#------------------------------------------------------------------------------
#$Date: 2024-02-04 13:50:24 +0200 (Sun, 04 Feb 2024) $
#$Revision: 289485 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/71/48/7714812.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_7714812
loop_
_publ_author_name
'Liang, Chun-Jie'
'Wu, Run-Chun'
'Huang, Xiao-Qiong'
'Qin, Qi-Pin'
'Liang, Hong'
'Tan, Ming-Xiong'
_publ_section_title
;
 Synthesis and anticancer mechanisms of four novel platinum(II)
 4'-substituted-2,2':6',2''-terpyridine complexes.
;
_journal_issue                   5
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              2143
_journal_page_last               2152
_journal_paper_doi               10.1039/d3dt03197g
_journal_volume                  53
_journal_year                    2024
_chemical_formula_moiety         'C2 H6 Cl3 O Pt S, C21 H13 Br2 Cl N3 Pt'
_chemical_formula_sum            'C23 H19 Br2 Cl4 N3 O Pt2 S'
_chemical_formula_weight         1077.27
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_date             2023-11-27
_audit_creation_method
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_audit_update_record
;
2023-11-28 deposited with the CCDC.	2023-12-21 downloaded from the CCDC.
;
_cell_angle_alpha                79.304(3)
_cell_angle_beta                 75.497(3)
_cell_angle_gamma                83.119(3)
_cell_formula_units_Z            2
_cell_length_a                   7.5483(7)
_cell_length_b                   12.8386(10)
_cell_length_c                   14.7671(13)
_cell_measurement_reflns_used    8203
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      26.34
_cell_measurement_theta_min      2.80
_cell_volume                     1357.4(2)
_computing_cell_refinement       'SAINT V8.40A (?, 2016)'
_computing_data_reduction        'SAINT V8.40A (?, 2016)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      150.0
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0639
_diffrn_reflns_av_unetI/netI     0.0381
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_limit_h_max       8
_diffrn_reflns_limit_h_min       -8
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            29274
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_theta_full        25.009
_diffrn_reflns_theta_max         25.009
_diffrn_reflns_theta_min         2.337
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    13.734
_exptl_absorpt_correction_T_max  0.0276
_exptl_absorpt_correction_T_min  0.0081
_exptl_absorpt_correction_type   none
_exptl_absorpt_process_details
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.1257 before and 0.0846 after correction.
The Ratio of minimum to maximum transmission is 0.2935.
The λ/2 correction factor is Not present.
;
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    2.636
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             992
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.18
_exptl_crystal_size_min          0.17
_refine_diff_density_max         2.910
_refine_diff_density_min         -5.171
_refine_diff_density_rms         0.440
_refine_ls_extinction_coef       0.0033(5)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2014/7 (Sheldrick 2014'
_refine_ls_goodness_of_fit_ref   1.217
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     292
_refine_ls_number_reflns         4768
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.217
_refine_ls_R_factor_all          0.0988
_refine_ls_R_factor_gt           0.0903
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0997P)²+43.6730P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2135
_refine_ls_wR_factor_ref         0.2202
_reflns_Friedel_coverage         0.000
_reflns_number_gt                4147
_reflns_number_total             4768
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d3dt03197g2.cif
_cod_data_source_block           pt
_cod_depositor_comments
'Adding full bibliography for 7714811--7714815.cif.'
_cod_original_cell_volume        1357.3(2)
_cod_database_code               7714812
_shelx_shelxl_version_number     2014/7
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_max   0.217
_shelx_estimated_absorpt_t_min   0.078
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2.a Aromatic/amide H refined with riding coordinates:
 C8(H8), C11(H11), C16(H16), C15(H15), C14(H14), C13(H13), C21(H21), C1(H1),
 C5(H5), C3(H3), C18(H18), C19(H19), C20(H20)
2.b Fitted hexagon refined as free rotating group:
 N1(C9,C8,C7,C11,C10), N2(C16,C15,C14,C13,C12), C1(C6,C5,C4,C3,C2)
2.c Idealised Me refined as rotating group:
 C22(H22A,H22B,H22C), C23(H23A,H23B,H23C)
;
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_operation_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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt2 Pt 0.92314(11) -0.50248(6) -0.28023(6) 0.0406(3) Uani 1 1 d . . . . .
Pt1 Pt 0.69177(11) 0.00923(6) 0.05909(6) 0.0407(3) Uani 1 1 d . . . . .
