#------------------------------------------------------------------------------
#$Date: 2018-01-29 18:13:51 +0200 (Mon, 29 Jan 2018) $
#$Revision: 205839 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/06/10/4061004.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_4061004
loop_
_publ_author_name
'Owen, Gareth R.'
'Stahl, Jürgen'
'Hampel, Frank'
'Gladysz, J. A.'
_publ_section_title
;
 Syntheses and Structures of Diplatinum Hexatriynediyl Complexes, in Which
 the sp Carbon Chains Are Shielded by sp3 Carbon Chains
;
_journal_coden_ASTM              ORGND7
_journal_issue                   25
_journal_name_full               Organometallics
_journal_page_first              5889
_journal_page_last               5892
_journal_paper_doi               10.1021/om0493558
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C104 H116 Cl4 F10 P4 Pt2'
_chemical_formula_weight         2211.83
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                102.614(6)
_cell_angle_beta                 103.327(6)
_cell_angle_gamma                112.551(5)
_cell_formula_units_Z            2
_cell_length_a                   15.0284(2)
_cell_length_b                   18.1876(2)
_cell_length_c                   21.3651(2)
_cell_measurement_temperature    173(2)
_cell_volume                     4932.71(10)
_diffrn_ambient_temperature      173(2)
_exptl_crystal_density_diffrn    1.489
_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_database_code               4061004
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
Pt1 Pt 0.178881(9) 0.076895(7) 0.337032(6) 0.02487(4) Uani 1 1 d . . .
P1 P 0.25167(7) 0.18749(6) 0.43977(4) 0.03133(19) Uani 1 1 d . . .
C1 C 0.1057(3) 0.1391(2) 0.30169(17) 0.0316(7) Uani 1 1 d . . .
C1B C 0.1886(3) 0.0500(2) 0.17928(18) 0.0361(8) Uani 1 1 d . . .
H1BA H 0.1867 0.0105 0.1383 0.043 Uiso 1 1 calc R . .
H1BB H 0.1505 0.0802 0.1634 0.043 Uiso 1 1 calc R . .
C1A C 0.1566(3) 0.2029(3) 0.4732(2) 0.0435(9) Uani 1 1 d . . .
H1AA H 0.1924 0.2518 0.5164 0.052 Uiso 1 1 calc R . .
H1AB H 0.1126 0.2162 0.4400 0.052 Uiso 1 1 calc R . .
Pt2 Pt -0.216304(9) 0.398074(7) 0.169895(6) 0.02443(4) Uani 1 1 d . . .
P2 P 0.12404(6) -0.01109(5) 0.22672(4) 0.02574(17) Uani 1 1 d . . .
C2 C 0.0564(3) 0.1752(2) 0.28208(17) 0.0335(8) Uani 1 1 d . . .
C2B C 0.3011(3) 0.1148(2) 0.2214(2) 0.0415(9) Uani 1 1 d . . .
H2BA H 0.3025 0.1627 0.2550 0.050 Uiso 1 1 calc R . .
H2BB H 0.3346 0.0878 0.2473 0.050 Uiso 1 1 calc R . .
C2A C 0.0889(4) 0.1247(3) 0.4865(2) 0.0598(12) Uani 1 1 d D . .
H2AA H 0.1262 0.1252 0.5297 0.072 Uiso 1 1 d R . .
H2AB H 0.0785 0.0756 0.4518 0.072 Uiso 1 1 d R . .
P3 P -0.16642(7) 0.47807(6) 0.28262(4) 0.02906(18) Uani 1 1 d . . .
C3 C 0.0000(3) 0.2148(2) 0.26092(18) 0.0359(8) Uani 1 1 d . . .
C3B C 0.3623(3) 0.1489(3) 0.1773(2) 0.0493(10) Uani 1 1 d . . .
H3BA H 0.4334 0.1904 0.2076 0.059 Uiso 1 1 calc R . .
H3BB H 0.3658 0.1015 0.1467 0.059 Uiso 1 1 calc R . .
C3A C -0.0121(5) 0.1150(5) 0.4872(3) 0.062(2) Uani 0.716(11) 1 d PD . .
H3AA H -0.0038 0.1665 0.5175 0.075 Uiso 0.716(11) 1 d PR . .
H3AB H -0.0424 0.0701 0.5040 0.075 Uiso 0.716(11) 1 d PR . .
