#------------------------------------------------------------------------------
#$Date: 2019-11-07 21:22:20 +0200 (Thu, 07 Nov 2019) $
#$Revision: 223490 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/23/27/7232774.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_7232774
loop_
_publ_author_name
'Cheng, Lin'
'Xue, Chong-Yu'
'Wang, Ying'
'Yang, Dan-Dan'
'Zhang, Ying-Xin'
'Gao, Yi-Xuan'
'Day, Gregory S.'
_publ_section_title
;
 Solvent-induced SC--SC transformation within the ZnII--triazole system: a
 promising MnO4− selective luminescent probe
;
_journal_issue                   22
_journal_name_full               CrystEngComm
_journal_page_first              3390
_journal_paper_doi               10.1039/C9CE00312F
_journal_volume                  21
_journal_year                    2019
_chemical_formula_sum            'C25 H20.4 Cl5 Cu N10 O0.7'
_chemical_formula_weight         712.90
_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_Hall           '-C 2yc'
_space_group_name_H-M_alt        'C 1 2/c 1'
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2019-04-25 deposited with the CCDC.    2019-05-09 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 98.305(11)
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   17.897(2)
_cell_length_b                   14.8153(15)
_cell_length_c                   21.628(2)
_cell_measurement_reflns_used    2227
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      29.0938
_cell_measurement_theta_min      3.1846
_cell_volume                     5674.5(10)
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_diffrn_ambient_temperature      293(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_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0583
_diffrn_reflns_av_unetI/netI     0.0969
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_limit_h_max       21
_diffrn_reflns_limit_h_min       -8
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_number            11480
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_theta_full        25.007
_diffrn_reflns_theta_max         25.007
_diffrn_reflns_theta_min         3.191
_diffrn_source                   'fine-focus sealed tube'
_exptl_absorpt_coefficient_mu    1.281
_exptl_absorpt_correction_T_max  0.8511
_exptl_absorpt_correction_T_min  0.8021
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            YELLOW
_exptl_crystal_density_diffrn    1.669
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       BLOCK
_exptl_crystal_F_000             2880
_exptl_crystal_size_max          0.180
_exptl_crystal_size_mid          0.170
_exptl_crystal_size_min          0.130
_refine_diff_density_max         1.065
_refine_diff_density_min         -0.457
_refine_diff_density_rms         0.112
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.063
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     388
_refine_ls_number_reflns         5003
_refine_ls_number_restraints     12
_refine_ls_restrained_S_all      1.064
_refine_ls_R_factor_all          0.1026
_refine_ls_R_factor_gt           0.0636
_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)+(0.0722P)²+13.4032P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1526
_refine_ls_wR_factor_ref         0.1708
_reflns_Friedel_coverage         0.000
_reflns_number_gt                3404
_reflns_number_total             5003
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c9ce00312f2.cif
_cod_data_source_block           P120725D
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_absorpt_correction_type' value 'MULTI-SCAN' changed to
'multi-scan' according to
/home/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

'_exptl_crystal_density_meas' value 'NONE' was changed to '?' - the
value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 4973 2017-02-22 13:04:09Z antanas 

 Adding full bibliography for 7232773--7232779.cif.
;
_cod_original_cell_volume        5674.6(11)
_cod_original_formula_sum        'C25 H20.40 Cl5 Cu N10 O0.70'
_cod_database_code               7232774
_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_min   0.802
_shelx_estimated_absorpt_t_max   0.851
loop_
_space_group_symop_operation_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_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
Cu1 Cu 1.17060(4) 0.51167(5) 0.19798(3) 0.0223(2) Uani 1 1 d . . . . .
Cl1 Cl 1.03916(9) 0.53329(10) 0.16612(7) 0.0255(4) Uani 1 1 d . . . . .
Cl2 Cl 1.29444(10) 0.46328(11) 0.19500(8) 0.0336(4) Uani 1 1 d . . . . .
Cl3 Cl 0.14273(11) 0.56238(12) 0.52859(9) 0.0425(5) Uani 1 1 d . . . . .
Cl4 Cl 0.17103(11) 0.45827(14) 0.42232(9) 0.0489(5) Uani 1 1 d . . . . .
Cl5 Cl 0.06511(11) 0.39297(12) 0.50142(8) 0.0426(5) Uani 1 1 d . . . . .
N1 N 0.8080(3) -0.3823(3) 0.3526(2) 0.0209(12) Uani 1 1 d . . . . .
N2 N 0.7631(3) -0.2902(3) 0.4212(2) 0.0277(13) Uani 1 1 d . . . . .