Br1 Br 1.2268(4) 0.2182(2) -0.60642(18) 0.0655(7) Uani 1 1 d . . . . .
Br2 Br 1.3559(4) -0.2220(2) -0.52579(19) 0.0699(8) Uani 1 1 d . . . . .
S1 S 1.1894(7) -0.5772(4) -0.3471(4) 0.0445(12) Uani 1 1 d . . . . .
Cl3 Cl 0.6358(7) -0.4333(4) -0.2059(4) 0.0469(12) Uani 1 1 d . . . . .
Cl4 Cl 0.7912(7) -0.6370(4) -0.3193(4) 0.0488(12) Uani 1 1 d . . . . .
Cl2 Cl 1.0556(8) -0.3733(5) -0.2370(4) 0.0544(14) Uani 1 1 d . . . . .
Cl1 Cl 0.5335(8) 0.0127(5) 0.2130(4) 0.0533(13) Uani 1 1 d . . . . .
O1 O 1.236(2) -0.6842(12) -0.3026(14) 0.059(4) Uani 1 1 d . . . . .
N3 N 0.765(2) 0.1615(15) 0.0260(14) 0.045(4) Uani 1 1 d . . . . .
N1 N 0.8197(15) 0.0090(9) -0.0666(6) 0.041(4) Uani 1 1 d . . . . .
C9 C 0.8310(17) -0.0828(8) -0.1056(7) 0.042(5) Uani 1 1 d G . . . .
C8 C 0.9266(18) -0.0856(8) -0.1989(8) 0.041(5) Uani 1 1 d G . . . .
H8 H 0.9343 -0.1483 -0.2255 0.049 Uiso 1 1 calc R . . . .
C7 C 1.0108(17) 0.0035(10) -0.2531(6) 0.043(5) Uani 1 1 d G . . . .
C11 C 0.9995(17) 0.0953(8) -0.2141(8) 0.039(4) Uani 1 1 d G . . . .
H11 H 1.0570 0.1562 -0.2512 0.047 Uiso 1 1 calc R . . . .
C10 C 0.9039(17) 0.0981(7) -0.1209(8) 0.036(4) Uani 1 1 d G . . . .
N2 N 0.6624(17) -0.1407(8) 0.0502(8) 0.044(4) Uani 1 1 d . . . . .
C16 C 0.5713(19) -0.2153(10) 0.1221(7) 0.050(5) Uani 1 1 d G . . . .
H16 H 0.5203 -0.1977 0.1835 0.060 Uiso 1 1 calc R . . . .
C15 C 0.555(2) -0.3158(9) 0.1041(9) 0.052(6) Uani 1 1 d G . . . .
H15 H 0.4926 -0.3668 0.1532 0.062 Uiso 1 1 calc R . . . .
C14 C 0.629(2) -0.3416(8) 0.0142(10) 0.048(5) Uani 1 1 d G . . . .
H14 H 0.6182 -0.4103 0.0019 0.058 Uiso 1 1 calc R . . . .
C13 C 0.721(2) -0.2670(10) -0.0577(7) 0.056(6) Uani 1 1 d G . . . .
H13 H 0.7715 -0.2846 -0.1191 0.068 Uiso 1 1 calc R . . . .
C12 C 0.7370(18) -0.1665(9) -0.0396(7) 0.041(4) Uani 1 1 d G . . . .
C21 C 0.729(3) 0.2360(16) 0.0801(14) 0.042(5) Uani 1 1 d . . . . .
H21 H 0.6601 0.2188 0.1434 0.051 Uiso 1 1 calc R . . . .
C17 C 0.872(3) 0.1851(17) -0.0632(16) 0.043(5) Uani 1 1 d . . . . .
C1 C 1.127(2) 0.0960(9) -0.4195(10) 0.048(5) Uani 1 1 d . . . . .
H1 H 1.0789 0.1616 -0.3989 0.057 Uiso 1 1 calc R . . . .
C6 C 1.1141(19) 0.0020(11) -0.3549(7) 0.044(5) Uani 1 1 d G . . . .
C5 C 1.185(2) -0.0941(9) -0.3851(9) 0.050(5) Uani 1 1 d G . . . .
H5 H 1.1759 -0.1583 -0.3409 0.060 Uiso 1 1 calc R . . . .
C4 C 1.269(2) -0.0961(9) -0.4800(10) 0.054(6) Uani 1 1 d G . . . .
C3 C 1.283(2) -0.0020(12) -0.5447(7) 0.056(6) Uani 1 1 d G . . . .