C3A' C -0.0012(10) 0.0622(10) 0.4337(8) 0.062(2) Uani 0.28 1 d PD . .
H3AC H -0.0306 0.0138 0.4470 0.075 Uiso 0.284(11) 1 d PR . .
H3AD H 0.0153 0.0446 0.3940 0.075 Uiso 0.284(11) 1 d PR . .
P4 P -0.25240(7) 0.31057(5) 0.06214(4) 0.02522(17) Uani 1 1 d . . .
C4 C -0.0495(3) 0.2507(2) 0.24219(17) 0.0346(8) Uani 1 1 d . . .
C4B C 0.3181(4) 0.1911(3) 0.1340(2) 0.0513(11) Uani 1 1 d . . .
H4BA H 0.2468 0.1500 0.1038 0.062 Uiso 1 1 calc R . .
H4BB H 0.3589 0.2070 0.1045 0.062 Uiso 1 1 calc R . .
C4A C -0.0873(4) 0.0951(5) 0.4136(4) 0.098(2) Uani 1 1 d D . .
H4AA H -0.0878 0.0488 0.3814 0.117 Uiso 1 1 d R . .
H4AB H -0.0640 0.1437 0.3996 0.117 Uiso 1 1 d R . .
C5 C -0.1016(3) 0.2931(2) 0.22108(17) 0.0337(8) Uani 1 1 d . . .
C5B C 0.3175(4) 0.2701(3) 0.1764(2) 0.0578(12) Uani 1 1 d . . .
H5BA H 0.2762 0.2543 0.2057 0.069 Uiso 1 1 calc R . .
H5BB H 0.3886 0.3113 0.2068 0.069 Uiso 1 1 calc R . .
C5A C -0.1885(6) 0.0723(5) 0.4128(4) 0.139(3) Uani 1 1 d . . .
H5AA H -0.1859 0.1127 0.4535 0.167 Uiso 1 1 calc R . .
H5AB H -0.2171 0.0154 0.4171 0.167 Uiso 1 1 calc R . .
C6 C -0.1445(3) 0.3334(2) 0.20271(16) 0.0305(7) Uani 1 1 d . . .
C6B C 0.2734(4) 0.3120(3) 0.1321(2) 0.0574(12) Uani 1 1 d . . .
H6BA H 0.2000 0.2727 0.1053 0.069 Uiso 1 1 calc R . .
H6BB H 0.3099 0.3219 0.0993 0.069 Uiso 1 1 calc R . .
C6A C -0.2615(6) 0.0707(5) 0.3491(5) 0.118(3) Uani 1 1 d . . .
H6AA H -0.3197 0.0752 0.3607 0.141 Uiso 1 1 calc R . .
H6AB H -0.2246 0.1223 0.3389 0.141 Uiso 1 1 calc R . .
C7B C 0.2821(4) 0.3962(3) 0.1733(2) 0.0584(12) Uani 1 1 d . . .
H7BA H 0.3554 0.4348 0.2008 0.070 Uiso 1 1 calc R . .
H7BB H 0.2589 0.4221 0.1409 0.070 Uiso 1 1 calc R . .
C7A C -0.2997(8) 0.0058(6) 0.2929(4) 0.155(4) Uani 1 1 d D . .
H7AA H -0.3345 -0.0466 0.2999 0.187 Uiso 1 1 d R . .
H7AB H -0.2434 0.0060 0.2788 0.187 Uiso 1 1 d R . .
C8B C 0.2206(4) 0.3889(3) 0.2208(2) 0.0544(11) Uani 1 1 d . . .
H8BA H 0.2446 0.3641 0.2538 0.065 Uiso 1 1 calc R . .
H8BB H 0.1474 0.3497 0.1935 0.065 Uiso 1 1 calc R . .
C8A C -0.3911(11) 0.0402(8) 0.2615(6) 0.088(3) Uani 0.462(12) 1 d PD . .
H8AA H -0.3572 0.0972 0.2620 0.106 Uiso 0.462(12) 1 d PR . .
H8AB H -0.4339 0.0382 0.2889 0.106 Uiso 0.462(12) 1 d PR . .
C8A' C -0.3470(9) -0.0013(7) 0.2144(5) 0.088(3) Uani 0.54 1 d PD . .
H8AC H -0.3457 -0.0483 0.1843 0.106 Uiso 0.538(12) 1 d PR . .
