#------------------------------------------------------------------------------
#$Date: 2016-02-20 05:06:23 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176774 $
#$URL: svn://www.crystallography.net/cod/cif/2/20/74/2207462.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2207462
loop_
_publ_author_name
'Lutz, Martin'
'Spek, Anthony L.'
'Kreiter, Robert'
'Klein Gebbink, Robertus J. M.'
'Koten, Gerard van'
_publ_section_title
trans-Dichlorobis(tris{4-[(dimethylamino)methyl]phenyl}phosphine)platinum(II)
_journal_coeditor_code           BT6791
_journal_issue                   12
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m2728
_journal_page_last               m2729
_journal_paper_doi               10.1107/S1600536805038882
_journal_volume                  61
_journal_year                    2005
_chemical_formula_iupac          '[Pt Cl2 (C27 H36 N3 P1)2]'
_chemical_formula_moiety         'C54 H72 Cl2 N6 P2 Pt'
_chemical_formula_sum            'C54 H72 Cl2 N6 P2 Pt'
_chemical_formula_weight         1133.11
_chemical_name_systematic
;
trans-Dichlorobis(tris{4-[(dimethylamino)methyl]phenyl}phosphine)platinum(II)
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/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                 94.9554(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   13.11220(10)
_cell_length_b                   17.62000(10)
_cell_length_c                   11.61800(10)
_cell_measurement_reflns_used    43969
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      27.48
_cell_measurement_theta_min      1.02
_cell_volume                     2674.15(3)
_computing_cell_refinement       'HKL2000 (Otwinowski & Minor, 1997)'
_computing_data_collection       'COLLECT (Nonius, 1999)'
_computing_data_reduction
;
HKL2000, DENZOX (Farrugia, 2004) and SADABS (Sheldrick, 2002)
;
_computing_molecular_graphics    'PLATON (Spek, 2003)'
_computing_publication_material  'manually editing SHELXL97 output'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      150(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Nonius KappaCCD'
_diffrn_measurement_method       'φ and ω'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'rotating anode'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0381
_diffrn_reflns_av_sigmaI/netI    0.0217
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            57383
_diffrn_reflns_theta_full        27.50
_diffrn_reflns_theta_max         27.50
_diffrn_reflns_theta_min         1.94
_exptl_absorpt_coefficient_mu    2.824
_exptl_absorpt_correction_T_max  0.78
_exptl_absorpt_correction_T_min  0.62
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS; Sheldrick, 2002)'
_exptl_crystal_colour            yellowish
_exptl_crystal_density_diffrn    1.407
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1160
_exptl_crystal_size_max          0.27
_exptl_crystal_size_mid          0.09
