#------------------------------------------------------------------------------
#$Date: 2016-02-16 03:10:39 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176453 $
#$URL: svn://www.crystallography.net/cod/cif/7/21/53/7215390.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_7215390
loop_
_publ_author_name
'Zhu, Xia'
'Wang, Li-Yan'
'Liu, Xun-Gao'
'Wang, Ju'
'Li, Bao-Long'
'Li, Hai-Yan'
_publ_section_title
;
 Structural versatility of seven copper(ii) coordination polymers
 constructed with the long flexible ligand
 1,4-bis(1,2,4-triazol-1-yl)butane
;
_journal_issue                   20
_journal_name_full               CrystEngComm
_journal_page_first              6090
_journal_paper_doi               10.1039/c1ce05466j
_journal_volume                  13
_journal_year                    2011
_chemical_formula_sum            'C19 H24.5 Cu2 N6 O12.5'
_chemical_formula_weight         664.03
_chemical_name_systematic
;
?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_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
_cell_angle_alpha                94.154(11)
_cell_angle_beta                 96.89
_cell_angle_gamma                112.580(8)
_cell_formula_units_Z            2
_cell_length_a                   7.5798(9)
_cell_length_b                   8.78490(10)
_cell_length_c                   19.056(3)
_cell_measurement_reflns_used    4026
_cell_measurement_temperature    223(2)
_cell_measurement_theta_max      25.3491
_cell_measurement_theta_min      3.0312
_cell_volume                     1153.4(2)
_computing_cell_refinement       'CrystalClear (Rigaku Corp., 2000)'
_computing_data_collection       'CrystalClear (Rigaku Corp., 2000)'
_computing_data_reduction        'CrystalClear (Rigaku Corp., 2000)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      223(2)
_diffrn_measured_fraction_theta_full 0.993
_diffrn_measured_fraction_theta_max 0.993
_diffrn_measurement_device_type  'Rigaku Mercury CCD'
_diffrn_measurement_method       ω
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71070
_diffrn_reflns_av_R_equivalents  0.0371
_diffrn_reflns_av_sigmaI/netI    0.0515
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -8
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_k_min       -10
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            11368
_diffrn_reflns_theta_full        25.35
_diffrn_reflns_theta_max         25.35
_diffrn_reflns_theta_min         3.03
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    1.928
_exptl_absorpt_correction_T_max  0.7608
_exptl_absorpt_correction_T_min  0.5127
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Jacobson, R. (1998) Private communication'
_exptl_crystal_colour            Blue
_exptl_crystal_density_diffrn    1.912
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Block
_exptl_crystal_F_000             677
_exptl_crystal_size_max          0.40
_exptl_crystal_size_mid          0.24
_exptl_crystal_size_min          0.15
_refine_diff_density_max         0.590
_refine_diff_density_min         -0.786
_refine_diff_density_rms         0.112
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.075
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     378
_refine_ls_number_reflns         4190
_refine_ls_number_restraints     8
_refine_ls_restrained_S_all      1.075
_refine_ls_R_factor_all          0.0649
_refine_ls_R_factor_gt           0.0483
_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)+(0.0594P)²+2.9420P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1200
_refine_ls_wR_factor_ref         0.1315
_reflns_number_gt                3405
_reflns_number_total             4190
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c1ce05466j.txt
_cod_data_source_block           Cu_btb_btec
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to
/usr/data/users/saulius/automatic-downloads/retrospective/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from
2011-04-26.

'_exptl_absorpt_correction_type' value 'Multi-scan'
changed to 'multi-scan' according to
/usr/data/users/saulius/automatic-downloads/retrospective/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 2281 2013-09-26 08:29:07Z andrius 
;
_cod_original_sg_symbol_H-M      P-1
_cod_original_formula_sum        'C19 H24.50 Cu2 N6 O12.50'
_cod_database_code               7215390
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
Cu1 Cu 0.68000(8) 0.85471(7) 0.83359(3) 0.01719(18) Uani 1 1 d .
Cu2 Cu -0.00510(8) 0.70464(7) 0.65110(3) 0.01993(18) Uani 1 1 d .
O1 O 0.6958(6) 0.6989(4) 0.7411(2) 0.0406(11) Uani 1 1 d .
O2 O 0.7333(4) 0.5430(4) 0.65326(18) 0.0219(7) Uani 1 1 d .
O3 O 0.0833(5) 0.5378(4) 0.68822(19) 0.0253(8) Uani 1 1 d .
O4 O 0.3364(5) 0.5922(5) 0.6301(2) 0.0330(9) Uani 1 1 d .
O5 O -0.1000(4) 0.0342(4) 0.80869(17) 0.0191(7) Uani 1 1 d .
O6 O 0.0984(6) -0.0988(6) 0.8193(3) 0.0708(18) Uani 1 1 d .