H3 H 1.3401 -0.0034 -0.6095 0.068 Uiso 1 1 calc R . . . .
C2 C 1.212(2) 0.0940(9) -0.5144(9) 0.051(5) Uani 1 1 d G . . . .
C22 C 1.374(4) -0.503(2) -0.357(2) 0.065(7) Uani 1 1 d . . . . .
H22A H 1.3696 -0.4402 -0.4058 0.097 Uiso 1 1 calc GR . . . .
H22B H 1.4888 -0.5467 -0.3755 0.097 Uiso 1 1 calc GR . . . .
H22C H 1.3668 -0.4813 -0.2963 0.097 Uiso 1 1 calc GR . . . .
C18 C 0.935(3) 0.2812(18) -0.0975(16) 0.046(5) Uani 1 1 d . . . . .
H18 H 1.0101 0.2941 -0.1600 0.055 Uiso 1 1 calc R . . . .
C19 C 0.894(3) 0.3609(17) -0.0437(18) 0.049(5) Uani 1 1 d . . . . .
H19 H 0.9354 0.4298 -0.0682 0.059 Uiso 1 1 calc R . . . .
C20 C 0.786(3) 0.336(2) 0.0506(15) 0.053(6) Uani 1 1 d . . . . .
H20 H 0.7537 0.3878 0.0915 0.064 Uiso 1 1 calc R . . . .
C23 C 1.198(4) -0.582(2) -0.4671(16) 0.057(6) Uani 1 1 d . . . . .
H23A H 1.1036 -0.6271 -0.4702 0.085 Uiso 1 1 calc GR . . . .
H23B H 1.3191 -0.6125 -0.4972 0.085 Uiso 1 1 calc GR . . . .
H23C H 1.1752 -0.5104 -0.5005 0.085 Uiso 1 1 calc GR . . . .
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'
Br Br -0.2901 2.4595 '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'
O O 0.0106 0.0060 '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'
S S 0.1246 0.1234 '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
S1 Pt2 Cl3 176.7(2) . . ?
S1 Pt2 Cl4 86.7(2) . . ?
S1 Pt2 Cl2 93.1(2) . . ?
Cl4 Pt2 Cl3 90.74(19) . . ?
Cl2 Pt2 Cl3 89.5(2) . . ?
Cl2 Pt2 Cl4 178.0(2) . . ?
N3 Pt1 Cl1 98.4(6) . . ?
N1 Pt1 Cl1 179.0(4) . . ?
N1 Pt1 N3 80.7(6) . . ?
N1 Pt1 N2 81.6(5) . . ?
N2 Pt1 Cl1 99.4(4) . . ?
N2 Pt1 N3 162.2(6) . . ?
O1 S1 Pt2 115.7(7) . . ?
O1 S1 C22 106.9(12) . . ?
O1 S1 C23 107.3(12) . . ?
C22 S1 Pt2 113.7(9) . . ?
C22 S1 C23 102.1(13) . . ?
C23 S1 Pt2 110.1(9) . . ?
C21 N3 Pt1 128.6(16) . . ?
C21 N3 C17 117.8(19) . . ?
C17 N3 Pt1 113.5(14) . . ?
C9 N1 Pt1 118.7(6) . . ?
C9 N1 C10 120.0 . . ?
C10 N1 Pt1 121.3(6) . . ?
N1 C9 C8 120.0 . . ?
N1 C9 C12 112.4(9) . . ?
C8 C9 C12 127.6(9) . . ?
C9 C8 H8 120.0 . . ?
C7 C8 C9 120.0 . . ?
C7 C8 H8 120.0 . . ?
C8 C7 C6 120.6(9) . . ?
C11 C7 C8 120.0 . . ?
C11 C7 C6 119.4(9) . . ?
C7 C11 H11 120.0 . . ?
C7 C11 C10 120.0 . . ?
C10 C11 H11 120.0 . . ?
N1 C10 C17 109.5(11) . . ?
C11 C10 N1 120.0 . . ?
C11 C10 C17 130.5(11) . . ?
C16 N2 Pt1 126.5(7) . . ?
C16 N2 C12 120.0 . . ?
C12 N2 Pt1 113.4(7) . . ?
N2 C16 H16 120.0 . . ?
C15 C16 N2 120.0 . . ?
C15 C16 H16 120.0 . . ?
C16 C15 H15 120.0 . . ?
C16 C15 C14 120.0 . . ?
C14 C15 H15 120.0 . . ?
