#------------------------------------------------------------------------------
#$Date: 2016-03-23 00:43:47 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179125 $
#$URL: svn://www.crystallography.net/cod/cif/4/30/87/4308714.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_4308714
loop_
_publ_author_name
'Raffaello Romeo'
'Salvatore Carnabuci'
'Maria Rosaria Plutino'
'Andrea Romeo'
'Silvia Rizzato'
'Alberto Albinati'
_publ_contact_author_address
;
Dipartimento di Chimica Inorganica,
Universita di Messina,
Salita Sperone 31, Vill. S. Agata,
I-98166 Messina
;
_publ_contact_author_email       raf.romeo@chem.unime.it
_publ_contact_author_name        ' Raffaello Romeo'
_publ_section_title
;
Structural Properties and Dissociative Fluxional Motion of
2,9-Dimethyl-1,10-Phenanthroline in Platinum(II) Complexes
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              1248
_journal_page_last               1262
_journal_paper_doi               10.1021/ic0485920
_journal_volume                  44
_journal_year                    2005
_chemical_formula_moiety         'C31 H26 F6 N2 P2 Pt'
_chemical_formula_sum            'C93 H78 F18 N6 P6 Pt3'
_chemical_formula_weight         797.59
_chemical_name_common            '[Pt(Me)(phen)(PC6H5)3](PF6)'
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.000(2)
_cell_angle_beta                 107.275(2)
_cell_angle_gamma                90.000(2)
_cell_formula_units_Z            12
_cell_length_a                   14.1973(10)
_cell_length_b                   30.075(2)
_cell_length_c                   20.9403(15)
_cell_measurement_reflns_used    1012
_cell_measurement_temperature    183(2)
_cell_measurement_theta_max      25.96
_cell_measurement_theta_min      2.29
_cell_volume                     8537.8(10)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'SAINT and SADABS'
_computing_molecular_graphics    'ORTEP for Windows 1.074(Farrugia 1997)'
_computing_publication_material  'WinGX 1.64.05 (L.J. Farruggia, 1999)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick,1990)'
_diffrn_ambient_temperature      183(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'CCD area detector'
_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     0.71069
_diffrn_reflns_av_R_equivalents  0.0437
_diffrn_reflns_av_sigmaI/netI    0.0327
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       37
_diffrn_reflns_limit_k_min       -37
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_number            80178
_diffrn_reflns_theta_full        26.03
_diffrn_reflns_theta_max         26.03
_diffrn_reflns_theta_min         1.22
_diffrn_standards_decay_%        0
_exptl_absorpt_coefficient_mu    5.108
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.6753
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.861
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    .
_exptl_crystal_description       prismatic
_exptl_crystal_F_000             4656
_exptl_crystal_size_max          0.5
_exptl_crystal_size_mid          0.3
_exptl_crystal_size_min          0.1
_refine_diff_density_max         1.036
_refine_diff_density_min         -0.998
_refine_diff_density_rms         0.106
_refine_ls_extinction_coef       no
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.039
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1135
_refine_ls_number_reflns         16808
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.039
_refine_ls_R_factor_all          0.0396
_refine_ls_R_factor_gt           0.0276
_refine_ls_shift/su_max          0.223
_refine_ls_shift/su_mean         0.037
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w==1/[σ²(Fo²)+(0.0254P)²+14.3219P] where P==(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0603
_refine_ls_wR_factor_ref         0.0646
_reflns_number_gt                13988
_reflns_number_total             16808
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic0485920si20041221_104825_1.cif
_cod_data_source_block           rom18
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
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               4308714
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'
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 0.068869(11) -0.092624(5) 0.761489(7) 0.02151(4) Uani 1 1 d . . .
Pt2 Pt 0.252522(11) 0.106616(5) 0.909679(7) 0.02093(4) Uani 1 1 d . . .
Pt3 Pt -0.394141(11) 0.093958(5) 0.589397(7) 0.02198(4) Uani 1 1 d . . .
C1L C 0.1284(3) -0.13131(14) 0.84344(19) 0.0302(10) Uani 1 1 d . . .
H1L1 H 0.1942 -0.1202 0.8676 0.042 Uiso 1 1 calc R . .
H1L2 H 0.1336 -0.1620 0.8293 0.042 Uiso 1 1 calc R . .
H1L3 H 0.0861 -0.1303 0.8728 0.042 Uiso 1 1 calc R . .
C2L C 0.1810(4) 0.14492(15) 0.8297(2) 0.0403(12) Uani 1 1 d . . .
H2L1 H 0.2278 0.1657 0.8196 0.056 Uiso 1 1 calc R . .
H2L2 H 0.1282 0.1616 0.8401 0.056 Uiso 1 1 calc R . .
H2L3 H 0.1527 0.1258 0.7908 0.056 Uiso 1 1 calc R . .
C3L C -0.4607(4) 0.13393(14) 0.5096(2) 0.0363(11) Uani 1 1 d . . .
H3L1 H -0.4394 0.1251 0.4710 0.051 Uiso 1 1 calc R . .
H3L2 H -0.4422 0.1650 0.5211 0.051 Uiso 1 1 calc R . .
H3L3 H -0.5325 0.1308 0.4985 0.051 Uiso 1 1 calc R . .
N2 N -0.0033(2) -0.04495(11) 0.68750(16) 0.0249(7) Uani 1 1 d . . .
N1 N 0.0561(2) -0.03859(10) 0.82159(15) 0.0222(7) Uani 1 1 d . . .
C9 C -0.0373(3) -0.04831(14) 0.6214(2) 0.0301(10) Uani 1 1 d . . .
H9 H -0.0352 -0.0766 0.6017 0.039 Uiso 1 1 calc R . .
C8 C -0.0759(3) -0.01247(15) 0.5792(2) 0.0355(10) Uani 1 1 d . . .
H8 H -0.0982 -0.0165 0.5321 0.046 Uiso 1 1 calc R . .
C7 C -0.0812(3) 0.02816(15) 0.6061(2) 0.0352(11) Uani 1 1 d . . .
H7 H -0.1052 0.0530 0.5780 0.046 Uiso 1 1 calc R . .
C6' C -0.0509(3) 0.03312(14) 0.6762(2) 0.0302(9) Uani 1 1 d . . .
C6 C -0.0597(3) 0.07384(15) 0.7090(2) 0.0370(11) Uani 1 1 d . . .
H6 H -0.0851 0.0994 0.6828 0.048 Uiso 1 1 calc R . .
C5 C -0.0328(3) 0.07686(15) 0.7762(2) 0.0349(10) Uani 1 1 d . . .
H5 H -0.0403 0.1043 0.7966 0.045 Uiso 1 1 calc R . .
C4' C 0.0074(3) 0.03903(13) 0.8176(2) 0.0273(9) Uani 1 1 d . . .
C4 C 0.0366(3) 0.03984(15) 0.8877(2) 0.0339(10) Uani 1 1 d . . .
H4 H 0.0299 0.0663 0.9107 0.044 Uiso 1 1 calc R . .
C3 C 0.0748(3) 0.00248(15) 0.9225(2) 0.0332(10) Uani 1 1 d . . .
H3 H 0.0943 0.0027 0.9700 0.043 Uiso 1 1 calc R . .
C2 C 0.0852(3) -0.03613(14) 0.8883(2) 0.0276(9) Uani 1 1 d . . .
H2 H 0.1141 -0.0616 0.9133 0.036 Uiso 1 1 calc R . .
C10' C 0.0181(3) -0.00111(13) 0.7865(2) 0.0242(9) Uani 1 1 d . . .
C10 C -0.0126(3) -0.00434(13) 0.71497(19) 0.0228(8) Uani 1 1 d . . .
N22 N 0.3243(2) 0.05799(11) 0.98378(16) 0.0258(7) Uani 1 1 d . . .
N12 N 0.2609(2) 0.05180(11) 0.84891(16) 0.0227(7) Uani 1 1 d . . .
C92 C 0.3547(3) 0.06095(14) 1.0500(2) 0.0310(10) Uani 1 1 d . . .
