#------------------------------------------------------------------------------
#$Date: 2016-03-25 09:35:27 +0100 (vie 25 de mar de 2016) $
#$Revision: 179755 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/51/7005121.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_7005121
loop_
_publ_author_name
'Braun, Leonie'
'Liptau, Patrick'
'Kehr, Gerald'
'Ugolotti, Juri'
'Fröhlich, Roland'
'Erker, Gerhard'
_publ_section_title
;
 Bis(diphenylphosphino)acetonitrile: synthesis, ligand properties and
 application in catalytic carbon-carbon coupling.
;
_journal_issue                   14
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              1409
_journal_page_last               1415
_journal_paper_doi               10.1039/b616847g
_journal_year                    2007
_chemical_formula_sum            'C28 H25 Cl6 N P2 Pt'
_chemical_formula_weight         845.22
_chemical_name_systematic
;
?
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 112.99(1)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   25.648(1)
_cell_length_b                   13.987(1)
_cell_length_c                   19.879(1)
_cell_measurement_temperature    198(2)
_cell_volume                     6564.9(8)
_computing_cell_refinement       'Collect (Nonius B.V., 1998)'
_computing_data_collection       'Collect (Nonius B.V., 1998)'
_computing_data_reduction        'Denzo-SMN (Otwinowski & Minor, 1997)'
_computing_molecular_graphics    'SCHAKAL (Keller, 1997)'
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      198(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Nonius KappaCCD'
_diffrn_measurement_method       'ω and φ scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'rotating anode Nonius FR591'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0511
_diffrn_reflns_av_sigmaI/netI    0.0514
_diffrn_reflns_limit_h_max       26
_diffrn_reflns_limit_h_min       -33
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_number            22018
_diffrn_reflns_theta_full        27.85
_diffrn_reflns_theta_max         27.85
_diffrn_reflns_theta_min         1.83
_exptl_absorpt_coefficient_mu    4.880
_exptl_absorpt_correction_T_max  0.5281
_exptl_absorpt_correction_T_min  0.4419
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SORTAV (Blessing, 1995 & 1997)'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.710
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             3280
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.15
_refine_diff_density_max         1.900
_refine_diff_density_min         -1.715
_refine_diff_density_rms         0.158
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.024
_refine_ls_hydrogen_treatment    riding
_refine_ls_matrix_type           full
_refine_ls_number_parameters     333
_refine_ls_number_reflns         7798
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.024
_refine_ls_R_factor_all          0.0651
_refine_ls_R_factor_gt           0.0462
_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)+(0.0779P)²+16.3703P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1228
_refine_ls_wR_factor_ref         0.1332
_reflns_number_gt                6003
_reflns_number_total             7798
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b616847g.txt
_cod_data_source_block           erk3010
_cod_original_cell_volume        6564.9(6)
_cod_original_sg_symbol_H-M      C2/c
_cod_database_code               7005121
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -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
Pt Pt 0.216952(9) 0.899874(15) 0.236584(11) 0.03277(9) Uani 1 1 d . . .
Cl1 Cl 0.18479(7) 0.79707(11) 0.30621(8) 0.0420(3) Uani 1 1 d . . .
Cl2 Cl 0.17803(7) 0.80069(11) 0.13328(8) 0.0461(4) Uani 1 1 d . . .
C1 C 0.2628(3) 1.1016(4) 0.2587(3) 0.0344(12) Uani 1 1 d . . .
H1 H 0.3007 1.1336 0.2773 0.041 Uiso 1 1 calc R . .
C2 C 0.2154(3) 1.1669(5) 0.2350(3) 0.0386(13) Uani 1 1 d . . .
N3 N 0.1769(3) 1.2164(4) 0.2151(3) 0.0537(14) Uani 1 1 d . . .
P1 P 0.25306(6) 1.00886(11) 0.18648(8) 0.0343(3) Uani 1 1 d . . .
C11 C 0.2101(3) 1.0578(4) 0.0986(3) 0.0384(13) Uani 1 1 d . . .
C12 C 0.2351(4) 1.1030(5) 0.0564(4) 0.0510(17) Uani 1 1 d . . .
H12 H 0.2751 1.1085 0.0739 0.061 Uiso 1 1 calc R . .
C13 C 0.2010(4) 1.1401(6) -0.0117(4) 0.062(2) Uani 1 1 d . . .
H13 H 0.2174 1.1717 -0.0410 0.075 Uiso 1 1 calc R . .
C14 C 0.1436(4) 1.1304(6) -0.0356(4) 0.066(2) Uani 1 1 d . . .
