#------------------------------------------------------------------------------
#$Date: 2021-04-05 17:22:27 +0300 (Mon, 05 Apr 2021) $
#$Revision: 263695 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/55/99/1559994.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_1559994
loop_
_publ_author_name
'Maisuls, Iván'
'Wang, Cui'
'Gutierrez Suburu, Matias E.'
'Wilde, Sebastian'
'Daniliuc, Constantin-Gabriel'
'Brünink, Dana'
'Doltsinis, Nikos L.'
'Ostendorp, Stefan'
'Wilde, Gerhard'
'Kösters, Jutta'
'Resch-Genger, Ute'
'Strassert, Cristian A.'
_publ_section_title
;
 Ligand-controlled and nanoconfinement-boosted luminescence employing
 Pt(ii) and Pd(ii) complexes: from color-tunable aggregation-enhanced dual
 emitters towards self-referenced oxygen reporters
;
_journal_issue                   9
_journal_name_full               'Chemical Science'
_journal_page_first              3270
_journal_page_last               3281
_journal_paper_doi               10.1039/D0SC06126C
_journal_volume                  12
_journal_year                    2021
_chemical_formula_sum            'C29 H19 F2 N3 O Pt'
_chemical_formula_weight         658.56
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_audit_update_record
;
2020-08-19 deposited with the CCDC.	2021-01-06 downloaded from the CCDC.
;
_cell_angle_alpha                117.792(1)
_cell_angle_beta                 105.826(1)
_cell_angle_gamma                94.593(1)
_cell_formula_units_Z            2
_cell_length_a                   9.3869(3)
_cell_length_b                   11.7589(2)
_cell_length_c                   11.9012(3)
_cell_measurement_reflns_used    2800
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      28.28
_cell_measurement_theta_min      4.08
_cell_volume                     1084.42(5)
_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    'XP-SHELXL-2013 (Sheldrick, 2013)'
_computing_publication_material  'SHELXL-2013 (Sheldrick, 2013)'
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2013)'
_computing_structure_solution    'SHELXL-2013 (Sheldrick, 2013)'
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 0.987
_diffrn_measured_fraction_theta_max 0.987
_diffrn_measurement_device_type  'Nonius KappaCCD APEXII'
_diffrn_measurement_method       'ω and φ scans'
_diffrn_radiation_monochromator  'Montel mirror'
_diffrn_radiation_source         'rotating anode Nonius FR591'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.039
_diffrn_reflns_av_sigmaI/netI    0.0277
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       0
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_number            9828
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         4.14
_exptl_absorpt_coefficient_mu    6.518
_exptl_absorpt_correction_T_max  0.8285
_exptl_absorpt_correction_T_min  0.5618
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
'Denzo (Otwinowski, Borek, Majewski & Minor, 2003)'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    2.017
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             636
_exptl_crystal_size_max          0.10
_exptl_crystal_size_mid          0.06
_exptl_crystal_size_min          0.03
_refine_diff_density_max         0.857
_refine_diff_density_min         -1.379
_refine_diff_density_rms         0.109
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.056
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     326
_refine_ls_number_reflns         3763
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.056
_refine_ls_R_factor_all          0.0258
_refine_ls_R_factor_gt           0.0248
_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)+(0.0281P)²+3.3469P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0608
_refine_ls_wR_factor_ref         0.0619
_reflns_number_gt                3653
_reflns_number_total             3763
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            d0sc06126c2.cif
_cod_data_source_block           dan9176
_cod_depositor_comments
'Adding full bibliography for 1559992--1559996.cif.'
_cod_original_cell_volume        1084.41(5)
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               1559994
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 0.794369(17) 0.416849(14) 0.485280(15) 0.02388(7) Uani 1 1 d . . .
F1 F 0.5939(3) -0.0829(3) 0.0392(3) 0.0422(7) Uani 1 1 d . . .
F2 F 0.3491(4) 0.3671(3) 0.0455(3) 0.0461(7) Uani 1 1 d . . .
C1 C 0.7900(5) 0.2291(4) 0.3554(4) 0.0269(9) Uani 1 1 d . . .