H92 H 0.3508 0.0889 1.0701 0.040 Uiso 1 1 calc R . .
C82 C 0.3924(3) 0.02467(15) 1.0915(2) 0.0385(11) Uani 1 1 d . . .
H82 H 0.4122 0.0280 1.1387 0.050 Uiso 1 1 calc R . .
C72 C 0.4005(3) -0.01560(15) 1.0632(2) 0.0379(11) Uani 1 1 d . . .
H72 H 0.4245 -0.0407 1.0908 0.049 Uiso 1 1 calc R . .
C6'2 C 0.3731(3) -0.01968(14) 0.9935(2) 0.0300(10) Uani 1 1 d . . .
C62 C 0.3849(3) -0.05947(14) 0.9601(2) 0.0347(10) Uani 1 1 d . . .
H62 H 0.4109 -0.0851 0.9858 0.045 Uiso 1 1 calc R . .
C52 C 0.3605(3) -0.06180(14) 0.8932(2) 0.0357(11) Uani 1 1 d . . .
H52 H 0.3715 -0.0886 0.8726 0.046 Uiso 1 1 calc R . .
C4'2 C 0.3180(3) -0.02446(14) 0.8526(2) 0.0287(9) Uani 1 1 d . . .
C42 C 0.2884(3) -0.02521(15) 0.7821(2) 0.0329(10) Uani 1 1 d . . .
H42 H 0.2974 -0.0513 0.7590 0.043 Uiso 1 1 calc R . .
C32 C 0.2465(3) 0.01199(15) 0.7474(2) 0.0321(10) Uani 1 1 d . . .
H32 H 0.2264 0.0120 0.6999 0.042 Uiso 1 1 calc R . .
C22 C 0.2338(3) 0.04972(14) 0.78238(19) 0.0290(9) Uani 1 1 d . . .
H22 H 0.2045 0.0752 0.7576 0.038 Uiso 1 1 calc R . .
C1'2 C 0.3034(3) 0.01496(13) 0.88404(19) 0.0230(8) Uani 1 1 d . . .
C102 C 0.3344(3) 0.01804(13) 0.9556(2) 0.0244(9) Uani 1 1 d . . .
N23 N -0.3196(2) 0.04576(11) 0.66169(16) 0.0256(7) Uani 1 1 d . . .
N13 N -0.3854(2) 0.03989(11) 0.52795(16) 0.0248(7) Uani 1 1 d . . .
C93 C -0.2837(3) 0.04922(14) 0.7279(2) 0.0292(9) Uani 1 1 d . . .
H93 H -0.2862 0.0773 0.7480 0.038 Uiso 1 1 calc R . .
C83 C -0.2424(3) 0.01317(15) 0.7692(2) 0.0359(11) Uani 1 1 d . . .
H83 H -0.2192 0.0168 0.8164 0.047 Uiso 1 1 calc R . .
C73 C -0.2358(3) -0.02702(15) 0.7413(2) 0.0373(11) Uani 1 1 d . . .
H73 H -0.2080 -0.0516 0.7689 0.049 Uiso 1 1 calc R . .
C6'3 C -0.2701(3) -0.03211(14) 0.6714(2) 0.0327(10) Uani 1 1 d . . .
C63 C -0.2631(3) -0.07263(15) 0.6375(3) 0.0407(12) Uani 1 1 d . . .
H63 H -0.2356 -0.0982 0.6628 0.053 Uiso 1 1 calc R . .
C53 C -0.2947(3) -0.07528(15) 0.5700(3) 0.0399(11) Uani 1 1 d . . .
H53 H -0.2891 -0.1026 0.5486 0.052 Uiso 1 1 calc R . .
C4'3 C -0.3364(3) -0.03737(14) 0.5305(2) 0.0314(10) Uani 1 1 d . . .
C43 C -0.3702(3) -0.03848(15) 0.4597(2) 0.0358(11) Uani 1 1 d . . .
H43 H -0.3652 -0.0649 0.4361 0.047 Uiso 1 1 calc R . .
C33 C -0.4099(3) -0.00081(15) 0.4260(2) 0.0341(10) Uani 1 1 d . . .
H33 H -0.4328 -0.0008 0.3785 0.044 Uiso 1 1 calc R . .
C23 C -0.4171(3) 0.03757(15) 0.4612(2) 0.0310(10) Uani 1 1 d . . .
H23 H -0.4457 0.0633 0.4368 0.040 Uiso 1 1 calc R . .
C1'3 C -0.3457(3) 0.00252(13) 0.5624(2) 0.0261(9) Uani 1 1 d . . .
C103 C -0.3114(3) 0.00549(13) 0.6334(2) 0.0265(9) Uani 1 1 d . . .
P1 P 0.08462(8) -0.14874(3) 0.69637(5) 0.0219(2) Uani 1 1 d . . .
P2 P 0.25707(7) 0.16546(3) 0.97504(5) 0.0215(2) Uani 1 1 d . . .
P3 P -0.40121(7) 0.14940(3) 0.65808(5) 0.0218(2) Uani 1 1 d . . .
C111 C 0.1727(3) -0.19272(13) 0.73346(19) 0.0258(9) Uani 1 1 d . . .
C112 C 0.2711(3) -0.18055(15) 0.7609(2) 0.0343(10) Uani 1 1 d . . .
H112 H 0.2898 -0.1503 0.7598 0.045 Uiso 1 1 calc R . .
C113 C 0.3417(4) -0.21191(18) 0.7897(2) 0.0435(12) Uani 1 1 d . . .
H113 H 0.4086 -0.2032 0.8084 0.057 Uiso 1 1 calc R . .
C114 C 0.3152(4) -0.25580(17) 0.7915(2) 0.0433(12) Uani 1 1 d . . .
H114 H 0.3636 -0.2774 0.8121 0.056 Uiso 1 1 calc R . .
C115 C 0.2183(4) -0.26843(16) 0.7634(2) 0.0404(12) Uani 1 1 d . . .
H115 H 0.2004 -0.2988 0.7641 0.053 Uiso 1 1 calc R . .
C116 C 0.1473(3) -0.23720(14) 0.7342(2) 0.0330(10) Uani 1 1 d . . .
H116 H 0.0809 -0.2462 0.7146 0.043 Uiso 1 1 calc R . .
C121 C -0.0341(3) -0.17567(13) 0.6647(2) 0.0254(9) Uani 1 1 d . . .
C122 C -0.0740(3) -0.19617(14) 0.7114(2) 0.0335(10) Uani 1 1 d . . .
H122 H -0.0372 -0.1964 0.7574 0.043 Uiso 1 1 calc R . .
C123 C -0.1651(4) -0.21573(16) 0.6913(3) 0.0447(12) Uani 1 1 d . . .
H123 H -0.1904 -0.2301 0.7231 0.058 Uiso 1 1 calc R . .
C124 C -0.2203(4) -0.21452(19) 0.6245(3) 0.0568(15) Uani 1 1 d . . .
H124 H -0.2834 -0.2282 0.6105 0.074 Uiso 1 1 calc R . .
C125 C -0.1838(4) -0.19346(19) 0.5786(3) 0.0565(15) Uani 1 1 d . . .
H125 H -0.2227 -0.1920 0.5331 0.073 Uiso 1 1 calc R . .
C126 C -0.0913(3) -0.17440(16) 0.5978(2) 0.0400(11) Uani 1 1 d . . .
H126 H -0.0664 -0.1604 0.5655 0.052 Uiso 1 1 calc R . .
C131 C 0.1281(3) -0.13257(14) 0.62618(19) 0.0267(9) Uani 1 1 d . . .
C132 C 0.1314(4) -0.16338(15) 0.5771(2) 0.0369(11) Uani 1 1 d . . .
H132 H 0.1060 -0.1925 0.5781 0.048 Uiso 1 1 calc R . .
C133 C 0.1715(4) -0.15159(16) 0.5273(2) 0.0437(12) Uani 1 1 d . . .
H133 H 0.1735 -0.1729 0.4942 0.057 Uiso 1 1 calc R . .