_exptl_crystal_size_min          0.09
_refine_diff_density_max         0.843
_refine_diff_density_min         -0.496
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.037
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     301
_refine_ls_number_reflns         6131
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.037
_refine_ls_R_factor_all          0.0292
_refine_ls_R_factor_gt           0.0203
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0197P)²+2.3473P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0469
_refine_ls_wR_factor_ref         0.0500
_reflns_number_gt                5028
_reflns_number_total             6131
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            bt6791.cif
_cod_data_source_block           I
_cod_original_cell_volume        2674.16(3)
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               2207462
_cod_database_fobs_code          2207462
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_occupancy
_atom_site_type_symbol
Pt1 0.5000 0.5000 0.5000 0.01778(4) Uani d S 1 Pt
Cl1 0.67425(4) 0.51413(3) 0.53872(5) 0.02918(13) Uani d . 1 Cl
P1 0.50904(4) 0.51907(3) 0.30349(5) 0.01878(11) Uani d . 1 P
N1 0.20169(17) 0.23248(12) 0.0739(2) 0.0389(5) Uani d . 1 N
N2 0.21225(15) 0.77656(11) 0.01699(18) 0.0321(5) Uani d . 1 N
N3 1.02199(15) 0.52548(13) 0.23664(18) 0.0321(5) Uani d . 1 N
C11 0.43711(16) 0.44688(12) 0.21934(18) 0.0205(4) Uani d . 1 C
C12 0.37972(17) 0.46236(13) 0.11618(19) 0.0236(5) Uani d . 1 C
H12 0.3735 0.5131 0.0889 0.028 Uiso calc R 1 H
C13 0.33130(17) 0.40397(13) 0.05250(19) 0.0264(5) Uani d . 1 C
H13 0.2917 0.4156 -0.0177 0.032 Uiso calc R 1 H
C14 0.33928(17) 0.32905(13) 0.0888(2) 0.0270(5) Uani d . 1 C
C15 0.39626(19) 0.31364(13) 0.1932(2) 0.0317(5) Uani d . 1 C
H15 0.4028 0.2628 0.2202 0.038 Uiso calc R 1 H
C16 0.44340(18) 0.37193(13) 0.2578(2) 0.0291(5) Uani d . 1 C
H16 0.4807 0.3606 0.3295 0.035 Uiso calc R 1 H
C17 0.2852(2) 0.26743(14) 0.0170(2) 0.0362(6) Uani d . 1 C
H17A 0.2573 0.2892 -0.0577 0.043 Uiso calc R 1 H
H17B 0.3354 0.2278 0.0006 0.043 Uiso calc R 1 H
C18 0.1293(2) 0.28785(18) 0.1088(3) 0.0569(9) Uani d . 1 C
H18A 0.1019 0.3169 0.0411 0.085 Uiso calc R 1 H
H18B 0.1638 0.3224 0.1657 0.085 Uiso calc R 1 H
H18C 0.0732 0.2619 0.1430 0.085 Uiso calc R 1 H
C19 0.1498(2) 0.17720(16) -0.0053(3) 0.0503(8) Uani d . 1 C
H19A 0.0945 0.1527 0.0325 0.075 Uiso calc R 1 H
H19B 0.1991 0.1387 -0.0259 0.075 Uiso calc R 1 H
H19C 0.1213 0.2032 -0.0753 0.075 Uiso calc R 1 H
C21 0.45621(16) 0.61024(12) 0.25173(18) 0.0199(4) Uani d . 1 C
C22 0.46979(17) 0.63671(12) 0.14063(19) 0.0233(5) Uani d . 1 C
H22 0.5155 0.6112 0.0947 0.028 Uiso calc R 1 H
C23 0.41679(17) 0.70013(12) 0.09704(19) 0.0245(5) Uani d . 1 C
H23 0.4265 0.7176 0.0214 0.029 Uiso calc R 1 H
C24 0.34945(17) 0.73839(12) 0.16345(19) 0.0238(5) Uani d . 1 C
C25 0.34154(18) 0.71457(12) 0.27606(19) 0.0263(5) Uani d . 1 C