C2 C 0.6798(5) 0.1317(4) 0.2316(4) 0.0288(9) Uani 1 1 d . . .
H2 H 0.5868 0.1507 0.1970 0.035 Uiso 1 1 calc R . .
C3 C 0.7048(6) 0.0093(5) 0.1600(5) 0.0336(11) Uani 1 1 d . . .
C4 C 0.8355(6) -0.0291(5) 0.2021(5) 0.0349(11) Uani 1 1 d . . .
H4 H 0.8501 -0.1142 0.1482 0.042 Uiso 1 1 calc R . .
C5 C 0.9440(6) 0.0638(5) 0.3275(5) 0.0344(10) Uani 1 1 d . . .
H5 H 1.0349 0.0418 0.3613 0.041 Uiso 1 1 calc R . .
C6 C 0.9215(5) 0.1887(4) 0.4046(4) 0.0278(9) Uani 1 1 d . . .
C7 C 1.0221(5) 0.2810(4) 0.5450(4) 0.0266(9) Uani 1 1 d . . .
N8 N 0.9779(4) 0.3962(3) 0.6092(3) 0.0236(7) Uani 1 1 d . . .
C9 C 1.1459(5) 0.2541(5) 0.6147(5) 0.0301(10) Uani 1 1 d . . .
H9 H 1.1765 0.1747 0.5696 0.036 Uiso 1 1 calc R . .
C10 C 1.2246(5) 0.3442(5) 0.7508(5) 0.0308(10) Uani 1 1 d . . .
H10 H 1.3083 0.3262 0.8005 0.037 Uiso 1 1 calc R . .
C11 C 1.1808(5) 0.4605(4) 0.8138(4) 0.0285(9) Uani 1 1 d . . .
H11 H 1.2353 0.5232 0.9070 0.034 Uiso 1 1 calc R . .
C12 C 1.0565(5) 0.4866(4) 0.7413(4) 0.0254(9) Uani 1 1 d . . .
N13 N 1.0148(4) 0.6064(4) 0.8088(4) 0.0265(8) Uani 1 1 d . . .
C14 C 0.9077(5) 0.6677(4) 0.7629(4) 0.0275(9) Uani 1 1 d . . .
N15 N 0.8116(4) 0.6058(4) 0.6331(4) 0.0256(8) Uani 1 1 d . . .
C16 C 0.9036(6) 0.7948(5) 0.8563(5) 0.0350(11) Uani 1 1 d . . .
H16 H 0.9739 0.8391 0.9469 0.042 Uiso 1 1 calc R . .
C17 C 0.7978(6) 0.8557(5) 0.8168(5) 0.0378(11) Uani 1 1 d . . .
H17 H 0.7936 0.9414 0.8805 0.045 Uiso 1 1 calc R . .
C18 C 0.6969(6) 0.7913(5) 0.6833(5) 0.0344(10) Uani 1 1 d . . .
H18 H 0.6231 0.8322 0.6549 0.041 Uiso 1 1 calc R . .
C19 C 0.7059(5) 0.6675(5) 0.5933(5) 0.0289(9) Uani 1 1 d . . .
C20 C 0.6070(5) 0.5878(5) 0.4504(5) 0.0303(10) Uani 1 1 d . . .
C21 C 0.6279(5) 0.4593(4) 0.3744(5) 0.0284(9) Uani 1 1 d . . .
C22 C 0.5370(5) 0.3868(5) 0.2351(5) 0.0296(10) Uani 1 1 d . . .
H22 H 0.5472 0.3007 0.1785 0.035 Uiso 1 1 calc R . .
C23 C 0.4344(5) 0.4406(5) 0.1819(5) 0.0349(11) Uani 1 1 d . . .
C24 C 0.4108(6) 0.5648(5) 0.2546(5) 0.0388(11) Uani 1 1 d . . .
H24 H 0.3376 0.5981 0.2136 0.047 Uiso 1 1 calc R . .
C25 C 0.5004(6) 0.6379(5) 0.3913(5) 0.0347(11) Uani 1 1 d . . .
H25 H 0.4888 0.7241 0.4458 0.042 Uiso 1 1 calc R . .