C134 C 0.2085(3) -0.10995(16) 0.5244(2) 0.0350(10) Uani 1 1 d . . .
H134 H 0.2363 -0.1024 0.4898 0.046 Uiso 1 1 calc R . .
C135 C 0.2050(3) -0.07871(16) 0.5725(2) 0.0354(10) Uani 1 1 d . . .
H135 H 0.2298 -0.0496 0.5707 0.046 Uiso 1 1 calc R . .
C136 C 0.1650(3) -0.09032(14) 0.6230(2) 0.0302(9) Uani 1 1 d . . .
H136 H 0.1629 -0.0690 0.6560 0.039 Uiso 1 1 calc R . .
C211 C 0.2283(3) 0.15286(13) 1.05242(19) 0.0244(9) Uani 1 1 d . . .
C212 C 0.1549(3) 0.12199(15) 1.0501(2) 0.0333(10) Uani 1 1 d . . .
H212 H 0.1249 0.1064 1.0097 0.043 Uiso 1 1 calc R . .
C213 C 0.1251(4) 0.11374(16) 1.1061(2) 0.0406(12) Uani 1 1 d . . .
H213 H 0.0751 0.0923 1.1041 0.053 Uiso 1 1 calc R . .
C214 C 0.1673(4) 0.13641(17) 1.1647(2) 0.0427(13) Uani 1 1 d . . .
H214 H 0.1447 0.1316 1.2026 0.055 Uiso 1 1 calc R . .
C215 C 0.2423(4) 0.16607(17) 1.1682(2) 0.0417(12) Uani 1 1 d . . .
H215 H 0.2734 0.1808 1.2092 0.054 Uiso 1 1 calc R . .
C216 C 0.2729(3) 0.17461(14) 1.1124(2) 0.0322(10) Uani 1 1 d . . .
H216 H 0.3244 0.1953 1.1152 0.042 Uiso 1 1 calc R . .
C221 C 0.1743(3) 0.21242(12) 0.94249(19) 0.0239(9) Uani 1 1 d . . .
C222 C 0.0851(3) 0.21553(14) 0.9570(2) 0.0310(10) Uani 1 1 d . . .
H222 H 0.0683 0.1936 0.9844 0.040 Uiso 1 1 calc R . .
C223 C 0.0207(3) 0.25015(16) 0.9318(2) 0.0385(11) Uani 1 1 d . . .
H223 H -0.0401 0.2519 0.9421 0.050 Uiso 1 1 calc R . .
C224 C 0.0445(4) 0.28206(16) 0.8920(2) 0.0412(12) Uani 1 1 d . . .
H224 H 0.0006 0.3061 0.8752 0.054 Uiso 1 1 calc R . .
C225 C 0.1323(4) 0.27901(14) 0.8766(2) 0.0409(12) Uani 1 1 d . . .
H225 H 0.1483 0.3007 0.8485 0.053 Uiso 1 1 calc R . .
C226 C 0.1972(3) 0.24449(14) 0.9018(2) 0.0331(10) Uani 1 1 d . . .
H226 H 0.2577 0.2427 0.8913 0.043 Uiso 1 1 calc R . .
C231 C 0.3801(3) 0.18997(13) 0.99944(19) 0.0256(9) Uani 1 1 d . . .
C232 C 0.3980(3) 0.23314(14) 1.0234(2) 0.0324(10) Uani 1 1 d . . .
H232 H 0.3448 0.2506 1.0284 0.042 Uiso 1 1 calc R . .
C233 C 0.4913(4) 0.25107(16) 1.0402(2) 0.0404(11) Uani 1 1 d . . .
H233 H 0.5022 0.2805 1.0573 0.053 Uiso 1 1 calc R . .
C234 C 0.5684(3) 0.22658(17) 1.0322(2) 0.0423(12) Uani 1 1 d . . .
H234 H 0.6325 0.2393 1.0431 0.055 Uiso 1 1 calc R . .
C235 C 0.5534(3) 0.18383(17) 1.0087(3) 0.0452(12) Uani 1 1 d . . .
H235 H 0.6071 0.1668 1.0035 0.059 Uiso 1 1 calc R . .
C236 C 0.4589(3) 0.16533(15) 0.9922(2) 0.0343(10) Uani 1 1 d . . .
H236 H 0.4486 0.1357 0.9760 0.045 Uiso 1 1 calc R . .
C311 C -0.4811(3) 0.19679(13) 0.62553(19) 0.0250(9) Uani 1 1 d . . .
C312 C -0.5824(3) 0.18990(14) 0.6102(2) 0.0300(9) Uani 1 1 d . . .
H312 H -0.6066 0.1612 0.6162 0.039 Uiso 1 1 calc R . .
C313 C -0.6480(3) 0.22409(15) 0.5866(2) 0.0363(11) Uani 1 1 d . . .
H313 H -0.7169 0.2191 0.5768 0.047 Uiso 1 1 calc R . .
C314 C -0.6134(4) 0.26566(15) 0.5771(2) 0.0390(11) Uani 1 1 d . . .
H314 H -0.6587 0.2891 0.5599 0.051 Uiso 1 1 calc R . .
C315 C -0.5145(4) 0.27322(14) 0.5921(2) 0.0352(11) Uani 1 1 d . . .
H315 H -0.4913 0.3020 0.5859 0.046 Uiso 1 1 calc R . .
C316 C -0.4469(3) 0.23890(13) 0.6167(2) 0.0289(9) Uani 1 1 d . . .
H316 H -0.3780 0.2444 0.6273 0.038 Uiso 1 1 calc R . .
C321 C -0.4492(3) 0.13403(13) 0.72669(19) 0.0249(9) Uani 1 1 d . . .
C322 C -0.4567(3) 0.16570(15) 0.7732(2) 0.0318(10) Uani 1 1 d . . .
H322 H -0.4315 0.1948 0.7714 0.041 Uiso 1 1 calc R . .
C323 C -0.5005(3) 0.15523(16) 0.8223(2) 0.0395(11) Uani 1 1 d . . .
H323 H -0.5054 0.1770 0.8539 0.051 Uiso 1 1 calc R . .
C324 C -0.5369(3) 0.11289(17) 0.8249(2) 0.0394(11) Uani 1 1 d . . .
H324 H -0.5662 0.1056 0.8588 0.051 Uiso 1 1 calc R . .
C325 C -0.5312(3) 0.08130(17) 0.7789(2) 0.0390(11) Uani 1 1 d . . .
H325 H -0.5567 0.0523 0.7810 0.051 Uiso 1 1 calc R . .
C326 C -0.4878(3) 0.09195(14) 0.7290(2) 0.0308(10) Uani 1 1 d . . .
H326 H -0.4848 0.0703 0.6967 0.040 Uiso 1 1 calc R . .
C331 C -0.2779(3) 0.17254(13) 0.69299(19) 0.0230(8) Uani 1 1 d . . .
C332 C -0.2262(3) 0.18391(16) 0.6483(2) 0.0371(11) Uani 1 1 d . . .
H332 H -0.2561 0.1801 0.6016 0.048 Uiso 1 1 calc R . .
C333 C -0.1314(3) 0.20077(17) 0.6715(3) 0.0456(13) Uani 1 1 d . . .
H333 H -0.0966 0.2085 0.6407 0.059 Uiso 1 1 calc R . .
C334 C -0.0870(3) 0.20644(16) 0.7394(2) 0.0428(12) Uani 1 1 d . . .
H334 H -0.0225 0.2186 0.7552 0.056 Uiso 1 1 calc R . .
C335 C -0.1370(3) 0.19437(15) 0.7837(2) 0.0389(11) Uani 1 1 d . . .
H335 H -0.1064 0.1978 0.8304 0.051 Uiso 1 1 calc R . .
C336 C -0.2313(3) 0.17734(14) 0.7611(2) 0.0305(10) Uani 1 1 d . . .
H336 H -0.2647 0.1688 0.7923 0.040 Uiso 1 1 calc R . .