H8AD H -0.3053 0.0495 0.2076 0.106 Uiso 0.538(12) 1 d PR . .
C9B C 0.2292(4) 0.4738(3) 0.2604(2) 0.0530(11) Uani 1 1 d . . .
H9BA H 0.3027 0.5149 0.2844 0.064 Uiso 1 1 calc R . .
H9BB H 0.1986 0.4961 0.2278 0.064 Uiso 1 1 calc R . .
C9A C -0.4467(5) -0.0124(4) 0.1990(4) 0.115(3) Uani 1 1 d D . .
H9AA H -0.4906 -0.0116 0.2251 0.138 Uiso 1 1 d R . .
H9AB H -0.4584 -0.0702 0.1837 0.138 Uiso 1 1 d R . .
C10A C -0.4960(4) -0.0013(3) 0.1367(3) 0.0645(13) Uani 1 1 d . . .
H10A H -0.5650 -0.0080 0.1356 0.077 Uiso 1 1 calc R . .
H10B H -0.5054 -0.0466 0.0965 0.077 Uiso 1 1 calc R . .
C10B C 0.1759(3) 0.4655(3) 0.3115(2) 0.0495(10) Uani 1 1 d . . .
H10C H 0.1989 0.4348 0.3391 0.059 Uiso 1 1 calc R . .
H10D H 0.1010 0.4308 0.2866 0.059 Uiso 1 1 calc R . .
C11B C 0.1945(3) 0.5497(3) 0.3601(2) 0.0491(10) Uani 1 1 d . . .
H11A H 0.1628 0.5380 0.3948 0.059 Uiso 1 1 calc R . .
H11B H 0.2695 0.5848 0.3844 0.059 Uiso 1 1 calc R . .
C11A C -0.4357(4) 0.0841(3) 0.1309(3) 0.0675(14) Uani 1 1 d . . .
H11C H -0.4216 0.1292 0.1729 0.081 Uiso 1 1 calc R . .
H11D H -0.3686 0.0889 0.1288 0.081 Uiso 1 1 calc R . .
C12B C 0.1534(3) 0.6006(2) 0.3265(2) 0.0455(10) Uani 1 1 d . . .
H12A H 0.1918 0.6191 0.2962 0.055 Uiso 1 1 calc R . .
H12B H 0.1665 0.6521 0.3624 0.055 Uiso 1 1 calc R . .
C12A C -0.4873(3) 0.0999(2) 0.0705(2) 0.0437(9) Uani 1 1 d . . .
H12C H -0.5561 0.0922 0.0707 0.052 Uiso 1 1 calc R . .
H12D H -0.4972 0.0575 0.0281 0.052 Uiso 1 1 calc R . .
C13B C 0.0384(3) 0.5527(2) 0.28421(18) 0.0381(8) Uani 1 1 d . . .
H13A H 0.0261 0.5048 0.2450 0.046 Uiso 1 1 calc R . .
H13B H 0.0173 0.5911 0.2656 0.046 Uiso 1 1 calc R . .
C13A C -0.4266(3) 0.1882(2) 0.0695(2) 0.0391(8) Uani 1 1 d . . .
H13C H -0.4087 0.2302 0.1144 0.047 Uiso 1 1 calc R . .
H13D H -0.4708 0.1990 0.0344 0.047 Uiso 1 1 calc R . .
C14B C -0.0284(3) 0.5184(2) 0.32567(17) 0.0354(8) Uani 1 1 d . . .
H14A H -0.0060 0.5642 0.3694 0.042 Uiso 1 1 calc R . .
H14B H -0.0162 0.4722 0.3368 0.042 Uiso 1 1 calc R . .
C14A C -0.3277(3) 0.2015(2) 0.05452(17) 0.0288(7) Uani 1 1 d . . .
H14C H -0.3455 0.1639 0.0076 0.035 Uiso 1 1 calc R . .
H14D H -0.2859 0.1857 0.0869 0.035 Uiso 1 1 calc R . .
C21 C 0.2432(3) 0.0052(2) 0.37224(16) 0.0276(7) Uani 1 1 d . . .
F22 F 0.07994(16) -0.09341(13) 0.36685(12) 0.0469(5) Uani 1 1 d . . .
C22 C 0.1827(3) -0.0687(2) 0.38131(18) 0.0332(8) Uani 1 1 d . . .