H14 H 0.1205 1.1555 -0.0822 0.080 Uiso 1 1 calc R . .
C15 C 0.1180(4) 1.0860(6) 0.0045(5) 0.066(2) Uani 1 1 d . . .
H15 H 0.0780 1.0805 -0.0136 0.079 Uiso 1 1 calc R . .
C16 C 0.1521(3) 1.0487(5) 0.0730(4) 0.0484(16) Uani 1 1 d . . .
H16 H 0.1353 1.0172 0.1018 0.058 Uiso 1 1 calc R . .
C21 C 0.3218(3) 0.9832(5) 0.1868(3) 0.0400(14) Uani 1 1 d . . .
C22 C 0.3322(3) 0.8922(5) 0.1676(4) 0.0494(17) Uani 1 1 d . . .
H22 H 0.3042 0.8439 0.1584 0.059 Uiso 1 1 calc R . .
C23 C 0.3824(4) 0.8709(6) 0.1618(5) 0.067(2) Uani 1 1 d . . .
H23 H 0.3888 0.8087 0.1474 0.080 Uiso 1 1 calc R . .
C24 C 0.4243(4) 0.9418(7) 0.1773(6) 0.077(3) Uani 1 1 d . . .
H24 H 0.4588 0.9280 0.1721 0.092 Uiso 1 1 calc R . .
C25 C 0.4156(4) 1.0297(7) 0.1996(6) 0.081(3) Uani 1 1 d . . .
H25 H 0.4450 1.0760 0.2132 0.097 Uiso 1 1 calc R . .
C26 C 0.3633(3) 1.0526(5) 0.2029(5) 0.062(2) Uani 1 1 d . . .
H26 H 0.3565 1.1153 0.2161 0.074 Uiso 1 1 calc R . .
P2 P 0.25431(6) 1.00906(11) 0.32220(8) 0.0336(3) Uani 1 1 d . . .
C31 C 0.2115(3) 1.0582(5) 0.3675(3) 0.0403(14) Uani 1 1 d . . .
C32 C 0.1535(3) 1.0504(5) 0.3343(4) 0.0474(16) Uani 1 1 d . . .
H32 H 0.1363 1.0193 0.2884 0.057 Uiso 1 1 calc R . .
C33 C 0.1203(4) 1.0885(6) 0.3686(5) 0.063(2) Uani 1 1 d . . .
H33 H 0.0802 1.0840 0.3460 0.076 Uiso 1 1 calc R . .
C34 C 0.1450(4) 1.1320(6) 0.4344(5) 0.068(2) Uani 1 1 d . . .
H34 H 0.1219 1.1569 0.4577 0.082 Uiso 1 1 calc R . .
C35 C 0.2031(4) 1.1408(6) 0.4683(4) 0.062(2) Uani 1 1 d . . .
H35 H 0.2197 1.1728 0.5140 0.074 Uiso 1 1 calc R . .
C36 C 0.2369(4) 1.1029(5) 0.4353(4) 0.0506(17) Uani 1 1 d . . .
H36 H 0.2769 1.1072 0.4585 0.061 Uiso 1 1 calc R . .
C41 C 0.3238(3) 0.9847(4) 0.3911(3) 0.0389(13) Uani 1 1 d . . .
C42 C 0.3653(3) 1.0539(6) 0.4177(4) 0.061(2) Uani 1 1 d . . .
H42 H 0.3587 1.1163 0.3971 0.073 Uiso 1 1 calc R . .
C43 C 0.4162(4) 1.0332(7) 0.4736(5) 0.080(3) Uani 1 1 d . . .
H43 H 0.4446 1.0812 0.4914 0.096 Uiso 1 1 calc R . .
C44 C 0.4261(4) 0.9441(7) 0.5033(5) 0.075(3) Uani 1 1 d . . .
H44 H 0.4613 0.9301 0.5422 0.090 Uiso 1 1 calc R . .
C45 C 0.3858(4) 0.8745(6) 0.4775(5) 0.067(2) Uani 1 1 d . . .
H45 H 0.3930 0.8126 0.4989 0.080 Uiso 1 1 calc R . .
C46 C 0.3339(3) 0.8932(5) 0.4200(4) 0.0491(16) Uani 1 1 d . . .
H46 H 0.3063 0.8443 0.4012 0.059 Uiso 1 1 calc R . .
C51 C -0.0440(6) 1.2202(11) 0.3847(7) 0.122(4) Uiso 1 1 d . . .