C15 C14 H14 120.0 . . ?
C13 C14 C15 120.0 . . ?
C13 C14 H14 120.0 . . ?
C14 C13 H13 120.0 . . ?
C14 C13 C12 120.0 . . ?
C12 C13 H13 120.0 . . ?
N2 C12 C9 113.8(9) . . ?
C13 C12 C9 126.2(9) . . ?
C13 C12 N2 120.0 . . ?
N3 C21 H21 118.1 . . ?
N3 C21 C20 124(2) . . ?
C20 C21 H21 118.1 . . ?
N3 C17 C10 115.0(17) . . ?
C18 C17 N3 122(2) . . ?
C18 C17 C10 122.7(18) . . ?
C6 C1 H1 120.0 . . ?
C6 C1 C2 120.0 . . ?
C2 C1 H1 120.0 . . ?
C1 C6 C7 119.8(10) . . ?
C5 C6 C7 120.1(10) . . ?
C5 C6 C1 120.0 . . ?
C6 C5 H5 120.0 . . ?
C6 C5 C4 120.0 . . ?
C4 C5 H5 120.0 . . ?
C5 C4 Br2 122.1(8) . . ?
C3 C4 Br2 117.9(8) . . ?
C3 C4 C5 120.0 . . ?
C4 C3 H3 120.0 . . ?
C4 C3 C2 120.0 . . ?
C2 C3 H3 120.0 . . ?
C1 C2 Br1 122.0(8) . . ?
C3 C2 Br1 117.9(8) . . ?
C3 C2 C1 120.0 . . ?
S1 C22 H22A 109.5 . . ?
S1 C22 H22B 109.5 . . ?
S1 C22 H22C 109.5 . . ?
H22A C22 H22B 109.5 . . ?
H22A C22 H22C 109.5 . . ?
H22B C22 H22C 109.5 . . ?
C17 C18 H18 119.6 . . ?
C17 C18 C19 121(2) . . ?
C19 C18 H18 119.6 . . ?
C18 C19 H19 121.4 . . ?
C18 C19 C20 117(2) . . ?
C20 C19 H19 121.4 . . ?
C21 C20 C19 118(2) . . ?
C21 C20 H20 121.0 . . ?
C19 C20 H20 121.0 . . ?
S1 C23 H23A 109.5 . . ?
S1 C23 H23B 109.5 . . ?
S1 C23 H23C 109.5 . . ?
H23A C23 H23B 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 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
Pt2 S1 2.198(5) . ?
Pt2 Cl3 2.325(5) . ?
Pt2 Cl4 2.319(5) . ?
Pt2 Cl2 2.296(5) . ?
Pt1 Cl1 2.294(6) . ?
Pt1 N3 2.034(19) . ?
Pt1 N1 1.866(8) . ?
Pt1 N2 1.995(9) . ?
Br1 C2 1.887(10) . ?
Br2 C4 1.852(10) . ?
S1 O1 1.452(17) . ?
S1 C22 1.74(3) . ?
S1 C23 1.77(2) . ?
N3 C21 1.32(3) . ?
N3 C17 1.36(3) . ?
N1 C9 1.3900 . ?
N1 C10 1.3900 . ?
C9 C8 1.3900 . ?
C9 C12 1.434(12) . ?
C8 H8 0.9500 . ?
C8 C7 1.3900 . ?
C7 C11 1.3900 . ?
C7 C6 1.512(12) . ?
C11 H11 0.9500 . ?
C11 C10 1.3900 . ?
C10 C17 1.49(2) . ?
N2 C16 1.3900 . ?
N2 C12 1.3900 . ?
C16 H16 0.9500 . ?
C16 C15 1.3900 . ?
C15 H15 0.9500 . ?
C15 C14 1.3900 . ?
C14 H14 0.9500 . ?
C14 C13 1.3900 . ?
C13 H13 0.9500 . ?
C13 C12 1.3900 . ?
C21 H21 0.9500 . ?
C21 C20 1.36(3) . ?
C17 C18 1.34(3) . ?
C1 H1 0.9500 . ?
C1 C6 1.3900 . ?
C1 C2 1.3900 . ?
C6 C5 1.3900 . ?
C5 H5 0.9500 . ?
C5 C4 1.3900 . ?
C4 C3 1.3900 . ?
C3 H3 0.9500 . ?
C3 C2 1.3900 . ?
C22 H22A 0.9800 . ?
C22 H22B 0.9800 . ?
C22 H22C 0.9800 . ?