F23 F 0.1554(2) -0.19209(15) 0.41099(14) 0.0622(7) Uani 1 1 d . . .
C23 C 0.2195(3) -0.1200(2) 0.4046(2) 0.0409(9) Uani 1 1 d . . .
F24 F 0.3596(2) -0.14721(17) 0.44400(13) 0.0642(7) Uani 1 1 d . . .
C24 C 0.3220(3) -0.0982(3) 0.42077(19) 0.0438(10) Uani 1 1 d . . .
F25 F 0.48659(18) -0.00412(17) 0.42704(13) 0.0572(7) Uani 1 1 d . . .
C25 C 0.3860(3) -0.0257(2) 0.41242(19) 0.0396(9) Uani 1 1 d . . .
F26 F 0.41241(16) 0.09355(13) 0.38090(12) 0.0445(5) Uani 1 1 d . . .
C26 C 0.3452(3) 0.0234(2) 0.38823(17) 0.0320(7) Uani 1 1 d . . .
C31 C 0.3447(3) 0.1888(2) 0.51279(18) 0.0370(8) Uani 1 1 d . . .
C32 C 0.4367(3) 0.2622(2) 0.55220(18) 0.0432(9) Uani 1 1 d . . .
H32A H 0.4519 0.3118 0.5402 0.052 Uiso 1 1 calc R . .
C33 C 0.5061(3) 0.2636(3) 0.6086(2) 0.0490(10) Uani 1 1 d . . .
H33A H 0.5668 0.3147 0.6355 0.059 Uiso 1 1 calc R . .
C34 C 0.4885(3) 0.1923(3) 0.62621(18) 0.0431(9) Uani 1 1 d . . .
C35 C 0.3979(3) 0.1193(2) 0.58689(18) 0.0401(9) Uani 1 1 d . . .
H35A H 0.3840 0.0693 0.5983 0.048 Uiso 1 1 calc R . .
C36 C 0.3267(3) 0.1176(2) 0.53091(18) 0.0365(8) Uani 1 1 d . . .
H36A H 0.2651 0.0668 0.5050 0.044 Uiso 1 1 calc R . .
C37 C 0.5657(4) 0.1923(3) 0.6864(2) 0.0591(13) Uani 1 1 d . . .
H37A H 0.6251 0.2486 0.7080 0.089 Uiso 1 1 calc R . .
H37B H 0.5886 0.1503 0.6701 0.089 Uiso 1 1 calc R . .
H37C H 0.5334 0.1779 0.7198 0.089 Uiso 1 1 calc R . .
C41 C 0.3240(3) 0.2837(2) 0.42445(18) 0.0360(8) Uani 1 1 d . . .
C42 C 0.3946(3) 0.2832(2) 0.3926(2) 0.0454(9) Uani 1 1 d . . .
H42A H 0.4038 0.2338 0.3805 0.054 Uiso 1 1 calc R . .
C43 C 0.4519(3) 0.3535(3) 0.3779(2) 0.0520(11) Uani 1 1 d . . .
H43A H 0.4992 0.3513 0.3557 0.062 Uiso 1 1 calc R . .
C44 C 0.4412(4) 0.4259(3) 0.3951(2) 0.0525(11) Uani 1 1 d . . .
C45 C 0.3724(4) 0.4278(2) 0.4282(2) 0.0550(12) Uani 1 1 d . . .
H45A H 0.3652 0.4780 0.4414 0.066 Uiso 1 1 calc R . .
C46 C 0.3139(3) 0.3575(2) 0.4426(2) 0.0448(10) Uani 1 1 d . . .
H46A H 0.2667 0.3599 0.4649 0.054 Uiso 1 1 calc R . .
C47 C 0.5022(4) 0.5021(3) 0.3780(3) 0.0741(16) Uani 1 1 d . . .
H47A H 0.5470 0.4898 0.3551 0.111 Uiso 1 1 calc R . .
H47B H 0.5443 0.5511 0.4202 0.111 Uiso 1 1 calc R . .
H47C H 0.4549 0.5148 0.3475 0.111 Uiso 1 1 calc R . .
C51 C -0.0131(3) -0.0594(2) 0.17838(17) 0.0302(7) Uani 1 1 d . . .
C52 C -0.0470(3) -0.0930(2) 0.10672(18) 0.0386(8) Uani 1 1 d . . .