C31 C 1.1009(5) 0.6847(4) 0.9543(4) 0.0270(9) Uani 1 1 d . . .
C32 C 1.0412(5) 0.6728(4) 1.0432(4) 0.0281(9) Uani 1 1 d . . .
H32 H 0.9467 0.6114 1.0094 0.034 Uiso 1 1 calc R . .
C33 C 1.1193(5) 0.7507(4) 1.1825(4) 0.0273(9) Uani 1 1 d . . .
H33 H 1.0782 0.7430 1.2439 0.033 Uiso 1 1 calc R . .
C34 C 1.2584(5) 0.8403(4) 1.2312(4) 0.0261(9) Uani 1 1 d . . .
C35 C 1.3193(5) 0.8496(5) 1.1407(5) 0.0306(10) Uani 1 1 d . . .
H35 H 1.4153 0.9089 1.1738 0.037 Uiso 1 1 calc R . .
C36 C 1.2401(5) 0.7725(4) 1.0024(5) 0.0289(9) Uani 1 1 d . . .
H36 H 1.2810 0.7797 0.9406 0.035 Uiso 1 1 calc R . .
O1 O 1.3441(4) 0.9225(3) 1.3658(3) 0.0362(8) Uani 1 1 d . . .
C37 C 1.2900(5) 0.9110(5) 1.4621(5) 0.0345(11) Uani 1 1 d . . .
H37A H 1.1909 0.9336 1.4546 0.052 Uiso 1 1 calc R . .
H37B H 1.3632 0.9718 1.5539 0.052 Uiso 1 1 calc R . .
H37C H 1.2787 0.8199 1.4439 0.052 Uiso 1 1 calc R . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 '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'
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
C1 Pt1 C21 103.51(18) . . ?
C1 Pt1 N15 174.27(15) . . ?
C21 Pt1 N15 82.01(17) . . ?
C1 Pt1 N8 81.98(16) . . ?
C21 Pt1 N8 173.31(15) . . ?
N15 Pt1 N8 92.61(14) . . ?
C2 C1 C6 115.9(4) . . ?
C2 C1 Pt1 131.6(4) . . ?
C6 C1 Pt1 112.4(3) . . ?
C3 C2 C1 120.5(4) . . ?
C3 C2 H2 119.7 . . ?
C1 C2 H2 119.7 . . ?
C2 C3 F1 118.5(4) . . ?
C2 C3 C4 124.3(4) . . ?
F1 C3 C4 117.1(4) . . ?
C3 C4 C5 116.3(4) . . ?
C3 C4 H4 121.8 . . ?
C5 C4 H4 121.8 . . ?
C4 C5 C6 121.1(5) . . ?
C4 C5 H5 119.5 . . ?
C6 C5 H5 119.5 . . ?
C5 C6 C1 121.6(4) . . ?
C5 C6 C7 122.2(4) . . ?
C1 C6 C7 116.0(4) . . ?
N8 C7 C9 120.7(4) . . ?
N8 C7 C6 114.6(4) . . ?
C9 C7 C6 124.5(4) . . ?
C12 N8 C7 120.5(4) . . ?
C12 N8 Pt1 125.4(3) . . ?
C7 N8 Pt1 114.0(3) . . ?
C10 C9 C7 119.3(4) . . ?
C10 C9 H9 120.4 . . ?
C7 C9 H9 120.4 . . ?
C11 C10 C9 119.6(4) . . ?
C11 C10 H10 120.2 . . ?
C9 C10 H10 120.2 . . ?
C10 C11 C12 120.3(4) . . ?
C10 C11 H11 119.8 . . ?
C12 C11 H11 119.8 . . ?
N8 C12 C11 119.6(4) . . ?
N8 C12 N13 121.6(4) . . ?
C11 C12 N13 118.9(4) . . ?
C12 N13 C14 132.7(4) . . ?
C12 N13 C31 113.9(4) . . ?
C14 N13 C31 113.3(4) . . ?
N15 C14 C16 120.3(4) . . ?
N15 C14 N13 121.4(4) . . ?
C16 C14 N13 118.2(4) . . ?
C14 N15 C19 119.6(4) . . ?
C14 N15 Pt1 125.6(3) . . ?