P1F P -0.14655(9) -0.11034(5) 0.40883(6) 0.0384(3) Uani 1 1 d . . .
P2F P -0.18308(10) 0.11273(5) 0.93647(6) 0.0415(3) Uani 1 1 d . . .
P3F P 0.49222(9) 0.09681(5) 1.26494(6) 0.0408(3) Uani 1 1 d . . .
F1 F -0.1365(3) -0.16164(12) 0.4199(2) 0.0898(12) Uani 1 1 d . . .
F2 F -0.1576(4) -0.05843(14) 0.4007(3) 0.142(2) Uani 1 1 d . . .
F3 F -0.2059(4) -0.11086(18) 0.4608(3) 0.146(2) Uani 1 1 d . . .
F4 F -0.0923(5) -0.1080(2) 0.3570(3) 0.162(3) Uani 1 1 d . . .
F5 F -0.2455(4) -0.11537(19) 0.3529(3) 0.151(3) Uani 1 1 d . . .
F6 F -0.0520(3) -0.10270(16) 0.4681(2) 0.127(2) Uani 1 1 d . . .
F7 F -0.1611(4) 0.06167(14) 0.9503(2) 0.1172(18) Uani 1 1 d . . .
F8 F -0.2796(4) 0.10154(16) 0.8792(2) 0.131(2) Uani 1 1 d . . .
F9 F -0.2410(3) 0.11131(17) 0.9889(2) 0.1117(16) Uani 1 1 d . . .
F10 F -0.0883(3) 0.1227(2) 0.9943(2) 0.153(3) Uani 1 1 d . . .
F11 F -0.2055(3) 0.16331(11) 0.92158(17) 0.0781(11) Uani 1 1 d . . .
F12 F -0.1247(5) 0.11263(19) 0.8846(3) 0.160(3) Uani 1 1 d . . .
F13 F 0.4734(3) 0.14838(12) 1.26327(18) 0.0778(11) Uani 1 1 d . . .
F14 F 0.3829(2) 0.08795(10) 1.21966(16) 0.0583(8) Uani 1 1 d . . .
F15 F 0.5120(3) 0.04448(12) 1.2642(2) 0.0867(12) Uani 1 1 d . . .
F16 F 0.6026(3) 0.10362(16) 1.3092(2) 0.0994(14) Uani 1 1 d . . .
F17 F 0.5260(3) 0.10138(13) 1.19972(19) 0.0836(12) Uani 1 1 d . . .
F18 F 0.4603(3) 0.09033(17) 1.33003(18) 0.1011(15) 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'
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'
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
C1L Pt1 N1 91.44(14) . . ?
C1L Pt1 N2 169.66(15) . . ?
N1 Pt1 N2 78.86(12) . . ?
C1L Pt1 P1 89.49(12) . . ?
N1 Pt1 P1 178.44(9) . . ?
N2 Pt1 P1 100.29(9) . . ?
C2L Pt2 N12 92.84(16) . . ?
C2L Pt2 N22 171.42(16) . . ?
N12 Pt2 N22 78.72(13) . . ?
C2L Pt2 P2 88.42(13) . . ?
N12 Pt2 P2 175.18(9) . . ?
N22 Pt2 P2 100.11(9) . . ?
C3L Pt3 N13 92.95(15) . . ?
C3L Pt3 N23 171.25(16) . . ?
N13 Pt3 N23 78.56(13) . . ?
C3L Pt3 P3 89.38(13) . . ?
N13 Pt3 P3 177.65(9) . . ?
N23 Pt3 P3 99.12(9) . . ?
C9 N2 C10 117.0(3) . . ?
C9 N2 Pt1 130.7(3) . . ?
C10 N2 Pt1 112.2(2) . . ?
C2 N1 C10' 117.8(3) . . ?
C2 N1 Pt1 128.0(3) . . ?
C10' N1 Pt1 114.1(2) . . ?
N2 C9 C8 123.6(4) . . ?
C7 C8 C9 119.4(4) . . ?
C8 C7 C6' 119.4(4) . . ?
C10 C6' C7 117.7(4) . . ?
C10 C6' C6 119.1(4) . . ?
C7 C6' C6 123.2(4) . . ?
C5 C6 C6' 121.4(4) . . ?
C6 C5 C4' 120.9(4) . . ?
C10' C4' C4 117.5(4) . . ?
C10' C4' C5 118.7(4) . . ?
C4 C4' C5 123.9(4) . . ?
C3 C4 C4' 119.6(4) . . ?
C4 C3 C2 119.8(4) . . ?
N1 C2 C3 122.5(4) . . ?
N1 C10' C4' 122.8(4) . . ?
N1 C10' C10 117.1(3) . . ?
C4' C10' C10 120.1(4) . . ?
N2 C10 C6' 122.8(4) . . ?
N2 C10 C10' 117.4(3) . . ?
C6' C10 C10' 119.8(4) . . ?
C92 N22 C102 117.9(3) . . ?
C92 N22 Pt2 130.1(3) . . ?
C102 N22 Pt2 111.9(3) . . ?
C22 N12 C1'2 118.0(3) . . ?
C22 N12 Pt2 128.2(3) . . ?
C1'2 N12 Pt2 113.8(2) . . ?
N22 C92 C82 122.9(4) . . ?
C72 C82 C92 119.2(4) . . ?
C82 C72 C6'2 119.7(4) . . ?
C102 C6'2 C72 117.5(4) . . ?
C102 C6'2 C62 119.0(4) . . ?
C72 C6'2 C62 123.4(4) . . ?
C52 C62 C6'2 121.8(4) . . ?
C62 C52 C4'2 120.9(4) . . ?
C1'2 C4'2 C42 117.8(4) . . ?
C1'2 C4'2 C52 118.6(4) . . ?
C42 C4'2 C52 123.6(4) . . ?
C32 C42 C4'2 119.4(4) . . ?
C42 C32 C22 119.3(4) . . ?
N12 C22 C32 123.2(4) . . ?
N12 C1'2 C4'2 122.4(4) . . ?
N12 C1'2 C102 117.4(3) . . ?
C4'2 C1'2 C102 120.2(4) . . ?
N22 C102 C6'2 122.7(4) . . ?
N22 C102 C1'2 118.0(3) . . ?
C6'2 C102 C1'2 119.2(4) . . ?
C93 N23 C103 117.7(3) . . ?
C93 N23 Pt3 129.8(3) . . ?
C103 N23 Pt3 112.5(3) . . ?
C23 N13 C1'3 117.9(4) . . ?
C23 N13 Pt3 128.2(3) . . ?
C1'3 N13 Pt3 113.9(3) . . ?
N23 C93 C83 122.9(4) . . ?
C73 C83 C93 119.5(4) . . ?
C83 C73 C6'3 119.8(4) . . ?
C103 C6'3 C73 117.2(4) . . ?
C103 C6'3 C63 119.0(4) . . ?
C73 C6'3 C63 123.8(4) . . ?
C53 C63 C6'3 121.3(4) . . ?
C63 C53 C4'3 120.6(4) . . ?
C1'3 C4'3 C43 118.0(4) . . ?
C1'3 C4'3 C53 119.4(4) . . ?
C43 C4'3 C53 122.6(4) . . ?
C33 C43 C4'3 118.7(4) . . ?
C43 C33 C23 120.0(4) . . ?
N13 C23 C33 122.9(4) . . ?
N13 C1'3 C4'3 122.5(4) . . ?
N13 C1'3 C103 117.4(4) . . ?
C4'3 C1'3 C103 120.1(4) . . ?
N23 C103 C6'3 122.8(4) . . ?
N23 C103 C1'3 117.4(4) . . ?
C6'3 C103 C1'3 119.7(4) . . ?
C121 P1 C131 109.02(19) . . ?
C121 P1 C111 106.08(19) . . ?
C131 P1 C111 100.54(18) . . ?
C121 P1 Pt1 108.21(13) . . ?
C131 P1 Pt1 114.36(14) . . ?
C111 P1 Pt1 118.01(13) . . ?
C231 P2 C211 106.46(18) . . ?