H52A H 0.0013 -0.0874 0.0840 0.046 Uiso 1 1 calc R . .
C53 C -0.1516(3) -0.1344(3) 0.0693(2) 0.0466(10) Uani 1 1 d . . .
H53A H -0.1742 -0.1568 0.0208 0.056 Uiso 1 1 calc R . .
C54 C -0.2235(3) -0.1437(3) 0.1012(2) 0.0450(10) Uani 1 1 d . . .
C55 C -0.1885(3) -0.1091(3) 0.1722(2) 0.0512(11) Uani 1 1 d . . .
H55A H -0.2368 -0.1144 0.1950 0.061 Uiso 1 1 calc R . .
C56 C -0.0836(3) -0.0666(3) 0.21055(19) 0.0418(9) Uani 1 1 d . . .
H56A H -0.0610 -0.0426 0.2590 0.050 Uiso 1 1 calc R . .
C57 C -0.3365(3) -0.1896(3) 0.0599(3) 0.0691(14) Uani 1 1 d . . .
H57A H -0.3464 -0.2097 0.0112 0.104 Uiso 1 1 calc R . .
H57B H -0.3669 -0.1509 0.0678 0.104 Uiso 1 1 calc R . .
H57C H -0.3700 -0.2380 0.0739 0.104 Uiso 1 1 calc R . .
C61 C 0.1470(2) -0.1038(2) 0.21132(16) 0.0280(7) Uani 1 1 d . . .
C62 C 0.0755(3) -0.1795(2) 0.21215(19) 0.0361(8) Uani 1 1 d . . .
H62A H 0.0174 -0.1813 0.2236 0.043 Uiso 1 1 calc R . .
C63 C 0.0878(3) -0.2526(2) 0.19653(19) 0.0387(8) Uani 1 1 d . . .
H63A H 0.0378 -0.3035 0.1974 0.046 Uiso 1 1 calc R . .
C64 C 0.1718(3) -0.2525(2) 0.17974(17) 0.0345(8) Uani 1 1 d . . .
C65 C 0.2447(3) -0.1763(2) 0.18199(19) 0.0382(8) Uani 1 1 d . . .
H65A H 0.3043 -0.1741 0.1727 0.046 Uiso 1 1 calc R . .
C66 C 0.2335(3) -0.1030(2) 0.19743(18) 0.0344(8) Uani 1 1 d . . .
H66A H 0.2852 -0.0516 0.1985 0.041 Uiso 1 1 calc R . .
C67 C 0.1786(3) -0.3338(2) 0.1561(2) 0.0482(10) Uani 1 1 d . . .
H67A H 0.2427 -0.3219 0.1467 0.072 Uiso 1 1 calc R . .
H67B H 0.1199 -0.3729 0.1142 0.072 Uiso 1 1 calc R . .
H67C H 0.1777 -0.3596 0.1918 0.072 Uiso 1 1 calc R . .
C71 C -0.2915(3) 0.4647(2) 0.13716(16) 0.0264(7) Uani 1 1 d . . .
F72 F -0.13355(16) 0.58455(13) 0.16265(12) 0.0443(5) Uani 1 1 d . . .
C72 C -0.2384(3) 0.5476(2) 0.14074(18) 0.0325(7) Uani 1 1 d . . .
F73 F -0.2273(2) 0.67779(14) 0.12955(15) 0.0609(7) Uani 1 1 d . . .
C73 C -0.2836(3) 0.5965(2) 0.1228(2) 0.0393(9) Uani 1 1 d . . .
F74 F -0.4358(2) 0.60729(19) 0.07931(16) 0.0705(8) Uani 1 1 d . . .
C74 C -0.3890(4) 0.5612(3) 0.0984(2) 0.0469(10) Uani 1 1 d . . .
F75 F -0.54987(19) 0.44512(18) 0.06975(15) 0.0651(7) Uani 1 1 d . . .
C75 C -0.4466(3) 0.4793(3) 0.0933(2) 0.0419(9) Uani 1 1 d . . .
F76 F -0.45855(16) 0.35345(13) 0.10792(13) 0.0500(6) Uani 1 1 d . . .
C76 C -0.3971(3) 0.4338(2) 0.11320(18) 0.0330(8) Uani 1 1 d . . .
C81 C -0.1899(3) 0.5701(2) 0.30047(16) 0.0313(7) Uani 1 1 d . . .