C19 N15 Pt1 114.6(3) . . ?
C17 C16 C14 119.9(5) . . ?
C17 C16 H16 120.0 . . ?
C14 C16 H16 120.0 . . ?
C16 C17 C18 119.8(5) . . ?
C16 C17 H17 120.1 . . ?
C18 C17 H17 120.1 . . ?
C19 C18 C17 118.8(5) . . ?
C19 C18 H18 120.6 . . ?
C17 C18 H18 120.6 . . ?
C18 C19 N15 121.4(4) . . ?
C18 C19 C20 124.9(4) . . ?
N15 C19 C20 113.7(4) . . ?
C25 C20 C21 121.7(4) . . ?
C25 C20 C19 121.2(4) . . ?
C21 C20 C19 117.1(4) . . ?
C22 C21 C20 116.1(4) . . ?
C22 C21 Pt1 131.2(4) . . ?
C20 C21 Pt1 112.6(3) . . ?
C23 C22 C21 120.0(5) . . ?
C23 C22 H22 120.0 . . ?
C21 C22 H22 120.0 . . ?
C22 C23 F2 118.1(4) . . ?
C22 C23 C24 124.8(5) . . ?
F2 C23 C24 117.1(4) . . ?
C23 C24 C25 116.0(5) . . ?
C23 C24 H24 122.0 . . ?
C25 C24 H24 122.0 . . ?
C24 C25 C20 121.5(5) . . ?
C24 C25 H25 119.3 . . ?
C20 C25 H25 119.3 . . ?
C32 C31 C36 120.5(4) . . ?
C32 C31 N13 119.5(4) . . ?
C36 C31 N13 120.0(4) . . ?
C31 C32 C33 120.1(4) . . ?
C31 C32 H32 120.0 . . ?
C33 C32 H32 120.0 . . ?
C32 C33 C34 119.5(4) . . ?
C32 C33 H33 120.2 . . ?
C34 C33 H33 120.2 . . ?
O1 C34 C35 115.5(4) . . ?
O1 C34 C33 124.5(4) . . ?
C35 C34 C33 120.0(4) . . ?
C36 C35 C34 120.0(4) . . ?
C36 C35 H35 120.0 . . ?
C34 C35 H35 120.0 . . ?
C35 C36 C31 119.9(4) . . ?
C35 C36 H36 120.1 . . ?
C31 C36 H36 120.1 . . ?
C34 O1 C37 117.4(3) . . ?
O1 C37 H37A 109.5 . . ?
O1 C37 H37B 109.5 . . ?
H37A C37 H37B 109.5 . . ?
O1 C37 H37C 109.5 . . ?
H37A C37 H37C 109.5 . . ?
H37B C37 H37C 109.5 . . ?
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 2.009(5) . ?
Pt1 C21 2.012(5) . ?
Pt1 N15 2.050(4) . ?
Pt1 N8 2.054(4) . ?
F1 C3 1.370(5) . ?
F2 C23 1.377(5) . ?
C1 C2 1.399(6) . ?
C1 C6 1.432(6) . ?
C2 C3 1.369(7) . ?
C2 H2 0.9500 . ?
C3 C4 1.387(7) . ?
C4 C5 1.389(7) . ?
C4 H4 0.9500 . ?
C5 C6 1.394(7) . ?
C5 H5 0.9500 . ?
C6 C7 1.465(6) . ?
C7 N8 1.374(6) . ?
C7 C9 1.384(7) . ?
N8 C12 1.352(6) . ?
C9 C10 1.383(7) . ?
C9 H9 0.9500 . ?
C10 C11 1.380(7) . ?
C10 H10 0.9500 . ?
C11 C12 1.398(6) . ?
C11 H11 0.9500 . ?
C12 N13 1.409(6) . ?
N13 C14 1.418(6) . ?
N13 C31 1.459(5) . ?
C14 N15 1.348(6) . ?
C14 C16 1.398(7) . ?
N15 C19 1.383(6) . ?
C16 C17 1.376(7) . ?
C16 H16 0.9500 . ?
C17 C18 1.392(7) . ?
C17 H17 0.9500 . ?
C18 C19 1.374(7) . ?