H51A H -0.0643 1.2804 0.3847 0.146 Uiso 1 1 calc R . .
H51B H -0.0709 1.1664 0.3770 0.146 Uiso 1 1 calc R . .
Cl52 Cl -0.0209(2) 1.2227(5) 0.3170(4) 0.231(3) Uani 1 1 d . . .
Cl53 Cl 0.00979(19) 1.2073(5) 0.4641(3) 0.216(3) Uani 1 1 d . . .
C61 C -0.0492(6) 1.1764(10) -0.1769(8) 0.123(4) Uiso 1 1 d . . .
H61A H -0.0690 1.1826 -0.2305 0.147 Uiso 1 1 calc R . .
H61B H -0.0772 1.1907 -0.1553 0.147 Uiso 1 1 calc R . .
Cl62 Cl -0.02760(19) 1.0575(4) -0.1567(3) 0.183(2) Uani 1 1 d . . .
Cl63 Cl 0.00186(19) 1.2597(3) -0.1478(2) 0.1522(16) 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'
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'
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
P2 Pt P1 74.84(5) . . ?
P2 Pt Cl2 171.56(5) . . ?
P1 Pt Cl2 97.05(5) . . ?
P2 Pt Cl1 96.62(5) . . ?
P1 Pt Cl1 171.42(5) . . ?
Cl2 Pt Cl1 91.51(5) . . ?
C2 C1 P2 110.6(4) . . ?
C2 C1 P1 110.1(4) . . ?
P2 C1 P1 91.2(2) . . ?
N3 C2 C1 177.9(7) . . ?
C21 P1 C11 107.9(3) . . ?
C21 P1 C1 107.3(3) . . ?
C11 P1 C1 109.1(3) . . ?
C21 P1 Pt 116.4(2) . . ?
C11 P1 Pt 119.7(2) . . ?
C1 P1 Pt 94.93(19) . . ?
C21 P1 P2 111.7(2) . . ?
C11 P1 P2 137.6(2) . . ?
C1 P1 P2 44.40(18) . . ?
Pt P1 P2 52.50(5) . . ?
C16 C11 C12 120.3(6) . . ?
C16 C11 P1 119.1(5) . . ?
C12 C11 P1 120.5(5) . . ?
C11 C12 C13 119.6(8) . . ?
C14 C13 C12 118.8(7) . . ?
C13 C14 C15 122.8(7) . . ?
C14 C15 C16 118.5(8) . . ?
C11 C16 C15 119.9(7) . . ?
C26 C21 C22 119.7(6) . . ?
C26 C21 P1 121.8(5) . . ?
C22 C21 P1 118.5(5) . . ?
C23 C22 C21 120.8(7) . . ?
C22 C23 C24 119.4(7) . . ?
C25 C24 C23 120.2(8) . . ?
C24 C25 C26 120.2(8) . . ?
C21 C26 C25 119.4(7) . . ?
C31 P2 C41 107.8(3) . . ?
C31 P2 C1 109.0(3) . . ?
C41 P2 C1 107.5(3) . . ?
C31 P2 Pt 118.8(2) . . ?
C41 P2 Pt 117.2(2) . . ?
C1 P2 Pt 95.05(18) . . ?
C31 P2 P1 136.9(2) . . ?
C41 P2 P1 112.5(2) . . ?
C1 P2 P1 44.36(18) . . ?
Pt P2 P1 52.66(5) . . ?
C32 C31 C36 120.4(6) . . ?
C32 C31 P2 119.1(5) . . ?
C36 C31 P2 120.5(5) . . ?
C31 C32 C33 119.4(7) . . ?
C34 C33 C32 120.0(8) . . ?
C33 C34 C35 121.4(7) . . ?
C34 C35 C36 119.4(8) . . ?
C35 C36 C31 119.4(8) . . ?
C42 C41 C46 119.8(6) . . ?
C42 C41 P2 122.8(5) . . ?
C46 C41 P2 117.3(5) . . ?
C43 C42 C41 120.5(7) . . ?
C44 C43 C42 120.1(8) . . ?
C43 C44 C45 120.3(8) . . ?
C44 C45 C46 120.9(7) . . ?
C41 C46 C45 118.4(7) . . ?
Cl53 C51 Cl52 110.2(8) . . ?
Cl63 C61 Cl62 116.4(8) . . ?
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 P2 2.2076(15) . ?
Pt P1 2.2122(15) . ?
Pt Cl2 2.3531(15) . ?
Pt Cl1 2.3571(14) . ?