H25 0.3000 0.7424 0.3242 0.032 Uiso calc R 1 H
C26 0.39363(17) 0.65051(13) 0.31955(19) 0.0252(5) Uani d . 1 C
H26 0.3861 0.6344 0.3964 0.030 Uiso calc R 1 H
C27 0.28317(18) 0.80230(12) 0.1129(2) 0.0273(5) Uani d . 1 C
H27A 0.2438 0.8241 0.1739 0.033 Uiso calc R 1 H
H27B 0.3274 0.8428 0.0854 0.033 Uiso calc R 1 H
C28 0.1540(2) 0.84024(16) -0.0341(2) 0.0413(6) Uani d . 1 C
H28A 0.1101 0.8227 -0.1014 0.062 Uiso calc R 1 H
H28B 0.2011 0.8791 -0.0584 0.062 Uiso calc R 1 H
H28C 0.1114 0.8619 0.0230 0.062 Uiso calc R 1 H
C29 0.1430(2) 0.71944(16) 0.0549(3) 0.0542(8) Uani d . 1 C
H29A 0.1038 0.7407 0.1154 0.081 Uiso calc R 1 H
H29B 0.1825 0.6756 0.0858 0.081 Uiso calc R 1 H
H29C 0.0960 0.7033 -0.0106 0.081 Uiso calc R 1 H
C31 0.63528(16) 0.51560(12) 0.24951(18) 0.0210(4) Uani d . 1 C
C32 0.70435(17) 0.57466(13) 0.27647(19) 0.0240(5) Uani d . 1 C
H32 0.6835 0.6176 0.3179 0.029 Uiso calc R 1 H
C33 0.80304(17) 0.57073(13) 0.24299(19) 0.0262(5) Uani d . 1 C
H33 0.8491 0.6115 0.2610 0.031 Uiso calc R 1 H
C34 0.83605(17) 0.50777(13) 0.18317(19) 0.0258(5) Uani d . 1 C
C35 0.76676(18) 0.45011(13) 0.1554(2) 0.0276(5) Uani d . 1 C
H35 0.7876 0.4073 0.1137 0.033 Uiso calc R 1 H
C36 0.66731(17) 0.45368(13) 0.18719(19) 0.0251(5) Uani d . 1 C
H36 0.6207 0.4137 0.1664 0.030 Uiso calc R 1 H
C37 0.94398(18) 0.50366(14) 0.1470(2) 0.0303(5) Uani d . 1 C
H37A 0.9576 0.4511 0.1226 0.036 Uiso calc R 1 H
H37B 0.9491 0.5371 0.0793 0.036 Uiso calc R 1 H
C38 1.1225(2) 0.52303(17) 0.1910(3) 0.0423(7) Uani d . 1 C
H38A 1.1749 0.5401 0.2506 0.063 Uiso calc R 1 H
H38B 1.1224 0.5564 0.1235 0.063 Uiso calc R 1 H
H38C 1.1375 0.4709 0.1683 0.063 Uiso calc R 1 H
C39 1.0225(2) 0.47619(19) 0.3361(2) 0.0462(7) Uani d . 1 C
H39A 1.0342 0.4237 0.3125 0.069 Uiso calc R 1 H
H39B 0.9564 0.4797 0.3692 0.069 Uiso calc R 1 H
H39C 1.0773 0.4918 0.3940 0.069 Uiso calc R 1 H
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'
Cl Cl 0.1484 0.1585 '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'
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_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
Cl1 Pt1 Cl1 . 3_666 180.0 ?
Cl1 Pt1 P1 . 3_666 87.573(19) yes
Cl1 Pt1 P1 3_666 3_666 92.429(19) ?
Cl1 Pt1 P1 . . 92.430(19) yes
Cl1 Pt1 P1 3_666 . 87.569(19) ?
P1 Pt1 P1 3_666 . 180.0 ?
C11 P1 C31 . . 103.66(10) ?
C11 P1 C21 . . 105.87(9) ?
C31 P1 C21 . . 104.23(10) ?
C11 P1 Pt1 . . 111.07(7) ?
C31 P1 Pt1 . . 117.33(7) ?
C21 P1 Pt1 . . 113.60(7) ?
C18 N1 C17 . . 112.2(2) ?
C18 N1 C19 . . 110.2(2) ?
C17 N1 C19 . . 108.7(2) ?
C29 N2 C28 . . 109.8(2) ?
C29 N2 C27 . . 111.0(2) ?
C28 N2 C27 . . 110.5(2) ?
C39 N3 C37 . . 111.7(2) ?
C39 N3 C38 . . 109.2(2) ?
C37 N3 C38 . . 109.5(2) ?
C12 C11 C16 . . 118.4(2) ?
C12 C11 P1 . . 123.03(16) ?
C16 C11 P1 . . 118.48(16) ?
C11 C12 C13 . . 120.3(2) ?
C11 C12 H12 . . 119.9 ?
C13 C12 H12 . . 119.9 ?
C14 C13 C12 . . 121.6(2) ?
C14 C13 H13 . . 119.2 ?
C12 C13 H13 . . 119.2 ?
C13 C14 C15 . . 118.1(2) ?