C18 H18 0.9500 . ?
C19 C20 1.465(6) . ?
C20 C25 1.393(7) . ?
C20 C21 1.418(7) . ?
C21 C22 1.413(6) . ?
C22 C23 1.367(7) . ?
C22 H22 0.9500 . ?
C23 C24 1.382(7) . ?
C24 C25 1.388(7) . ?
C24 H24 0.9500 . ?
C25 H25 0.9500 . ?
C31 C32 1.379(6) . ?
C31 C36 1.388(6) . ?
C32 C33 1.392(6) . ?
C32 H32 0.9500 . ?
C33 C34 1.396(6) . ?
C33 H33 0.9500 . ?
C34 O1 1.370(5) . ?
C34 C35 1.391(6) . ?
C35 C36 1.385(6) . ?
C35 H35 0.9500 . ?
C36 H36 0.9500 . ?
O1 C37 1.428(6) . ?
C37 H37A 0.9800 . ?
C37 H37B 0.9800 . ?
C37 H37C 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
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
C21 Pt1 C1 C2 -16.4(5) . . . . ?
N15 Pt1 C1 C2 148.2(13) . . . . ?
N8 Pt1 C1 C2 167.5(4) . . . . ?
C21 Pt1 C1 C6 167.2(3) . . . . ?
N15 Pt1 C1 C6 -28.2(16) . . . . ?
N8 Pt1 C1 C6 -8.9(3) . . . . ?
C6 C1 C2 C3 -4.5(6) . . . . ?
Pt1 C1 C2 C3 179.3(3) . . . . ?
C1 C2 C3 F1 -179.8(4) . . . . ?
C1 C2 C3 C4 0.8(7) . . . . ?
C2 C3 C4 C5 2.0(7) . . . . ?
F1 C3 C4 C5 -177.4(4) . . . . ?
C3 C4 C5 C6 -0.7(7) . . . . ?
C4 C5 C6 C1 -3.2(7) . . . . ?
C4 C5 C6 C7 170.6(4) . . . . ?
C2 C1 C6 C5 5.7(6) . . . . ?
Pt1 C1 C6 C5 -177.3(3) . . . . ?
C2 C1 C6 C7 -168.5(4) . . . . ?
Pt1 C1 C6 C7 8.5(5) . . . . ?
C5 C6 C7 N8 -175.8(4) . . . . ?
C1 C6 C7 N8 -1.7(5) . . . . ?
C5 C6 C7 C9 -0.7(7) . . . . ?
C1 C6 C7 C9 173.4(4) . . . . ?
C9 C7 N8 C12 1.2(6) . . . . ?
C6 C7 N8 C12 176.6(4) . . . . ?
C9 C7 N8 Pt1 178.8(3) . . . . ?
C6 C7 N8 Pt1 -5.8(4) . . . . ?
C1 Pt1 N8 C12 -174.3(4) . . . . ?
C21 Pt1 N8 C12 40.1(14) . . . . ?
N15 Pt1 N8 C12 3.8(3) . . . . ?
C1 Pt1 N8 C7 8.3(3) . . . . ?
C21 Pt1 N8 C7 -137.3(12) . . . . ?
N15 Pt1 N8 C7 -173.6(3) . . . . ?
N8 C7 C9 C10 0.5(6) . . . . ?
C6 C7 C9 C10 -174.3(4) . . . . ?
C7 C9 C10 C11 -1.5(7) . . . . ?
C9 C10 C11 C12 0.7(7) . . . . ?
C7 N8 C12 C11 -2.0(6) . . . . ?
Pt1 N8 C12 C11 -179.3(3) . . . . ?
C7 N8 C12 N13 179.0(4) . . . . ?
Pt1 N8 C12 N13 1.7(6) . . . . ?
C10 C11 C12 N8 1.0(6) . . . . ?
C10 C11 C12 N13 -180.0(4) . . . . ?
N8 C12 N13 C14 -8.4(7) . . . . ?
C11 C12 N13 C14 172.6(4) . . . . ?
N8 C12 N13 C31 173.2(4) . . . . ?
C11 C12 N13 C31 -5.8(5) . . . . ?