N3 N 0.8166(3) -0.2475(3) 0.3928(2) 0.0229(12) Uani 1 1 d . . . . .
N4 N 0.7569(3) 0.3191(4) 0.6425(3) 0.0358(14) Uani 1 1 d . . . . .
N5 N 0.8226(3) 0.4031(3) 0.7176(2) 0.0257(12) Uani 1 1 d . . . . .
N6 N 0.8325(3) 0.3117(3) 0.6406(2) 0.0251(12) Uani 1 1 d . . . . .
N7 N 1.1545(3) 0.2514(3) 0.2671(3) 0.0346(15) Uani 1 1 d . . . . .
N8 N 1.1489(3) 0.3978(3) 0.2408(2) 0.0222(12) Uani 1 1 d . . . . .
N9 N 1.0982(3) 0.2948(3) 0.2925(2) 0.0211(12) Uani 1 1 d . . . . .
N10 N 0.9255(3) 0.1030(3) 0.4472(2) 0.0213(12) Uani 1 1 d . . . . .
C1 C 0.8970(3) 0.0152(4) 0.4335(3) 0.0185(13) Uani 1 1 d . . . . .
C2 C 0.8809(4) -0.0422(4) 0.4808(3) 0.0231(14) Uani 1 1 d . . . . .
H2A H 0.8896 -0.0222 0.5220 0.028 Uiso 1 1 calc R U . . .
C3 C 0.8831(4) -0.0163(4) 0.3725(3) 0.0238(14) Uani 1 1 d . . . . .
H3A H 0.8934 0.0205 0.3400 0.029 Uiso 1 1 calc R U . . .
C4 C 0.8542(4) -0.1014(4) 0.3594(3) 0.0229(14) Uani 1 1 d . . . . .
H4A H 0.8437 -0.1208 0.3182 0.027 Uiso 1 1 calc R U . . .
C5 C 0.8526(4) -0.1279(4) 0.4684(3) 0.0232(14) Uani 1 1 d . . . . .
H5A H 0.8417 -0.1648 0.5006 0.028 Uiso 1 1 calc R U . . .
C6 C 0.8406(3) -0.1581(4) 0.4073(3) 0.0198(14) Uani 1 1 d . . . . .
C7 C 0.8427(4) -0.3044(4) 0.3527(3) 0.0216(14) Uani 1 1 d . . . . .
H7A H 0.8801 -0.2905 0.3285 0.026 Uiso 1 1 calc R U . . .
C8 C 0.7608(4) -0.3709(4) 0.3953(3) 0.0256(15) Uani 1 1 d . . . . .
H8A H 0.7291 -0.4165 0.4057 0.031 Uiso 1 1 calc R U . . .
C9 C 0.9030(4) 0.1524(4) 0.4983(3) 0.0215(14) Uani 1 1 d . . . . .
C10 C 0.8294(4) 0.1503(4) 0.5103(3) 0.0256(15) Uani 1 1 d . . . . .
H10A H 0.7942 0.1145 0.4857 0.031 Uiso 1 1 calc R U . . .
C11 C 0.9551(4) 0.2050(4) 0.5367(3) 0.0284(15) Uani 1 1 d . . . . .
H11A H 1.0054 0.2050 0.5306 0.034 Uiso 1 1 calc R U . . .
C12 C 0.9330(4) 0.2575(4) 0.5841(3) 0.0290(16) Uani 1 1 d . . . . .
H12A H 0.9678 0.2937 0.6088 0.035 Uiso 1 1 calc R U . . .
C13 C 0.8070(4) 0.2005(4) 0.5583(3) 0.0265(15) Uani 1 1 d . . . . .
H13A H 0.7575 0.1975 0.5663 0.032 Uiso 1 1 calc R U . . .
C14 C 0.8585(4) 0.2551(4) 0.5940(3) 0.0241(15) Uani 1 1 d . . . . .
C15 C 0.8695(4) 0.3621(4) 0.6859(3) 0.0277(16) Uani 1 1 d . . . . .
H15A H 0.9218 0.3674 0.6940 0.033 Uiso 1 1 calc R U . . .
C16 C 0.7552(4) 0.3741(4) 0.6901(3) 0.0304(16) Uani 1 1 d . . . . .
H16A H 0.7104 0.3915 0.7035 0.037 Uiso 1 1 calc R U . . .
C17 C 0.9671(3) 0.1501(4) 0.4056(3) 0.0200(14) Uani 1 1 d . . . . .
C18 C 0.9557(4) 0.2421(4) 0.3957(3) 0.0229(14) Uani 1 1 d . . . . .
H18A H 0.9190 0.2719 0.4143 0.028 Uiso 1 1 calc R U . . .