C13 C14 C17 . . 119.8(2) ?
C15 C14 C17 . . 122.1(2) ?
C16 C15 C14 . . 120.5(2) ?
C16 C15 H15 . . 119.8 ?
C14 C15 H15 . . 119.8 ?
C15 C16 C11 . . 121.2(2) ?
C15 C16 H16 . . 119.4 ?
C11 C16 H16 . . 119.4 ?
N1 C17 C14 . . 112.8(2) ?
N1 C17 H17A . . 109.0 ?
C14 C17 H17A . . 109.0 ?
N1 C17 H17B . . 109.0 ?
C14 C17 H17B . . 109.0 ?
H17A C17 H17B . . 107.8 ?
N1 C18 H18A . . 109.5 ?
N1 C18 H18B . . 109.5 ?
H18A C18 H18B . . 109.5 ?
N1 C18 H18C . . 109.5 ?
H18A C18 H18C . . 109.5 ?
H18B C18 H18C . . 109.5 ?
N1 C19 H19A . . 109.5 ?
N1 C19 H19B . . 109.5 ?
H19A C19 H19B . . 109.5 ?
N1 C19 H19C . . 109.5 ?
H19A C19 H19C . . 109.5 ?
H19B C19 H19C . . 109.5 ?
C26 C21 C22 . . 118.96(19) ?
C26 C21 P1 . . 119.33(16) ?
C22 C21 P1 . . 121.43(16) ?
C23 C22 C21 . . 120.4(2) ?
C23 C22 H22 . . 119.8 ?
C21 C22 H22 . . 119.8 ?
C22 C23 C24 . . 120.5(2) ?
C22 C23 H23 . . 119.7 ?
C24 C23 H23 . . 119.7 ?
C25 C24 C23 . . 118.5(2) ?
C25 C24 C27 . . 120.4(2) ?
C23 C24 C27 . . 121.0(2) ?
C24 C25 C26 . . 120.9(2) ?
C24 C25 H25 . . 119.5 ?
C26 C25 H25 . . 119.5 ?
C21 C26 C25 . . 120.4(2) ?
C21 C26 H26 . . 119.8 ?
C25 C26 H26 . . 119.8 ?
N2 C27 C24 . . 111.86(18) ?
N2 C27 H27A . . 109.2 ?
C24 C27 H27A . . 109.2 ?
N2 C27 H27B . . 109.2 ?
C24 C27 H27B . . 109.2 ?
H27A C27 H27B . . 107.9 ?
N2 C28 H28A . . 109.5 ?
N2 C28 H28B . . 109.5 ?
H28A C28 H28B . . 109.5 ?
N2 C28 H28C . . 109.5 ?
H28A C28 H28C . . 109.5 ?
H28B C28 H28C . . 109.5 ?
N2 C29 H29A . . 109.5 ?
N2 C29 H29B . . 109.5 ?
H29A C29 H29B . . 109.5 ?
N2 C29 H29C . . 109.5 ?
H29A C29 H29C . . 109.5 ?
H29B C29 H29C . . 109.5 ?
C36 C31 C32 . . 118.7(2) ?
C36 C31 P1 . . 121.92(17) ?
C32 C31 P1 . . 119.25(16) ?
C33 C32 C31 . . 120.2(2) ?
C33 C32 H32 . . 119.9 ?
C31 C32 H32 . . 119.9 ?
C32 C33 C34 . . 121.1(2) ?
C32 C33 H33 . . 119.5 ?
C34 C33 H33 . . 119.5 ?
C35 C34 C33 . . 118.3(2) ?
C35 C34 C37 . . 120.8(2) ?
C33 C34 C37 . . 120.9(2) ?
C34 C35 C36 . . 121.2(2) ?
C34 C35 H35 . . 119.4 ?
C36 C35 H35 . . 119.4 ?
C35 C36 C31 . . 120.4(2) ?
C35 C36 H36 . . 119.8 ?
C31 C36 H36 . . 119.8 ?