C12 N13 C14 N15 5.8(7) . . . . ?
C31 N13 C14 N15 -175.8(4) . . . . ?
C12 N13 C14 C16 -174.4(4) . . . . ?
C31 N13 C14 C16 4.0(6) . . . . ?
C16 C14 N15 C19 -1.7(6) . . . . ?
N13 C14 N15 C19 178.2(4) . . . . ?
C16 C14 N15 Pt1 -176.8(3) . . . . ?
N13 C14 N15 Pt1 3.0(6) . . . . ?
C1 Pt1 N15 C14 12.9(16) . . . . ?
C21 Pt1 N15 C14 177.8(4) . . . . ?
N8 Pt1 N15 C14 -6.2(4) . . . . ?
C1 Pt1 N15 C19 -162.5(14) . . . . ?
C21 Pt1 N15 C19 2.4(3) . . . . ?
N8 Pt1 N15 C19 178.4(3) . . . . ?
N15 C14 C16 C17 2.1(7) . . . . ?
N13 C14 C16 C17 -177.7(4) . . . . ?
C14 C16 C17 C18 -1.2(8) . . . . ?
C16 C17 C18 C19 -0.1(8) . . . . ?
C17 C18 C19 N15 0.6(7) . . . . ?
C17 C18 C19 C20 179.5(4) . . . . ?
C14 N15 C19 C18 0.3(6) . . . . ?
Pt1 N15 C19 C18 176.0(3) . . . . ?
C14 N15 C19 C20 -178.7(4) . . . . ?
Pt1 N15 C19 C20 -3.0(5) . . . . ?
C18 C19 C20 C25 5.0(7) . . . . ?
N15 C19 C20 C25 -176.0(4) . . . . ?
C18 C19 C20 C21 -176.9(4) . . . . ?
N15 C19 C20 C21 2.1(6) . . . . ?
C25 C20 C21 C22 1.3(6) . . . . ?
C19 C20 C21 C22 -176.7(4) . . . . ?
C25 C20 C21 Pt1 178.0(3) . . . . ?
C19 C20 C21 Pt1 -0.1(5) . . . . ?
C1 Pt1 C21 C22 -6.7(5) . . . . ?
N15 Pt1 C21 C22 174.8(4) . . . . ?
N8 Pt1 C21 C22 138.1(11) . . . . ?
C1 Pt1 C21 C20 177.3(3) . . . . ?
N15 Pt1 C21 C20 -1.2(3) . . . . ?
N8 Pt1 C21 C20 -37.9(14) . . . . ?
C20 C21 C22 C23 -1.1(6) . . . . ?
Pt1 C21 C22 C23 -177.0(4) . . . . ?
C21 C22 C23 F2 179.4(4) . . . . ?
C21 C22 C23 C24 0.3(8) . . . . ?
C22 C23 C24 C25 0.4(8) . . . . ?
F2 C23 C24 C25 -178.7(4) . . . . ?
C23 C24 C25 C20 -0.2(7) . . . . ?
C21 C20 C25 C24 -0.7(7) . . . . ?
C19 C20 C25 C24 177.3(4) . . . . ?
C12 N13 C31 C32 -95.1(5) . . . . ?
C14 N13 C31 C32 86.2(5) . . . . ?
C12 N13 C31 C36 86.4(5) . . . . ?
C14 N13 C31 C36 -92.3(5) . . . . ?
C36 C31 C32 C33 1.1(7) . . . . ?
N13 C31 C32 C33 -177.5(4) . . . . ?
C31 C32 C33 C34 -0.3(7) . . . . ?
C32 C33 C34 O1 179.4(4) . . . . ?
C32 C33 C34 C35 -1.1(7) . . . . ?
O1 C34 C35 C36 -178.8(4) . . . . ?
C33 C34 C35 C36 1.7(7) . . . . ?
C34 C35 C36 C31 -0.9(7) . . . . ?
C32 C31 C36 C35 -0.5(7) . . . . ?
N13 C31 C36 C35 178.0(4) . . . . ?
C35 C34 O1 C37 -176.7(4) . . . . ?
C33 C34 O1 C37 2.8(7) . . . . ?