C19 C 1.0210(4) 0.1064(4) 0.3757(3) 0.0219(14) Uani 1 1 d . . . . .
H19A H 1.0287 0.0448 0.3817 0.026 Uiso 1 1 calc R U . . .
C20 C 1.0629(3) 0.1525(4) 0.3375(3) 0.0198(13) Uani 1 1 d . . . . .
H20A H 1.0978 0.1223 0.3170 0.024 Uiso 1 1 calc R U . . .
C21 C 0.9984(4) 0.2894(4) 0.3584(3) 0.0235(14) Uani 1 1 d . . . . .
H21A H 0.9909 0.3511 0.3524 0.028 Uiso 1 1 calc R U . . .
C22 C 1.0524(3) 0.2451(4) 0.3301(2) 0.0192(13) Uani 1 1 d . . . . .
C23 C 1.1828(4) 0.3164(4) 0.2371(3) 0.0366(18) Uani 1 1 d . . . . .
H23A H 1.2230 0.3077 0.2149 0.044 Uiso 1 1 calc R U . . .
C24 C 1.0958(3) 0.3817(4) 0.2760(3) 0.0190(13) Uani 1 1 d . . . . .
H24A H 1.0621 0.4242 0.2875 0.023 Uiso 1 1 calc R U . . .
C25 C 0.1024(4) 0.4890(5) 0.4697(3) 0.0349(17) Uani 1 1 d . . . . .
H25A H 0.0613 0.5207 0.4436 0.042 Uiso 1 1 calc R U . . .
O1 O 0.0104(18) 0.8765(11) 0.2609(12) 0.058(7) Uani 0.3 1 d . U P A -1
O1' O -0.0623(8) 0.8156(9) 0.2404(5) 0.046(3) Uani 0.4 1 d . U P B -2
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'
O O 0.0106 0.0060 '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'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cu Cu 0.3201 1.2651 '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
N1 Cu1 N8 174.16(19) 2_765 .
N1 Cu1 N5 90.60(18) 2_765 5_766
N8 Cu1 N5 95.24(19) . 5_766
N1 Cu1 Cl2 88.20(15) 2_765 .
N8 Cu1 Cl2 90.12(15) . .
N5 Cu1 Cl2 104.98(15) 5_766 .
N1 Cu1 Cl1 89.73(15) 2_765 .
N8 Cu1 Cl1 89.87(16) . .
N5 Cu1 Cl1 95.56(15) 5_766 .
Cl2 Cu1 Cl1 159.38(7) . .
C7 N1 C8 103.4(5) . .
C7 N1 Cu1 124.7(4) . 2_745
C8 N1 Cu1 131.7(4) . 2_745
C8 N2 N3 102.1(5) . .
C7 N3 N2 109.5(5) . .
C7 N3 C6 127.6(5) . .
N2 N3 C6 122.9(5) . .
C16 N4 N6 102.0(5) . .
C15 N5 C16 102.9(5) . .
C15 N5 Cu1 137.3(5) . 5_766
C16 N5 Cu1 119.4(4) . 5_766
C15 N6 N4 108.9(5) . .
C15 N6 C14 131.7(6) . .
N4 N6 C14 119.4(5) . .
C23 N7 N9 102.3(5) . .
C24 N8 C23 103.8(5) . .
C24 N8 Cu1 128.7(4) . .
C23 N8 Cu1 127.4(4) . .
C24 N9 N7 110.0(5) . .
C24 N9 C22 130.2(5) . .
N7 N9 C22 119.8(5) . .
C1 N10 C17 121.5(4) . .
C1 N10 C9 119.9(5) . .
C17 N10 C9 117.8(5) . .
C3 C1 C2 117.8(5) . .
C3 C1 N10 121.2(5) . .
C2 C1 N10 121.0(5) . .
C5 C2 C1 121.8(5) . .
C5 C2 H2A 119.1 . .
C1 C2 H2A 119.1 . .
C4 C3 C1 120.9(5) . .
C4 C3 H3A 119.6 . .
C1 C3 H3A 119.6 . .
C3 C4 C6 120.3(5) . .
C3 C4 H4A 119.8 . .
C6 C4 H4A 119.8 . .
C2 C5 C6 119.1(5) . .
C2 C5 H5A 120.4 . .
C6 C5 H5A 120.4 . .
C5 C6 C4 119.9(5) . .
C5 C6 N3 121.1(5) . .
C4 C6 N3 119.0(5) . .
N1 C7 N3 110.2(5) . .
N1 C7 H7A 124.9 . .
N3 C7 H7A 124.9 . .