C231 P2 C221 104.35(19) . . ?
C211 P2 C221 101.66(18) . . ?
C231 P2 Pt2 110.13(14) . . ?
C211 P2 Pt2 114.05(13) . . ?
C221 P2 Pt2 119.02(13) . . ?
C321 P3 C331 108.68(18) . . ?
C321 P3 C311 98.97(18) . . ?
C331 P3 C311 105.58(18) . . ?
C321 P3 Pt3 114.76(14) . . ?
C331 P3 Pt3 108.85(13) . . ?
C311 P3 Pt3 119.14(13) . . ?
C116 C111 C112 118.7(4) . . ?
C116 C111 P1 123.8(3) . . ?
C112 C111 P1 117.5(3) . . ?
C113 C112 C111 120.7(4) . . ?
C114 C113 C112 120.0(5) . . ?
C113 C114 C115 119.9(4) . . ?
C114 C115 C116 120.4(5) . . ?
C115 C116 C111 120.2(4) . . ?
C126 C121 C122 118.3(4) . . ?
C126 C121 P1 123.8(3) . . ?
C122 C121 P1 117.7(3) . . ?
C123 C122 C121 120.8(4) . . ?
C122 C123 C124 119.9(5) . . ?
C125 C124 C123 120.0(5) . . ?
C124 C125 C126 120.8(5) . . ?
C125 C126 C121 120.1(5) . . ?
C136 C131 C132 118.7(4) . . ?
C136 C131 P1 120.5(3) . . ?
C132 C131 P1 120.7(3) . . ?
C133 C132 C131 120.0(4) . . ?
C134 C133 C132 121.5(4) . . ?
C133 C134 C135 119.3(4) . . ?
C136 C135 C134 119.6(4) . . ?
C135 C136 C131 121.0(4) . . ?
C212 C211 C216 118.9(4) . . ?
C212 C211 P2 118.2(3) . . ?
C216 C211 P2 122.9(3) . . ?
C213 C212 C211 120.5(4) . . ?
C214 C213 C212 120.4(5) . . ?
C215 C214 C213 119.6(4) . . ?
C214 C215 C216 120.5(4) . . ?
C215 C216 C211 120.1(4) . . ?
C226 C221 C222 118.8(4) . . ?
C226 C221 P2 121.4(3) . . ?
C222 C221 P2 119.7(3) . . ?
C223 C222 C221 120.7(4) . . ?
C224 C223 C222 120.1(5) . . ?
C223 C224 C225 119.8(4) . . ?
C224 C225 C226 120.4(4) . . ?
C225 C226 C221 120.3(4) . . ?
C232 C231 C236 118.2(4) . . ?
C232 C231 P2 122.5(3) . . ?
C236 C231 P2 119.4(3) . . ?
C233 C232 C231 121.2(4) . . ?
C234 C233 C232 120.1(4) . . ?
C235 C234 C233 120.2(4) . . ?
C234 C235 C236 119.8(5) . . ?
C231 C236 C235 120.5(4) . . ?
C316 C311 C312 118.9(4) . . ?
C316 C311 P3 124.0(3) . . ?
C312 C311 P3 117.1(3) . . ?
C313 C312 C311 120.9(4) . . ?
C314 C313 C312 119.8(4) . . ?
C315 C314 C313 120.3(4) . . ?
C314 C315 C316 120.6(4) . . ?
C311 C316 C315 119.5(4) . . ?
C326 C321 C322 119.2(4) . . ?
C326 C321 P3 120.2(3) . . ?
C322 C321 P3 120.2(3) . . ?
C323 C322 C321 120.6(4) . . ?
C324 C323 C322 119.6(4) . . ?
C325 C324 C323 120.7(4) . . ?
C324 C325 C326 119.7(4) . . ?
C321 C326 C325 120.1(4) . . ?
C336 C331 C332 118.6(4) . . ?
C336 C331 P3 124.0(3) . . ?
C332 C331 P3 117.4(3) . . ?
C333 C332 C331 120.4(4) . . ?
C334 C333 C332 120.3(4) . . ?
C335 C334 C333 119.5(4) . . ?
C334 C335 C336 120.6(4) . . ?
C335 C336 C331 120.6(4) . . ?
F4 P1F F5 90.2(3) . . ?
F4 P1F F6 93.6(3) . . ?
F5 P1F F6 175.1(4) . . ?
F4 P1F F3 177.3(3) . . ?
F5 P1F F3 88.3(4) . . ?
F6 P1F F3 87.8(3) . . ?
F4 P1F F1 96.3(3) . . ?
F5 P1F F1 92.2(3) . . ?
F6 P1F F1 90.5(2) . . ?
F3 P1F F1 86.0(3) . . ?
F4 P1F F2 86.1(4) . . ?
F5 P1F F2 88.6(3) . . ?
F6 P1F F2 88.5(3) . . ?
F3 P1F F2 91.6(3) . . ?
F1 P1F F2 177.4(3) . . ?
F12 P2F F10 91.5(3) . . ?
F12 P2F F9 178.3(3) . . ?
F10 P2F F9 88.4(3) . . ?
F12 P2F F8 89.5(4) . . ?
F10 P2F F8 178.4(3) . . ?
F9 P2F F8 90.5(3) . . ?
F12 P2F F11 88.9(2) . . ?
F10 P2F F11 92.6(3) . . ?
F9 P2F F11 92.8(2) . . ?
F8 P2F F11 88.7(2) . . ?
F12 P2F F7 90.5(3) . . ?
F10 P2F F7 88.1(3) . . ?
F9 P2F F7 87.8(3) . . ?
F8 P2F F7 90.7(3) . . ?
F11 P2F F7 179.2(2) . . ?
F18 P3F F13 92.9(2) . . ?
F18 P3F F16 90.0(2) . . ?
F13 P3F F16 91.0(2) . . ?
F18 P3F F17 177.7(3) . . ?
F13 P3F F17 89.3(2) . . ?
F16 P3F F17 89.6(2) . . ?
F18 P3F F14 90.8(2) . . ?
F13 P3F F14 91.31(18) . . ?
F16 P3F F14 177.5(2) . . ?
F17 P3F F14 89.6(2) . . ?
F18 P3F F15 89.1(3) . . ?
F13 P3F F15 178.0(2) . . ?
F16 P3F F15 89.2(2) . . ?
F17 P3F F15 88.7(2) . . ?
F14 P3F F15 88.41(19) . . ?
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 C1L 2.037(4) . ?
Pt1 N1 2.096(3) . ?
Pt1 N2 2.136(3) . ?
Pt1 P1 2.2223(10) . ?
Pt2 C2L 2.039(4) . ?
Pt2 N12 2.107(3) . ?
Pt2 N22 2.156(3) . ?
Pt2 P2 2.2265(10) . ?
Pt3 C3L 2.048(4) . ?
Pt3 N13 2.100(3) . ?
Pt3 N23 2.136(3) . ?
Pt3 P3 2.2236(10) . ?
N2 C9 1.327(5) . ?
N2 C10 1.373(5) . ?
N1 C2 1.335(5) . ?
N1 C10' 1.366(5) . ?
C9 C8 1.399(6) . ?
C8 C7 1.357(6) . ?
C7 C6' 1.410(6) . ?
C6' C10 1.400(6) . ?
C6' C6 1.427(6) . ?
C6 C5 1.347(6) . ?
C5 C4' 1.441(6) . ?
C4' C10' 1.401(6) . ?
C4' C4 1.403(6) . ?
C4 C3 1.361(6) . ?
C3 C2 1.396(6) . ?
C10' C10 1.434(5) . ?
N22 C92 1.327(5) . ?
N22 C102 1.365(5) . ?
N12 C22 1.332(5) . ?
N12 C1'2 1.367(5) . ?
C92 C82 1.398(6) . ?
C82 C72 1.368(6) . ?
C72 C6'2 1.399(6) . ?
C6'2 C102 1.401(6) . ?
C6'2 C62 1.422(6) . ?
C62 C52 1.340(6) . ?
C52 C4'2 1.430(6) . ?
