) . ?
C174 H17C 0.9300 . ?
C175 C176 1.376(16) . ?
C175 H17D 0.9300 . ?
C176 H17E 0.9300 . ?
C181 C182 1.383(15) . ?
C181 C186 1.393(16) . ?
C182 C183 1.375(17) . ?
C182 H18B 0.9300 . ?
C183 C184 1.33(2) . ?
C183 H18C 0.9300 . ?
C184 C185 1.40(2) . ?
C184 H18D 0.9300 . ?
C185 C186 1.39(2) . ?
C185 H18E 0.9300 . ?
C186 H18F 0.9300 . ?