N2 C8 N1 114.8(5) . .
N2 C8 H8A 122.6 . .
N1 C8 H8A 122.6 . .
C10 C9 C11 118.3(5) . .
C10 C9 N10 121.2(5) . .
C11 C9 N10 120.6(5) . .
C9 C10 C13 121.2(6) . .
C9 C10 H10A 119.4 . .
C13 C10 H10A 119.4 . .
C12 C11 C9 121.1(6) . .
C12 C11 H11A 119.4 . .
C9 C11 H11A 119.4 . .
C14 C12 C11 118.9(6) . .
C14 C12 H12A 120.5 . .
C11 C12 H12A 120.5 . .
C14 C13 C10 119.7(6) . .
C14 C13 H13A 120.2 . .
C10 C13 H13A 120.2 . .
C13 C14 C12 120.7(6) . .
C13 C14 N6 118.6(6) . .
C12 C14 N6 120.7(5) . .
N5 C15 N6 110.9(6) . .
N5 C15 H15A 124.5 . .
N6 C15 H15A 124.5 . .
N4 C16 N5 115.3(6) . .
N4 C16 H16A 122.3 . .
N5 C16 H16A 122.3 . .
C18 C17 C19 118.6(5) . .
C18 C17 N10 119.8(5) . .
C19 C17 N10 121.6(5) . .
C21 C18 C17 120.5(6) . .
C21 C18 H18A 119.8 . .
C17 C18 H18A 119.8 . .
C20 C19 C17 121.5(5) . .
C20 C19 H19A 119.2 . .
C17 C19 H19A 119.2 . .
C19 C20 C22 118.8(5) . .
C19 C20 H20A 120.6 . .
C22 C20 H20A 120.6 . .
C18 C21 C22 119.9(5) . .
C18 C21 H21A 120.0 . .
C22 C21 H21A 120.0 . .
C21 C22 C20 120.7(5) . .
C21 C22 N9 119.9(5) . .
C20 C22 N9 119.4(5) . .
N7 C23 N8 114.7(6) . .
N7 C23 H23A 122.7 . .
N8 C23 H23A 122.7 . .
N8 C24 N9 109.2(5) . .
N8 C24 H24A 125.4 . .
N9 C24 H24A 125.4 . .
Cl3 C25 Cl5 111.1(4) . .
Cl3 C25 Cl4 109.5(4) . .
Cl5 C25 Cl4 110.7(4) . .
Cl3 C25 H25A 108.5 . .
Cl5 C25 H25A 108.5 . .
Cl4 C25 H25A 108.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Cu1 N1 1.983(5) 2_765
Cu1 N8 1.990(5) .
Cu1 N5 2.208(5) 5_766
Cu1 Cl2 2.3391(19) .
Cu1 Cl1 2.3755(18) .
Cl3 C25 1.750(7) .
Cl4 C25 1.768(7) .
Cl5 C25 1.753(7) .
N1 C7 1.310(7) .
N1 C8 1.350(7) .
N1 Cu1 1.983(5) 2_745
N2 C8 1.319(7) .
N2 N3 1.366(7) .
N3 C7 1.340(7) .
N3 C6 1.414(7) .
N4 C16 1.315(8) .
N4 N6 1.364(7) .
N5 C15 1.309(8) .
N5 C16 1.336(8) .
N5 Cu1 2.208(5) 5_766
N6 C15 1.330(8) .
N6 C14 1.440(7) .
N7 C23 1.305(8) .
N7 N9 1.374(7) .
N8 C24 1.323(7) .
N8 C23 1.357(8) .
N9 C24 1.335(7) .
N9 C22 1.438(7) .
N10 C1 1.414(7) .
N10 C17 1.429(7) .
N10 C9 1.430(7) .
C1 C3 1.387(8) .
C1 C2 1.391(8) .
C2 C5 1.378(8) .
C2 H2A 0.9300 .
C3 C4 1.376(8) .
C3 H3A 0.9300 .
C4 C6 1.381(8) .
C4 H4A 0.9300 .
C5 C6 1.382(8) .
C5 H5A 0.9300 .
C7 H7A 0.9300 .
C8 H8A 0.9300 .
C9 C10 1.380(8) .
C9 C11 1.395(8) .
C10 C13 1.382(8) .
C10 H10A 0.9300 .
C11 C12 1.388(8) .
C11 H11A 0.9300 .
C12 C14 1.381(9) .
C12 H12A 0.9300 .
C13 C14 1.375(9) .
C13 H13A 0.9300 .
C15 H15A 0.9300 .
C16 H16A 0.9300 .
C17 C18 1.390(8) .
C17 C19 1.395(8) .