C4'2 C1'2 1.401(5) . ?
C4'2 C42 1.408(6) . ?
C42 C32 1.370(6) . ?
C32 C22 1.391(6) . ?
C1'2 C102 1.433(5) . ?
N23 C93 1.332(5) . ?
N23 C103 1.368(5) . ?
N13 C23 1.337(5) . ?
N13 C1'3 1.363(5) . ?
C93 C83 1.402(6) . ?
C83 C73 1.358(6) . ?
C73 C6'3 1.408(6) . ?
C6'3 C103 1.406(6) . ?
C6'3 C63 1.429(6) . ?
C63 C53 1.352(7) . ?
C53 C4'3 1.430(6) . ?
C4'3 C1'3 1.398(6) . ?
C4'3 C43 1.416(6) . ?
C43 C33 1.365(6) . ?
C33 C23 1.389(6) . ?
C1'3 C103 1.424(6) . ?
P1 C121 1.809(4) . ?
P1 C131 1.822(4) . ?
P1 C111 1.827(4) . ?
P2 C231 1.823(4) . ?
P2 C211 1.824(4) . ?
P2 C221 1.835(4) . ?
P3 C321 1.823(4) . ?
P3 C331 1.823(4) . ?
P3 C311 1.823(4) . ?
C111 C116 1.387(6) . ?
C111 C112 1.393(6) . ?
C112 C113 1.377(6) . ?
C113 C114 1.376(7) . ?
C114 C115 1.379(7) . ?
C115 C116 1.381(6) . ?
C121 C126 1.395(6) . ?
C121 C122 1.410(6) . ?
C122 C123 1.368(6) . ?
C123 C124 1.386(8) . ?
C124 C125 1.375(8) . ?
C125 C126 1.379(7) . ?
C131 C136 1.383(6) . ?
C131 C132 1.394(6) . ?
C132 C133 1.374(6) . ?
C133 C134 1.367(7) . ?
C134 C135 1.389(6) . ?
C135 C136 1.386(6) . ?
C211 C212 1.386(6) . ?
C211 C216 1.391(6) . ?
C212 C213 1.383(6) . ?
C213 C214 1.377(7) . ?
C214 C215 1.374(7) . ?
C215 C216 1.386(6) . ?
C221 C226 1.388(6) . ?
C221 C222 1.390(6) . ?
C222 C223 1.383(6) . ?
C223 C224 1.378(7) . ?
C224 C225 1.381(7) . ?
C225 C226 1.384(6) . ?
C231 C232 1.388(6) . ?
C231 C236 1.388(6) . ?
C232 C233 1.376(6) . ?
C233 C234 1.371(7) . ?
C234 C235 1.371(7) . ?
C235 C236 1.398(6) . ?
C311 C316 1.389(6) . ?
C311 C312 1.393(6) . ?
C312 C313 1.377(6) . ?
C313 C314 1.379(7) . ?
C314 C315 1.364(7) . ?
C315 C316 1.400(6) . ?
C321 C326 1.386(6) . ?
C321 C322 1.389(6) . ?
C322 C323 1.386(6) . ?
C323 C324 1.381(7) . ?
C324 C325 1.371(7) . ?
C325 C326 1.399(6) . ?
C331 C336 1.390(5) . ?
C331 C332 1.392(6) . ?
C332 C333 1.384(6) . ?
C333 C334 1.383(7) . ?
C334 C335 1.375(7) . ?
C335 C336 1.379(6) . ?
P1F F4 1.507(4) . ?
P1F F5 1.546(4) . ?
P1F F6 1.551(4) . ?
P1F F3 1.562(4) . ?
P1F F1 1.560(4) . ?
P1F F2 1.573(4) . ?
P2F F12 1.549(4) . ?
P2F F10 1.549(4) . ?
P2F F9 1.556(4) . ?
P2F F8 1.566(4) . ?
P2F F11 1.566(4) . ?
P2F F7 1.577(4) . ?
P3F F18 1.571(4) . ?
P3F F13 1.573(4) . ?
P3F F16 1.579(4) . ?
P3F F17 1.583(4) . ?
P3F F14 1.583(3) . ?
P3F F15 1.600(4) . ?
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
C1L Pt1 N2 C9 -155.9(8) . . . . ?
N1 Pt1 N2 C9 -176.3(4) . . . . ?
P1 Pt1 N2 C9 5.0(4) . . . . ?
C1L Pt1 N2 C10 25.7(10) . . . . ?
N1 Pt1 N2 C10 5.3(3) . . . . ?
P1 Pt1 N2 C10 -173.4(2) . . . . ?
C1L Pt1 N1 C2 2.9(3) . . . . ?
N2 Pt1 N1 C2 179.3(3) . . . . ?
P1 Pt1 N1 C2 -124(3) . . . . ?
C1L Pt1 N1 C10' 178.9(3) . . . . ?
N2 Pt1 N1 C10' -4.7(3) . . . . ?
P1 Pt1 N1 C10' 52(4) . . . . ?
C10 N2 C9 C8 3.9(6) . . . . ?
Pt1 N2 C9 C8 -174.5(3) . . . . ?
N2 C9 C8 C7 -1.1(7) . . . . ?
C9 C8 C7 C6' -2.1(7) . . . . ?
C8 C7 C6' C10 2.4(6) . . . . ?
C8 C7 C6' C6 -175.9(4) . . . . ?
C10 C6' C6 C5 -0.5(7) . . . . ?
C7 C6' C6 C5 177.8(4) . . . . ?
C6' C6 C5 C4' 0.9(7) . . . . ?
C6 C5 C4' C10' 0.1(6) . . . . ?
C6 C5 C4' C4 -179.9(4) . . . . ?
C10' C4' C4 C3 0.7(6) . . . . ?
C5 C4' C4 C3 -179.3(4) . . . . ?
C4' C4 C3 C2 0.5(6) . . . . ?
C10' N1 C2 C3 2.3(6) . . . . ?
Pt1 N1 C2 C3 178.2(3) . . . . ?
C4 C3 C2 N1 -2.1(7) . . . . ?
C2 N1 C10' C4' -1.0(6) . . . . ?
Pt1 N1 C10' C4' -177.5(3) . . . . ?
C2 N1 C10' C10 179.9(3) . . . . ?
Pt1 N1 C10' C10 3.5(4) . . . . ?
C4 C4' C10' N1 -0.5(6) . . . . ?
C5 C4' C10' N1 179.5(4) . . . . ?
C4 C4' C10' C10 178.5(4) . . . . ?
C5 C4' C10' C10 -1.5(6) . . . . ?
C9 N2 C10 C6' -3.5(6) . . . . ?
Pt1 N2 C10 C6' 175.2(3) . . . . ?
C9 N2 C10 C10' 176.2(4) . . . . ?
Pt1 N2 C10 C10' -5.2(4) . . . . ?
C7 C6' C10 N2 0.4(6) . . . . ?
C6 C6' C10 N2 178.8(4) . . . . ?
C7 C6' C10 C10' -179.2(4) . . . . ?
C6 C6' C10 C10' -0.8(6) . . . . ?
N1 C10' C10 N2 1.3(5) . . . . ?
C4' C10' C10 N2 -177.8(4) . . . . ?
N1 C10' C10 C6' -179.1(4) . . . . ?
C4' C10' C10 C6' 1.8(6) . . . . ?
C2L Pt2 N22 C92 -169.0(11) . . . . ?
N12 Pt2 N22 C92 -179.4(4) . . . . ?
P2 Pt2 N22 C92 5.3(4) . . . . ?
C2L Pt2 N22 C102 7.9(13) . . . . ?
N12 Pt2 N22 C102 -2.5(3) . . . . ?
P2 Pt2 N22 C102 -177.7(2) . . . . ?
C2L Pt2 N12 C22 5.1(4) . . . . ?
N22 Pt2 N12 C22 -176.4(4) . . . . ?
P2 Pt2 N12 C22 -100.0(11) . . . . ?
C2L Pt2 N12 C1'2 -177.6(3) . . . . ?