C82 C -0.1125(3) 0.6523(2) 0.3190(2) 0.0423(9) Uani 1 1 d . . .
H82A H -0.0433 0.6623 0.3272 0.051 Uiso 1 1 calc R . .
C83 C -0.1359(3) 0.7194(2) 0.3256(2) 0.0451(10) Uani 1 1 d . . .
H83A H -0.0822 0.7749 0.3375 0.054 Uiso 1 1 calc R . .
C84 C -0.2354(3) 0.7081(2) 0.31529(18) 0.0387(9) Uani 1 1 d . . .
C85 C -0.3112(3) 0.6269(2) 0.30007(18) 0.0377(8) Uani 1 1 d . . .
H85A H -0.3794 0.6179 0.2952 0.045 Uiso 1 1 calc R . .
C86 C -0.2899(3) 0.5584(2) 0.29172(17) 0.0338(8) Uani 1 1 d . . .
H86A H -0.3438 0.5031 0.2799 0.041 Uiso 1 1 calc R . .
C87 C -0.2603(4) 0.7815(3) 0.3205(2) 0.0550(11) Uani 1 1 d . . .
H87A H -0.3341 0.7611 0.3114 0.082 Uiso 1 1 calc R . .
H87B H -0.2413 0.8074 0.2868 0.082 Uiso 1 1 calc R . .
H87C H -0.2217 0.8236 0.3666 0.082 Uiso 1 1 calc R . .
C91 C -0.2274(3) 0.4185(2) 0.33180(17) 0.0342(8) Uani 1 1 d . . .
C92 C -0.2102(3) 0.4588(3) 0.40051(19) 0.0490(10) Uani 1 1 d . . .
H92A H -0.1698 0.5185 0.4208 0.059 Uiso 1 1 calc R . .
C93 C -0.2515(4) 0.4123(3) 0.4387(2) 0.0554(12) Uani 1 1 d . . .
H93A H -0.2380 0.4410 0.4853 0.067 Uiso 1 1 calc R . .
C94 C -0.3123(3) 0.3249(3) 0.4117(2) 0.0488(10) Uani 1 1 d . . .
C95 C -0.3313(3) 0.2858(3) 0.3433(2) 0.0500(10) Uani 1 1 d . . .
H95A H -0.3737 0.2263 0.3230 0.060 Uiso 1 1 calc R . .
C96 C -0.2903(3) 0.3311(2) 0.30359(19) 0.0421(9) Uani 1 1 d . . .
H96A H -0.3052 0.3022 0.2568 0.051 Uiso 1 1 calc R . .
C97 C -0.3548(4) 0.2751(3) 0.4548(2) 0.0668(14) Uani 1 1 d . . .
H97A H -0.3947 0.2149 0.4269 0.100 Uiso 1 1 calc R . .
H97B H -0.3993 0.2952 0.4721 0.100 Uiso 1 1 calc R . .
H97C H -0.2980 0.2829 0.4934 0.100 Uiso 1 1 calc R . .
C101 C -0.1375(2) 0.3176(2) 0.04492(16) 0.0275(7) Uani 1 1 d . . .
C102 C -0.1375(3) 0.2488(2) 0.00016(19) 0.0381(8) Uani 1 1 d . . .
H10E H -0.1966 0.1952 -0.0179 0.046 Uiso 1 1 calc R . .
C103 C -0.0526(3) 0.2579(2) -0.01820(19) 0.0381(8) Uani 1 1 d . . .
H10F H -0.0540 0.2099 -0.0478 0.046 Uiso 1 1 calc R . .
C104 C 0.0336(3) 0.3345(2) 0.00531(18) 0.0350(8) Uani 1 1 d . . .
C105 C 0.0345(3) 0.4030(3) 0.0507(2) 0.0502(11) Uani 1 1 d . . .
H10G H 0.0939 0.4564 0.0686 0.060 Uiso 1 1 calc R . .
C106 C -0.0495(3) 0.3943(2) 0.0700(2) 0.0451(10) Uani 1 1 d . . .
H10H H -0.0469 0.4419 0.1012 0.054 Uiso 1 1 calc R . .
C107 C 0.1225(3) 0.3437(3) -0.0187(2) 0.0447(9) Uani 1 1 d . . .
H10I H 0.1075 0.2888 -0.0499 0.067 Uiso 1 1 calc R . .
H10J H 0.1846 0.3635 0.0208 0.067 Uiso 1 1 calc R . .