C18 C21 1.380(8) .
C18 H18A 0.9300 .
C19 C20 1.375(8) .
C19 H19A 0.9300 .
C20 C22 1.391(8) .
C20 H20A 0.9300 .
C21 C22 1.383(8) .
C21 H21A 0.9300 .
C23 H23A 0.9300 .
C24 H24A 0.9300 .
C25 H25A 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
C8 N2 N3 C7 -0.4(6) .
C8 N2 N3 C6 -178.0(6) .
C16 N4 N6 C15 -0.3(7) .
C16 N4 N6 C14 179.5(5) .
C23 N7 N9 C24 0.4(7) .
C23 N7 N9 C22 180.0(5) .
C17 N10 C1 C3 -23.7(9) .
C9 N10 C1 C3 146.2(6) .
C17 N10 C1 C2 157.1(6) .
C9 N10 C1 C2 -33.0(8) .
C3 C1 C2 C5 0.4(9) .
N10 C1 C2 C5 179.6(6) .
C2 C1 C3 C4 0.2(9) .
N10 C1 C3 C4 -179.0(6) .
C1 C3 C4 C6 -2.0(10) .
C1 C2 C5 C6 0.8(9) .
C2 C5 C6 C4 -2.5(9) .
C2 C5 C6 N3 175.5(6) .
C3 C4 C6 C5 3.1(9) .
C3 C4 C6 N3 -175.0(6) .
C7 N3 C6 C5 -135.8(6) .
N2 N3 C6 C5 41.5(9) .
C7 N3 C6 C4 42.3(9) .
N2 N3 C6 C4 -140.5(6) .
C8 N1 C7 N3 -1.3(7) .
Cu1 N1 C7 N3 -178.5(4) 2_745
N2 N3 C7 N1 1.1(7) .
C6 N3 C7 N1 178.6(6) .
N3 N2 C8 N1 -0.5(7) .
C7 N1 C8 N2 1.1(8) .
Cu1 N1 C8 N2 178.1(4) 2_745
C1 N10 C9 C10 -40.3(8) .
C17 N10 C9 C10 130.0(6) .
C1 N10 C9 C11 140.6(6) .
C17 N10 C9 C11 -49.1(8) .
C11 C9 C10 C13 1.4(9) .
N10 C9 C10 C13 -177.7(5) .
C10 C9 C11 C12 -3.0(9) .
N10 C9 C11 C12 176.1(6) .
C9 C11 C12 C14 1.8(10) .
C9 C10 C13 C14 1.3(10) .
C10 C13 C14 C12 -2.6(10) .
C10 C13 C14 N6 175.5(5) .
C11 C12 C14 C13 1.0(10) .
C11 C12 C14 N6 -177.0(5) .
C15 N6 C14 C13 170.9(6) .
N4 N6 C14 C13 -8.8(8) .
C15 N6 C14 C12 -11.0(10) .
N4 N6 C14 C12 169.3(6) .
C16 N5 C15 N6 1.0(7) .
Cu1 N5 C15 N6 174.0(4) 5_766
N4 N6 C15 N5 -0.4(7) .
C14 N6 C15 N5 179.8(5) .
N6 N4 C16 N5 1.0(7) .
C15 N5 C16 N4 -1.3(7) .
Cu1 N5 C16 N4 -175.9(4) 5_766
C1 N10 C17 C18 140.3(6) .
C9 N10 C17 C18 -29.8(8) .
C1 N10 C17 C19 -41.5(8) .
C9 N10 C17 C19 148.4(6) .
C19 C17 C18 C21 -1.9(9) .
N10 C17 C18 C21 176.4(5) .
C18 C17 C19 C20 0.6(9) .
N10 C17 C19 C20 -177.6(6) .
C17 C19 C20 C22 1.6(9) .
C17 C18 C21 C22 0.8(9) .
C18 C21 C22 C20 1.5(9) .
C18 C21 C22 N9 -178.4(5) .
C19 C20 C22 C21 -2.7(9) .
C19 C20 C22 N9 177.3(5) .
C24 N9 C22 C21 -4.0(9) .
N7 N9 C22 C21 176.5(6) .
C24 N9 C22 C20 176.0(6) .
N7 N9 C22 C20 -3.4(8) .
N9 N7 C23 N8 -0.4(8) .
C24 N8 C23 N7 0.2(8) .
Cu1 N8 C23 N7 -176.1(5) .
C23 N8 C24 N9 0.1(7) .
Cu1 N8 C24 N9 176.3(4) .
N7 N9 C24 N8 -0.3(7) .
C22 N9 C24 N8 -179.8(5) .