C18 H18 0.9500 . ?
C18 C19 1.37(3) . ?
C19 H19 0.9500 . ?
C19 C20 1.43(3) . ?
C20 H20 0.9500 . ?
C23 H23A 0.9800 . ?
C23 H23B 0.9800 . ?
C23 H23C 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
Pt1 N3 C21 C20 -179.9(17) . . . . ?
Pt1 N3 C17 C10 3(2) . . . . ?
Pt1 N3 C17 C18 -179.3(17) . . . . ?
Pt1 N1 C9 C8 -179.5(9) . . . . ?
Pt1 N1 C9 C12 0.3(11) . . . . ?
Pt1 N1 C10 C11 179.5(9) . . . . ?
Pt1 N1 C10 C17 -0.5(12) . . . . ?
Pt1 N2 C16 C15 177.0(10) . . . . ?
Pt1 N2 C12 C9 4.2(11) . . . . ?
Pt1 N2 C12 C13 -177.4(9) . . . . ?
Br2 C4 C3 C2 177.0(12) . . . . ?
N3 Pt1 N1 C9 -178.6(8) . . . . ?
N3 Pt1 N1 C10 1.9(8) . . . . ?
N3 C21 C20 C19 -2(3) . . . . ?
N3 C17 C18 C19 -1(3) . . . . ?
N1 C9 C8 C7 0.0 . . . . ?
N1 C9 C12 N2 -3.0(12) . . . . ?
N1 C9 C12 C13 178.8(8) . . . . ?
N1 C10 C17 N3 -2(2) . . . . ?
N1 C10 C17 C18 -179.3(18) . . . . ?
C9 N1 C10 C11 0.0 . . . . ?
C9 N1 C10 C17 179.9(13) . . . . ?
C9 C8 C7 C11 0.0 . . . . ?
C9 C8 C7 C6 -179.6(13) . . . . ?
C8 C9 C12 N2 176.8(8) . . . . ?
C8 C9 C12 C13 -1.4(16) . . . . ?
C8 C7 C11 C10 0.0 . . . . ?
C8 C7 C6 C1 151.8(8) . . . . ?
C8 C7 C6 C5 -24.0(14) . . . . ?
C7 C11 C10 N1 0.0 . . . . ?
C7 C11 C10 C17 -179.9(16) . . . . ?
C7 C6 C5 C4 175.7(13) . . . . ?
C11 C7 C6 C1 -27.8(14) . . . . ?
C11 C7 C6 C5 156.5(9) . . . . ?
C11 C10 C17 N3 177.9(12) . . . . ?
C11 C10 C17 C18 1(3) . . . . ?
C10 N1 C9 C8 0.0 . . . . ?
C10 N1 C9 C12 179.8(12) . . . . ?
C10 C17 C18 C19 176.4(19) . . . . ?
N2 Pt1 N1 C9 1.6(7) . . . . ?
N2 Pt1 N1 C10 -177.9(8) . . . . ?
N2 C16 C15 C14 0.0 . . . . ?
C16 N2 C12 C9 -178.4(12) . . . . ?
C16 N2 C12 C13 0.0 . . . . ?
C16 C15 C14 C13 0.0 . . . . ?
C15 C14 C13 C12 0.0 . . . . ?
C14 C13 C12 C9 178.2(14) . . . . ?
C14 C13 C12 N2 0.0 . . . . ?
C12 C9 C8 C7 -179.8(14) . . . . ?
C12 N2 C16 C15 0.0 . . . . ?
C21 N3 C17 C10 -178.9(16) . . . . ?
C21 N3 C17 C18 -2(3) . . . . ?
C17 N3 C21 C20 3(3) . . . . ?
C17 C18 C19 C20 2(3) . . . . ?
C1 C6 C5 C4 0.0 . . . . ?
C6 C7 C11 C10 179.6(12) . . . . ?
C6 C1 C2 Br1 177.8(12) . . . . ?
C6 C1 C2 C3 0.0 . . . . ?
C6 C5 C4 Br2 -176.8(12) . . . . ?
C6 C5 C4 C3 0.0 . . . . ?
C5 C4 C3 C2 0.0 . . . . ?
C4 C3 C2 Br1 -177.9(11) . . . . ?
C4 C3 C2 C1 0.0 . . . . ?
C2 C1 C6 C7 -175.7(13) . . . . ?
C2 C1 C6 C5 0.0 . . . . ?
C18 C19 C20 C21 -1(3) . . . . ?