H10K H 0.1333 0.3848 -0.0426 0.067 Uiso 1 1 calc R . .
C111 C -0.3195(2) 0.3255(2) -0.01311(16) 0.0264(7) Uani 1 1 d . . .
C112 C -0.2843(3) 0.4068(2) -0.01695(17) 0.0320(7) Uani 1 1 d . . .
H11E H -0.2291 0.4532 0.0204 0.038 Uiso 1 1 calc R . .
C113 C -0.3291(3) 0.4204(2) -0.07479(17) 0.0338(8) Uani 1 1 d . . .
H11F H -0.3048 0.4763 -0.0763 0.041 Uiso 1 1 calc R . .
C114 C -0.4092(3) 0.3536(2) -0.13070(17) 0.0342(8) Uani 1 1 d . . .
C115 C -0.4440(3) 0.2731(2) -0.12703(18) 0.0364(8) Uani 1 1 d . . .
H11G H -0.4989 0.2267 -0.1646 0.044 Uiso 1 1 calc R . .
C116 C -0.3996(3) 0.2588(2) -0.06888(17) 0.0320(7) Uani 1 1 d . . .
H11H H -0.4245 0.2029 -0.0674 0.038 Uiso 1 1 calc R . .
C117 C -0.4561(3) 0.3700(3) -0.19324(19) 0.0483(10) Uani 1 1 d . . .
H11I H -0.5111 0.3164 -0.2275 0.072 Uiso 1 1 calc R . .
H11J H -0.4032 0.3952 -0.2123 0.072 Uiso 1 1 calc R . .
H11K H -0.4845 0.4090 -0.1805 0.072 Uiso 1 1 calc R . .
C200 C 0.0588(5) 0.6683(5) 0.5791(3) 0.102(2) Uani 1 1 d . . .
H20A H 0.0887 0.6300 0.5879 0.123 Uiso 1 1 calc R . .
H20B H 0.0967 0.7215 0.6190 0.123 Uiso 1 1 calc R . .
Cl20 Cl 0.07833(16) 0.69147(12) 0.50651(8) 0.1045(6) Uani 1 1 d . . .
Cl21 Cl -0.06459(12) 0.62306(12) 0.57349(8) 0.0947(5) Uani 1 1 d . . .
C300 C -0.1060(4) 0.0891(3) 0.0885(2) 0.0692(14) Uani 1 1 d . . .
H30A H -0.0961 0.1469 0.1106 0.083 Uiso 1 1 calc R . .
H30B H -0.1009 0.0625 0.1240 0.083 Uiso 1 1 calc R . .
Cl30 Cl -0.01047(17) 0.09595(16) 0.05530(11) 0.1241(8) Uani 1 1 d . . .
Cl31 Cl -0.22761(14) 0.03050(10) 0.02620(12) 0.1273(9) Uani 1 1 d . . .
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
Pt1 C1 2.001(3) . ?
Pt1 C21 2.064(3) . ?
Pt1 P2 2.2892(8) . ?
Pt1 P1 2.3103(9) . ?
Pt1 Pt2 10.3966(4) . ?
P1 C41 1.818(4) . ?
P1 C1A 1.821(4) . ?
P1 C31 1.828(4) . ?
C1 C2 1.226(5) . ?
C1B C2B 1.537(5) . ?
C1B P2 1.822(4) . ?
C1A C2A 1.529(6) . ?
Pt2 C6 2.006(3) . ?
Pt2 C71 2.072(3) . ?
Pt2 P3 2.2978(8) . ?
Pt2 P4 2.2997(8) . ?
P2 C51 1.822(3) . ?
P2 C61 1.825(3) . ?
C2 C3 1.370(5) . ?
C2B C3B 1.529(5) . ?
C2A C3A' 1.398(14) . ?
C2A C3A 1.463(7) . ?
P3 C91 1.816(4) . ?
P3 C81 1.818(3) . ?
P3 C14B 1.829(4) . ?
C3 C4 1.221(5) . ?
C3B C4B 1.519(6) . ?
C3A C3A' 1.408(17) . ?
C3A C4A 1.581(8) . ?
C3A' C4A 1.632(14) . ?
P4 C101 1.811(3) . ?
P4 C14A 1.816(3) . ?
P4 C111 1.824(3) . ?
C4 C5 1.364(5) . ?