N3 C37 C34 . . 114.08(19) ?
N3 C37 H37A . . 108.7 ?
C34 C37 H37A . . 108.7 ?
N3 C37 H37B . . 108.7 ?
C34 C37 H37B . . 108.7 ?
H37A C37 H37B . . 107.6 ?
N3 C38 H38A . . 109.5 ?
N3 C38 H38B . . 109.5 ?
H38A C38 H38B . . 109.5 ?
N3 C38 H38C . . 109.5 ?
H38A C38 H38C . . 109.5 ?
H38B C38 H38C . . 109.5 ?
N3 C39 H39A . . 109.5 ?
N3 C39 H39B . . 109.5 ?
H39A C39 H39B . . 109.5 ?
N3 C39 H39C . . 109.5 ?
H39A C39 H39C . . 109.5 ?
H39B C39 H39C . . 109.5 ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Pt1 Cl1 . 2.3038(5) yes
Pt1 Cl1 3_666 2.3038(5) ?
Pt1 P1 3_666 2.3207(5) ?
Pt1 P1 . 2.3208(5) yes
P1 C11 . 1.818(2) yes
P1 C21 . 1.830(2) yes
P1 C31 . 1.821(2) yes
N1 C18 . 1.443(4) ?
N1 C17 . 1.463(3) ?
N1 C19 . 1.466(3) ?
N2 C29 . 1.449(4) ?
N2 C28 . 1.455(3) ?
N2 C27 . 1.461(3) ?
N3 C39 . 1.445(3) ?
N3 C37 . 1.447(3) ?
N3 C38 . 1.463(3) ?
C11 C12 . 1.386(3) ?
C11 C16 . 1.394(3) ?
C12 C13 . 1.388(3) ?
C12 H12 . 0.9500 ?
C13 C14 . 1.387(3) ?
C13 H13 . 0.9500 ?
C14 C15 . 1.395(3) ?
C14 C17 . 1.509(3) ?
C15 C16 . 1.385(3) ?
C15 H15 . 0.9500 ?
C16 H16 . 0.9500 ?
C17 H17A . 0.9900 ?
C17 H17B . 0.9900 ?
C18 H18A . 0.9800 ?
C18 H18B . 0.9800 ?
C18 H18C . 0.9800 ?
C19 H19A . 0.9800 ?
C19 H19B . 0.9800 ?
C19 H19C . 0.9800 ?
C21 C26 . 1.382(3) ?
C21 C22 . 1.398(3) ?
C22 C23 . 1.388(3) ?
C22 H22 . 0.9500 ?
C23 C24 . 1.396(3) ?
C23 H23 . 0.9500 ?
C24 C25 . 1.386(3) ?
C24 C27 . 1.510(3) ?
C25 C26 . 1.391(3) ?
C25 H25 . 0.9500 ?
C26 H26 . 0.9500 ?
C27 H27A . 0.9900 ?
C27 H27B . 0.9900 ?
C28 H28A . 0.9800 ?
C28 H28B . 0.9800 ?
C28 H28C . 0.9800 ?
C29 H29A . 0.9800 ?
C29 H29B . 0.9800 ?
C29 H29C . 0.9800 ?
C31 C36 . 1.394(3) ?
C31 C32 . 1.397(3) ?
C32 C33 . 1.385(3) ?
C32 H32 . 0.9500 ?
C33 C34 . 1.398(3) ?
C33 H33 . 0.9500 ?
C34 C35 . 1.382(3) ?
C34 C37 . 1.512(3) ?
C35 C36 . 1.387(3) ?
C35 H35 . 0.9500 ?
C36 H36 . 0.9500 ?
C37 H37A . 0.9900 ?
C37 H37B . 0.9900 ?
C38 H38A . 0.9800 ?
C38 H38B . 0.9800 ?
C38 H38C . 0.9800 ?
C39 H39A . 0.9800 ?
C39 H39B . 0.9800 ?
C39 H39C . 0.9800 ?