C1 C2 1.444(9) . ?
C1 P2 1.879(6) . ?
C1 P1 1.878(6) . ?
C2 N3 1.143(8) . ?
P1 C21 1.797(6) . ?
P1 C11 1.798(6) . ?
P1 P2 2.686(2) . ?
C11 C16 1.378(9) . ?
C11 C12 1.389(10) . ?
C12 C13 1.394(10) . ?
C13 C14 1.366(12) . ?
C14 C15 1.365(13) . ?
C15 C16 1.400(10) . ?
C21 C26 1.383(9) . ?
C21 C22 1.385(9) . ?
C22 C23 1.369(10) . ?
C23 C24 1.405(13) . ?
C24 C25 1.356(12) . ?
C25 C26 1.405(11) . ?
P2 C31 1.804(6) . ?
P2 C41 1.805(6) . ?
C31 C32 1.377(9) . ?
C31 C36 1.395(9) . ?
C32 C33 1.389(10) . ?
C33 C34 1.355(13) . ?
C34 C35 1.379(12) . ?
C35 C36 1.382(11) . ?
C41 C42 1.384(9) . ?
C41 C46 1.385(8) . ?
C42 C43 1.375(11) . ?
C43 C44 1.360(12) . ?
C44 C45 1.366(12) . ?
C45 C46 1.399(10) . ?
C51 Cl53 1.652(13) . ?
C51 Cl52 1.669(13) . ?
C61 Cl63 1.678(14) . ?
C61 Cl62 1.750(14) . ?
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 C1 C2 N3 -69(19) . . . . ?
P1 C1 C2 N3 30(19) . . . . ?
C2 C1 P1 C21 143.9(4) . . . . ?
P2 C1 P1 C21 -103.6(3) . . . . ?
C2 C1 P1 C11 27.2(5) . . . . ?
P2 C1 P1 C11 139.7(3) . . . . ?
C2 C1 P1 Pt -96.5(4) . . . . ?
P2 C1 P1 Pt 15.9(2) . . . . ?
C2 C1 P1 P2 -112.5(5) . . . . ?
P2 Pt P1 C21 98.1(2) . . . . ?
Cl2 Pt P1 C21 -84.3(2) . . . . ?
Cl1 Pt P1 C21 92.4(4) . . . . ?
P2 Pt P1 C11 -129.4(2) . . . . ?
Cl2 Pt P1 C11 48.2(2) . . . . ?
Cl1 Pt P1 C11 -135.1(4) . . . . ?
P2 Pt P1 C1 -14.0(2) . . . . ?
Cl2 Pt P1 C1 163.6(2) . . . . ?
Cl1 Pt P1 C1 -19.7(5) . . . . ?
Cl2 Pt P1 P2 177.59(6) . . . . ?
Cl1 Pt P1 P2 -5.7(4) . . . . ?
C21 P1 C11 C16 154.5(5) . . . . ?
C1 P1 C11 C16 -89.2(6) . . . . ?
Pt P1 C11 C16 18.4(6) . . . . ?
P2 P1 C11 C16 -47.1(7) . . . . ?
C21 P1 C11 C12 -24.5(6) . . . . ?
C1 P1 C11 C12 91.8(6) . . . . ?
Pt P1 C11 C12 -160.6(4) . . . . ?
P2 P1 C11 C12 133.9(5) . . . . ?
C16 C11 C12 C13 0.8(10) . . . . ?
P1 C11 C12 C13 179.8(6) . . . . ?
C11 C12 C13 C14 -0.6(11) . . . . ?
C12 C13 C14 C15 0.3(13) . . . . ?
C13 C14 C15 C16 -0.2(13) . . . . ?
C12 C11 C16 C15 -0.7(10) . . . . ?
P1 C11 C16 C15 -179.7(6) . . . . ?
C14 C15 C16 C11 0.4(11) . . . . ?
C11 P1 C21 C26 84.4(7) . . . . ?
C1 P1 C21 C26 -33.1(7) . . . . ?
Pt P1 C21 C26 -137.9(6) . . . . ?
P2 P1 C21 C26 -80.2(6) . . . . ?
C11 P1 C21 C22 -93.2(6) . . . . ?
C1 P1 C21 C22 149.3(5) . . . . ?
Pt P1 C21 C22 44.5(6) . . . . ?
P2 P1 C21 C22 102.2(5) . . . . ?
C26 C21 C22 C23 -2.4(11) . . . . ?
P1 C21 C22 C23 175.2(6) . . . . ?