C4B C5B 1.526(6) . ?
C4A C5A 1.409(10) . ?
C5 C6 1.216(5) . ?
C5B C6B 1.526(6) . ?
C5A C6A 1.526(10) . ?
C6B C7B 1.529(6) . ?
C6A C7A 1.307(10) . ?
C7B C8B 1.517(6) . ?
C7A C8A' 1.619(11) . ?
C7A C8A 1.773(14) . ?
C8B C9B 1.530(6) . ?
C8A C9A 1.309(11) . ?
C8A C8A' 1.545(18) . ?
C8A' C9A 1.380(12) . ?
C9B C10B 1.498(6) . ?
C9A C10A 1.462(7) . ?
C10A C11A 1.519(6) . ?
C10B C11B 1.530(6) . ?
C11B C12B 1.510(6) . ?
C11A C12A 1.490(6) . ?
C12B C13B 1.531(5) . ?
C12A C13A 1.521(5) . ?
C13B C14B 1.534(5) . ?
C13A C14A 1.533(5) . ?
C21 C26 1.377(5) . ?
C21 C22 1.389(5) . ?
F22 C22 1.367(4) . ?
C22 C23 1.377(5) . ?
F23 C23 1.355(4) . ?
C23 C24 1.370(6) . ?
F24 C24 1.345(4) . ?
C24 C25 1.381(6) . ?
F25 C25 1.346(4) . ?
C25 C26 1.383(5) . ?
F26 C26 1.358(4) . ?
C31 C36 1.378(5) . ?
C31 C32 1.400(5) . ?
C32 C33 1.388(5) . ?
C33 C34 1.374(6) . ?
C34 C35 1.386(6) . ?
C34 C37 1.521(5) . ?
C35 C36 1.395(5) . ?
C41 C46 1.389(5) . ?
C41 C42 1.388(6) . ?
C42 C43 1.389(6) . ?
C43 C44 1.369(6) . ?
C44 C45 1.388(7) . ?
C44 C47 1.515(6) . ?
C45 C46 1.392(6) . ?
C51 C56 1.371(5) . ?
C51 C52 1.404(5) . ?
C52 C53 1.388(5) . ?
C53 C54 1.382(6) . ?
C54 C55 1.391(6) . ?
C54 C57 1.503(6) . ?
C55 C56 1.396(5) . ?
C61 C62 1.391(5) . ?
C61 C66 1.393(5) . ?
C62 C63 1.391(5) . ?
C63 C64 1.389(5) . ?
C64 C65 1.379(5) . ?
C64 C67 1.506(5) . ?
C65 C66 1.387(5) . ?
C71 C76 1.382(5) . ?
C71 C72 1.384(5) . ?
F72 C72 1.365(4) . ?
C72 C73 1.375(5) . ?
F73 C73 1.346(4) . ?
C73 C74 1.374(6) . ?
F74 C74 1.353(4) . ?
C74 C75 1.371(6) . ?
F75 C75 1.347(4) . ?
C75 C76 1.378(5) . ?
F76 C76 1.358(4) . ?
C81 C82 1.393(5) . ?
C81 C86 1.396(5) . ?
C82 C83 1.382(5) . ?
C83 C84 1.385(6) . ?
C84 C85 1.383(5) . ?
C84 C87 1.507(5) . ?
C85 C86 1.386(5) . ?
C91 C96 1.397(5) . ?
C91 C92 1.403(5) . ?
C92 C93 1.378(6) . ?
C93 C94 1.391(6) . ?
C94 C95 1.385(6) . ?
C94 C97 1.507(6) . ?
C95 C96 1.392(6) . ?
C101 C106 1.383(5) . ?
C101 C102 1.398(5) . ?
C102 C103 1.380(5) . ?
C103 C104 1.372(5) . ?
C104 C105 1.395(5) . ?
C104 C107 1.501(5) . ?
C105 C106 1.381(5) . ?
C111 C116 1.388(5) . ?
C111 C112 1.395(5) . ?
C112 C113 1.386(5) . ?
C113 C114 1.390(5) . ?
C114 C115 1.380(5) . ?
C114 C117 1.507(5) . ?
C115 C116 1.395(5) . ?
C200 Cl21 1.677(7) . ?
C200 Cl20 1.753(6) . ?
C300 Cl30 1.718(6) . ?
C300 Cl31 1.735(5) . ?