N22 Pt2 N12 C1'2 0.8(3) . . . . ?
P2 Pt2 N12 C1'2 77.3(12) . . . . ?
C102 N22 C92 C82 -2.8(6) . . . . ?
Pt2 N22 C92 C82 174.0(3) . . . . ?
N22 C92 C82 C72 1.3(7) . . . . ?
C92 C82 C72 C6'2 1.4(7) . . . . ?
C82 C72 C6'2 C102 -2.5(7) . . . . ?
C82 C72 C6'2 C62 175.8(4) . . . . ?
C102 C6'2 C62 C52 0.2(7) . . . . ?
C72 C6'2 C62 C52 -178.1(4) . . . . ?
C6'2 C62 C52 C4'2 -2.2(7) . . . . ?
C62 C52 C4'2 C1'2 0.8(6) . . . . ?
C62 C52 C4'2 C42 -178.3(4) . . . . ?
C1'2 C4'2 C42 C32 -0.4(6) . . . . ?
C52 C4'2 C42 C32 178.7(4) . . . . ?
C4'2 C42 C32 C22 -0.1(6) . . . . ?
C1'2 N12 C22 C32 0.2(6) . . . . ?
Pt2 N12 C22 C32 177.3(3) . . . . ?
C42 C32 C22 N12 0.3(7) . . . . ?
C22 N12 C1'2 C4'2 -0.8(6) . . . . ?
Pt2 N12 C1'2 C4'2 -178.3(3) . . . . ?
C22 N12 C1'2 C102 178.5(4) . . . . ?
Pt2 N12 C1'2 C102 0.9(4) . . . . ?
C42 C4'2 C1'2 N12 0.9(6) . . . . ?
C52 C4'2 C1'2 N12 -178.3(4) . . . . ?
C42 C4'2 C1'2 C102 -178.3(4) . . . . ?
C52 C4'2 C1'2 C102 2.5(6) . . . . ?
C92 N22 C102 C6'2 1.5(6) . . . . ?
Pt2 N22 C102 C6'2 -175.8(3) . . . . ?
C92 N22 C102 C1'2 -178.8(4) . . . . ?
Pt2 N22 C102 C1'2 3.8(4) . . . . ?
C72 C6'2 C102 N22 1.0(6) . . . . ?
C62 C6'2 C102 N22 -177.4(4) . . . . ?
C72 C6'2 C102 C1'2 -178.6(4) . . . . ?
C62 C6'2 C102 C1'2 3.0(6) . . . . ?
N12 C1'2 C102 N22 -3.3(5) . . . . ?
C4'2 C1'2 C102 N22 176.0(4) . . . . ?
N12 C1'2 C102 C6'2 176.3(4) . . . . ?
C4'2 C1'2 C102 C6'2 -4.4(6) . . . . ?
C3L Pt3 N23 C93 163.1(10) . . . . ?
N13 Pt3 N23 C93 177.2(4) . . . . ?
P3 Pt3 N23 C93 -3.2(4) . . . . ?
C3L Pt3 N23 C103 -18.6(12) . . . . ?
N13 Pt3 N23 C103 -4.6(3) . . . . ?
P3 Pt3 N23 C103 175.1(2) . . . . ?
C3L Pt3 N13 C23 -0.9(4) . . . . ?
N23 Pt3 N13 C23 -178.8(4) . . . . ?
P3 Pt3 N13 C23 172(2) . . . . ?
C3L Pt3 N13 C1'3 -178.0(3) . . . . ?
N23 Pt3 N13 C1'3 4.1(3) . . . . ?
P3 Pt3 N13 C1'3 -5(2) . . . . ?
C103 N23 C93 C83 -2.8(6) . . . . ?
Pt3 N23 C93 C83 175.3(3) . . . . ?
N23 C93 C83 C73 1.7(7) . . . . ?
C93 C83 C73 C6'3 0.2(7) . . . . ?
C83 C73 C6'3 C103 -0.7(6) . . . . ?
C83 C73 C6'3 C63 177.7(4) . . . . ?
C103 C6'3 C63 C53 0.4(7) . . . . ?
C73 C6'3 C63 C53 -178.0(4) . . . . ?
C6'3 C63 C53 C4'3 -0.1(7) . . . . ?
C63 C53 C4'3 C1'3 -0.9(7) . . . . ?
C63 C53 C4'3 C43 179.7(4) . . . . ?
C1'3 C4'3 C43 C33 0.0(6) . . . . ?
C53 C4'3 C43 C33 179.4(4) . . . . ?
C4'3 C43 C33 C23 -0.2(6) . . . . ?
C1'3 N13 C23 C33 -0.9(6) . . . . ?
Pt3 N13 C23 C33 -177.8(3) . . . . ?
C43 C33 C23 N13 0.7(7) . . . . ?
C23 N13 C1'3 C4'3 0.6(6) . . . . ?
Pt3 N13 C1'3 C4'3 178.0(3) . . . . ?
C23 N13 C1'3 C103 179.5(4) . . . . ?
Pt3 N13 C1'3 C103 -3.2(4) . . . . ?
C43 C4'3 C1'3 N13 -0.1(6) . . . . ?
C53 C4'3 C1'3 N13 -179.6(4) . . . . ?
C43 C4'3 C1'3 C103 -179.0(4) . . . . ?
C53 C4'3 C1'3 C103 1.6(6) . . . . ?
C93 N23 C103 C6'3 2.1(6) . . . . ?
Pt3 N23 C103 C6'3 -176.3(3) . . . . ?
C93 N23 C103 C1'3 -177.1(3) . . . . ?
Pt3 N23 C103 C1'3 4.4(4) . . . . ?
C73 C6'3 C103 N23 -0.4(6) . . . . ?
C63 C6'3 C103 N23 -179.0(4) . . . . ?
C73 C6'3 C103 C1'3 178.8(4) . . . . ?
C63 C6'3 C103 C1'3 0.3(6) . . . . ?
N13 C1'3 C103 N23 -0.9(5) . . . . ?
C4'3 C1'3 C103 N23 178.0(4) . . . . ?
N13 C1'3 C103 C6'3 179.8(4) . . . . ?
C4'3 C1'3 C103 C6'3 -1.3(6) . . . . ?
C1L Pt1 P1 C121 99.95(19) . . . . ?
N1 Pt1 P1 C121 -134(3) . . . . ?
N2 Pt1 P1 C121 -76.69(17) . . . . ?
C1L Pt1 P1 C131 -138.33(19) . . . . ?
N1 Pt1 P1 C131 -12(3) . . . . ?
N2 Pt1 P1 C131 45.02(17) . . . . ?
C1L Pt1 P1 C111 -20.4(2) . . . . ?
N1 Pt1 P1 C111 106(3) . . . . ?
N2 Pt1 P1 C111 162.96(18) . . . . ?
C2L Pt2 P2 C231 -103.1(2) . . . . ?
N12 Pt2 P2 C231 2.1(11) . . . . ?
N22 Pt2 P2 C231 77.70(16) . . . . ?
C2L Pt2 P2 C211 137.3(2) . . . . ?
N12 Pt2 P2 C211 -117.5(11) . . . . ?
N22 Pt2 P2 C211 -41.91(17) . . . . ?
C2L Pt2 P2 C221 17.2(2) . . . . ?
N12 Pt2 P2 C221 122.5(11) . . . . ?
N22 Pt2 P2 C221 -161.96(18) . . . . ?
C3L Pt3 P3 C321 131.9(2) . . . . ?
N13 Pt3 P3 C321 -41(2) . . . . ?
N23 Pt3 P3 C321 -50.17(17) . . . . ?
C3L Pt3 P3 C331 -106.09(19) . . . . ?
N13 Pt3 P3 C331 81(2) . . . . ?
N23 Pt3 P3 C331 71.85(16) . . . . ?
C3L Pt3 P3 C311 14.9(2) . . . . ?
N13 Pt3 P3 C311 -158(2) . . . . ?
N23 Pt3 P3 C311 -167.15(18) . . . . ?
C121 P1 C111 C116 0.7(4) . . . . ?