C21 C22 C23 C24 1.6(13) . . . . ?
C22 C23 C24 C25 1.7(15) . . . . ?
C23 C24 C25 C26 -4.2(16) . . . . ?
C22 C21 C26 C25 0.0(12) . . . . ?
P1 C21 C26 C25 -177.6(7) . . . . ?
C24 C25 C26 C21 3.3(15) . . . . ?
C2 C1 P2 C31 -26.8(5) . . . . ?
P1 C1 P2 C31 -138.8(3) . . . . ?
C2 C1 P2 C41 -143.4(4) . . . . ?
P1 C1 P2 C41 104.6(3) . . . . ?
C2 C1 P2 Pt 96.1(4) . . . . ?
P1 C1 P2 Pt -16.0(2) . . . . ?
C2 C1 P2 P1 112.0(5) . . . . ?
P1 Pt P2 C31 128.9(2) . . . . ?
Cl2 Pt P2 C31 112.4(4) . . . . ?
Cl1 Pt P2 C31 -51.9(2) . . . . ?
P1 Pt P2 C41 -98.6(2) . . . . ?
Cl2 Pt P2 C41 -115.1(4) . . . . ?
Cl1 Pt P2 C41 80.5(2) . . . . ?
P1 Pt P2 C1 14.0(2) . . . . ?
Cl2 Pt P2 C1 -2.5(5) . . . . ?
Cl1 Pt P2 C1 -166.8(2) . . . . ?
Cl2 Pt P2 P1 -16.5(4) . . . . ?
Cl1 Pt P2 P1 179.14(6) . . . . ?
C21 P1 P2 C31 158.6(4) . . . . ?
C11 P1 P2 C31 0.7(5) . . . . ?
C1 P1 P2 C31 65.7(4) . . . . ?
Pt P1 P2 C31 -94.2(3) . . . . ?
C21 P1 P2 C41 0.5(3) . . . . ?
C11 P1 P2 C41 -157.3(4) . . . . ?
C1 P1 P2 C41 -92.4(4) . . . . ?
Pt P1 P2 C41 107.8(2) . . . . ?
C21 P1 P2 C1 92.9(4) . . . . ?
C11 P1 P2 C1 -65.0(4) . . . . ?
Pt P1 P2 C1 -159.8(3) . . . . ?
C21 P1 P2 Pt -107.2(2) . . . . ?
C11 P1 P2 Pt 94.9(3) . . . . ?
C1 P1 P2 Pt 159.8(3) . . . . ?
C41 P2 C31 C32 -156.2(5) . . . . ?
C1 P2 C31 C32 87.4(6) . . . . ?
Pt P2 C31 C32 -19.8(6) . . . . ?
P1 P2 C31 C32 45.0(7) . . . . ?
C41 P2 C31 C36 23.4(6) . . . . ?
C1 P2 C31 C36 -93.0(6) . . . . ?
Pt P2 C31 C36 159.8(5) . . . . ?
P1 P2 C31 C36 -135.3(5) . . . . ?
C36 C31 C32 C33 0.7(11) . . . . ?
P2 C31 C32 C33 -179.7(6) . . . . ?
C31 C32 C33 C34 -0.6(12) . . . . ?
C32 C33 C34 C35 0.9(13) . . . . ?
C33 C34 C35 C36 -1.3(13) . . . . ?
C34 C35 C36 C31 1.4(11) . . . . ?
C32 C31 C36 C35 -1.1(10) . . . . ?
P2 C31 C36 C35 179.3(6) . . . . ?
C31 P2 C41 C42 -83.2(7) . . . . ?
C1 P2 C41 C42 34.1(7) . . . . ?
Pt P2 C41 C42 139.6(6) . . . . ?
P1 P2 C41 C42 81.2(6) . . . . ?
C31 P2 C41 C46 93.8(6) . . . . ?
C1 P2 C41 C46 -148.8(5) . . . . ?
Pt P2 C41 C46 -43.4(6) . . . . ?
P1 P2 C41 C46 -101.7(5) . . . . ?
C46 C41 C42 C43 -1.3(12) . . . . ?
P2 C41 C42 C43 175.7(7) . . . . ?
C41 C42 C43 C44 0.0(15) . . . . ?
C42 C43 C44 C45 0.5(16) . . . . ?
C43 C44 C45 C46 0.4(15) . . . . ?
C42 C41 C46 C45 2.2(11) . . . . ?
P2 C41 C46 C45 -175.0(6) . . . . ?
C44 C45 C46 C41 -1.7(13) . . . . ?