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_site_symmetry_1
_geom_torsion
_geom_torsion_publ_flag
Pt1 P1 C11 C16 . -41.2(2) yes
Pt1 P1 C21 C26 . -16.5(2) yes
Pt1 P1 C31 C32 . -71.20(18) yes
C19 N1 C17 C14 . 176.3(2) yes
C28 N2 C27 C24 . -176.6(2) yes
C38 N3 C37 C34 . -177.3(2) yes
C15 C14 C17 N1 . 66.2(3) yes
C23 C24 C27 N2 . 62.1(3) yes
C33 C34 C37 N3 . 45.6(3) yes
Cl1 Pt1 P1 C11 . 132.12(8) ?
Cl1 Pt1 P1 C11 3_666 -47.89(8) ?
Cl1 Pt1 P1 C31 . 13.17(8) ?
Cl1 Pt1 P1 C31 3_666 -166.83(8) ?
Cl1 Pt1 P1 C21 . -108.67(8) ?
Cl1 Pt1 P1 C21 3_666 71.32(8) ?
C31 P1 C11 C12 . -91.54(19) ?
C21 P1 C11 C12 . 17.9(2) ?
Pt1 P1 C11 C12 . 141.60(17) ?
C31 P1 C11 C16 . 85.7(2) ?
C21 P1 C11 C16 . -164.94(18) ?
C16 C11 C12 C13 . -1.0(3) ?
P1 C11 C12 C13 . 176.22(17) ?
C11 C12 C13 C14 . -0.6(4) ?
C12 C13 C14 C15 . 1.2(4) ?
C12 C13 C14 C17 . 179.9(2) ?
C13 C14 C15 C16 . -0.2(4) ?
C17 C14 C15 C16 . -178.9(2) ?
C14 C15 C16 C11 . -1.4(4) ?
C12 C11 C16 C15 . 2.0(4) ?
P1 C11 C16 C15 . -175.38(19) ?
C18 N1 C17 C14 . 54.2(3) ?
C13 C14 C17 N1 . -112.5(3) ?
C11 P1 C21 C26 . 105.64(18) ?
C31 P1 C21 C26 . -145.38(18) ?
C11 P1 C21 C22 . -68.3(2) ?
C31 P1 C21 C22 . 40.7(2) ?
Pt1 P1 C21 C22 . 169.60(15) ?
C26 C21 C22 C23 . -3.5(3) ?
P1 C21 C22 C23 . 170.45(17) ?
C21 C22 C23 C24 . 0.1(3) ?
C22 C23 C24 C25 . 3.9(3) ?
C22 C23 C24 C27 . -173.6(2) ?
C23 C24 C25 C26 . -4.7(3) ?
C27 C24 C25 C26 . 172.8(2) ?
C22 C21 C26 C25 . 2.7(3) ?
P1 C21 C26 C25 . -171.32(17) ?
C24 C25 C26 C21 . 1.4(3) ?
C29 N2 C27 C24 . 61.4(3) ?
C25 C24 C27 N2 . -115.4(2) ?
C11 P1 C31 C36 . -17.6(2) ?
C21 P1 C31 C36 . -128.19(18) ?
Pt1 P1 C31 C36 . 105.23(17) ?
C11 P1 C31 C32 . 165.98(17) ?
C21 P1 C31 C32 . 55.37(19) ?
C36 C31 C32 C33 . -0.9(3) ?
P1 C31 C32 C33 . 175.63(17) ?
C31 C32 C33 C34 . -0.8(3) ?
C32 C33 C34 C35 . 1.7(3) ?
C32 C33 C34 C37 . -179.8(2) ?
C33 C34 C35 C36 . -1.0(3) ?
C37 C34 C35 C36 . -179.4(2) ?
C34 C35 C36 C31 . -0.7(3) ?
C32 C31 C36 C35 . 1.7(3) ?
P1 C31 C36 C35 . -174.80(17) ?
C39 N3 C37 C34 . 61.6(3) ?
C35 C34 C37 N3 . -136.0(2) ?