C131 P1 C111 C116 -112.8(4) . . . . ?
Pt1 P1 C111 C116 122.2(3) . . . . ?
C121 P1 C111 C112 179.1(3) . . . . ?
C131 P1 C111 C112 65.6(3) . . . . ?
Pt1 P1 C111 C112 -59.5(3) . . . . ?
C116 C111 C112 C113 -1.5(6) . . . . ?
P1 C111 C112 C113 -180.0(3) . . . . ?
C111 C112 C113 C114 0.0(7) . . . . ?
C112 C113 C114 C115 1.2(7) . . . . ?
C113 C114 C115 C116 -0.9(7) . . . . ?
C114 C115 C116 C111 -0.5(7) . . . . ?
C112 C111 C116 C115 1.7(6) . . . . ?
P1 C111 C116 C115 -179.9(3) . . . . ?
C131 P1 C121 C126 -13.6(4) . . . . ?
C111 P1 C121 C126 -121.2(4) . . . . ?
Pt1 P1 C121 C126 111.3(4) . . . . ?
C131 P1 C121 C122 171.4(3) . . . . ?
C111 P1 C121 C122 63.9(4) . . . . ?
Pt1 P1 C121 C122 -63.7(3) . . . . ?
C126 C121 C122 C123 2.3(6) . . . . ?
P1 C121 C122 C123 177.6(4) . . . . ?
C121 C122 C123 C124 -1.7(7) . . . . ?
C122 C123 C124 C125 -0.3(8) . . . . ?
C123 C124 C125 C126 1.7(9) . . . . ?
C124 C125 C126 C121 -1.1(8) . . . . ?
C122 C121 C126 C125 -0.9(7) . . . . ?
P1 C121 C126 C125 -175.9(4) . . . . ?
C121 P1 C131 C136 132.7(3) . . . . ?
C111 P1 C131 C136 -116.0(4) . . . . ?
Pt1 P1 C131 C136 11.5(4) . . . . ?
C121 P1 C131 C132 -51.8(4) . . . . ?
C111 P1 C131 C132 59.4(4) . . . . ?
Pt1 P1 C131 C132 -173.1(3) . . . . ?
C136 C131 C132 C133 0.5(7) . . . . ?
P1 C131 C132 C133 -175.0(4) . . . . ?
C131 C132 C133 C134 -0.2(8) . . . . ?
C132 C133 C134 C135 -0.4(7) . . . . ?
C133 C134 C135 C136 0.6(7) . . . . ?
C134 C135 C136 C131 -0.2(7) . . . . ?
C132 C131 C136 C135 -0.3(6) . . . . ?
P1 C131 C136 C135 175.2(3) . . . . ?
C231 P2 C211 C212 -160.0(3) . . . . ?
C221 P2 C211 C212 91.0(4) . . . . ?
Pt2 P2 C211 C212 -38.4(4) . . . . ?
C231 P2 C211 C216 23.6(4) . . . . ?
C221 P2 C211 C216 -85.4(4) . . . . ?
Pt2 P2 C211 C216 145.2(3) . . . . ?
C216 C211 C212 C213 1.5(6) . . . . ?
P2 C211 C212 C213 -175.0(3) . . . . ?
C211 C212 C213 C214 0.6(7) . . . . ?
C212 C213 C214 C215 -2.6(7) . . . . ?
C213 C214 C215 C216 2.6(7) . . . . ?
C214 C215 C216 C211 -0.5(7) . . . . ?
C212 C211 C216 C215 -1.5(6) . . . . ?
P2 C211 C216 C215 174.8(3) . . . . ?
C231 P2 C221 C226 41.6(4) . . . . ?
C211 P2 C221 C226 152.2(3) . . . . ?
Pt2 P2 C221 C226 -81.6(4) . . . . ?
C231 P2 C221 C222 -140.3(3) . . . . ?
C211 P2 C221 C222 -29.7(4) . . . . ?
Pt2 P2 C221 C222 96.4(3) . . . . ?
C226 C221 C222 C223 -0.5(6) . . . . ?
P2 C221 C222 C223 -178.7(3) . . . . ?
C221 C222 C223 C224 0.0(7) . . . . ?
C222 C223 C224 C225 0.8(7) . . . . ?
C223 C224 C225 C226 -1.0(7) . . . . ?
C224 C225 C226 C221 0.5(7) . . . . ?
C222 C221 C226 C225 0.3(6) . . . . ?
P2 C221 C226 C225 178.4(3) . . . . ?
C211 P2 C231 C232 -74.7(4) . . . . ?
C221 P2 C231 C232 32.4(4) . . . . ?
Pt2 P2 C231 C232 161.2(3) . . . . ?
C211 P2 C231 C236 107.2(4) . . . . ?
C221 P2 C231 C236 -145.7(3) . . . . ?
Pt2 P2 C231 C236 -16.9(4) . . . . ?
C236 C231 C232 C233 -0.5(6) . . . . ?
P2 C231 C232 C233 -178.6(3) . . . . ?
C231 C232 C233 C234 1.2(7) . . . . ?
C232 C233 C234 C235 -1.1(7) . . . . ?
C233 C234 C235 C236 0.5(8) . . . . ?
C232 C231 C236 C235 -0.1(7) . . . . ?
P2 C231 C236 C235 178.1(4) . . . . ?
C234 C235 C236 C231 0.1(7) . . . . ?
C321 P3 C311 C316 125.6(4) . . . . ?
C331 P3 C311 C316 13.2(4) . . . . ?
Pt3 P3 C311 C316 -109.4(3) . . . . ?
C321 P3 C311 C312 -53.0(3) . . . . ?
C331 P3 C311 C312 -165.3(3) . . . . ?
Pt3 P3 C311 C312 72.0(3) . . . . ?
C316 C311 C312 C313 0.2(6) . . . . ?
P3 C311 C312 C313 178.8(3) . . . . ?
C311 C312 C313 C314 0.7(7) . . . . ?
C312 C313 C314 C315 -1.2(7) . . . . ?
C313 C314 C315 C316 0.7(7) . . . . ?
C312 C311 C316 C315 -0.7(6) . . . . ?
P3 C311 C316 C315 -179.2(3) . . . . ?
C314 C315 C316 C311 0.2(6) . . . . ?
C331 P3 C321 C326 -129.1(3) . . . . ?
C311 P3 C321 C326 121.0(3) . . . . ?
Pt3 P3 C321 C326 -7.0(4) . . . . ?
C331 P3 C321 C322 57.5(4) . . . . ?
C311 P3 C321 C322 -52.4(4) . . . . ?
Pt3 P3 C321 C322 179.6(3) . . . . ?
C326 C321 C322 C323 1.2(6) . . . . ?
P3 C321 C322 C323 174.7(3) . . . . ?
C321 C322 C323 C324 0.1(7) . . . . ?
C322 C323 C324 C325 -0.8(7) . . . . ?
C323 C324 C325 C326 0.2(7) . . . . ?
C322 C321 C326 C325 -1.8(6) . . . . ?
P3 C321 C326 C325 -175.3(3) . . . . ?
C324 C325 C326 C321 1.1(7) . . . . ?
C321 P3 C331 C336 -0.4(4) . . . . ?
C311 P3 C331 C336 104.9(4) . . . . ?
Pt3 P3 C331 C336 -126.1(3) . . . . ?
C321 P3 C331 C332 176.3(3) . . . . ?
C311 P3 C331 C332 -78.3(4) . . . . ?
Pt3 P3 C331 C332 50.7(4) . . . . ?
C336 C331 C332 C333 -1.7(7) . . . . ?
P3 C331 C332 C333 -178.6(4) . . . . ?
C331 C332 C333 C334 0.1(8) . . . . ?
C332 C333 C334 C335 1.3(8) . . . . ?
C333 C334 C335 C336 -1.0(7) . . . . ?
C334 C335 C336 C331 -0.7(7) . . . . ?
C332 C331 C336 C335 2.1(6) . . . . ?
P3 C331 C336 C335 178.7(3) . . . . ?