O7 O 0.5060(4) -0.0515(4) 0.78044(17) 0.0200(7) Uani 1 1 d .
O8 O 0.5280(6) 0.0884(5) 0.88566(19) 0.0358(9) Uani 1 1 d .
O9 O 0.8483(5) 0.8266(6) 0.9167(2) 0.0456(12) Uani 1 1 d D
O10 O 0.2721(5) 0.8540(4) 0.65205(19) 0.0247(8) Uani 1 1 d D
O11 O -0.0610(7) 0.6196(5) 0.5269(2) 0.0437(11) Uani 1 1 d D
O12 O 0.5000 0.5000 0.5000 0.073(2) Uani 1 2 d S
O13 O 1.2286(12) 1.1271(9) 0.9546(4) 0.109(2) Uani 1 1 d .
H13 H 1.3018 1.2224 0.9733 0.164 Uiso 1 1 calc R
N1 N 0.1836(6) 0.5197(5) 0.8901(2) 0.0203(9) Uani 1 1 d .
N2 N 0.3072(6) 0.4492(5) 0.9149(2) 0.0255(9) Uani 1 1 d .
N3 N 0.4623(5) 0.6789(5) 0.8661(2) 0.0199(9) Uani 1 1 d .
N4 N -0.2079(6) 1.0658(5) 0.6023(2) 0.0201(9) Uani 1 1 d .
N5 N -0.0397(6) 1.1236(5) 0.5741(2) 0.0238(9) Uani 1 1 d .
N6 N -0.0679(6) 0.8982(5) 0.6271(2) 0.0205(9) Uani 1 1 d .
C1 C -0.0467(7) 0.4204(6) 0.9741(3) 0.0263(11) Uani 1 1 d .
H1A H 0.0084 0.3415 0.9892 0.032 Uiso 1 1 calc R
H1B H -0.1855 0.3710 0.9764 0.032 Uiso 1 1 calc R
C2 C -0.0211(7) 0.4440(6) 0.8975(3) 0.0261(11) Uani 1 1 d .
H2A H -0.0826 0.3359 0.8676 0.031 Uiso 1 1 calc R
H2B H -0.0858 0.5151 0.8805 0.031 Uiso 1 1 calc R
C3 C 0.4712(7) 0.5486(6) 0.8996(3) 0.0273(12) Uani 1 1 d .
H3A H 0.5866 0.5326 0.9107 0.033 Uiso 1 1 calc R
C4 C 0.2786(7) 0.6564(6) 0.8617(3) 0.0234(11) Uani 1 1 d .
H4A H 0.2235 0.7258 0.8418 0.028 Uiso 1 1 calc R
C5 C -0.4487(7) 1.0938(6) 0.5116(3) 0.0258(11) Uani 1 1 d .
H5A H -0.3516 1.1413 0.4809 0.031 Uiso 1 1 calc R
H5B H -0.5437 1.1440 0.5044 0.031 Uiso 1 1 calc R
C6 C -0.3498(7) 1.1402(6) 0.5889(3) 0.0237(11) Uani 1 1 d .
H6A H -0.2846 1.2614 0.5996 0.028 Uiso 1 1 calc R
H6B H -0.4471 1.1012 0.6202 0.028 Uiso 1 1 calc R
C7 C 0.0395(7) 1.0193(6) 0.5916(3) 0.0211(10) Uani 1 1 d .
H7A H 0.1602 1.0282 0.5803 0.025 Uiso 1 1 calc R
C8 C -0.2228(7) 0.9324(6) 0.6331(2) 0.0218(10) Uani 1 1 d .
H8A H -0.3265 0.8711 0.6558 0.026 Uiso 1 1 calc R
C9 C 0.4847(6) 0.4154(5) 0.7209(2) 0.0154(9) Uani 1 1 d .
C10 C 0.2927(6) 0.4009(5) 0.7134(2) 0.0165(9) Uani 1 1 d .
C11 C 0.1596(6) 0.2733(5) 0.7408(2) 0.0153(9) Uani 1 1 d .
H11A H 0.0309 0.2641 0.7362 0.018 Uiso 1 1 calc R
C12 C 0.2092(6) 0.1573(5) 0.7751(2) 0.0173(10) Uani 1 1 d .
C13 C 0.4021(6) 0.1713(5) 0.7816(2) 0.0154(9) Uani 1 1 d .
C14 C 0.5363(6) 0.3000(5) 0.7534(2) 0.0166(9) Uani 1 1 d .
H14A H 0.6645 0.3084 0.7565 0.020 Uiso 1 1 calc R
C15 C 0.6469(6) 0.5663(5) 0.7025(3) 0.0167(10) Uani 1 1 d .
C16 C 0.2338(7) 0.5182(6) 0.6742(3) 0.0201(10) Uani 1 1 d .
C17 C 0.0580(7) 0.0182(6) 0.8033(3) 0.0259(11) Uani 1 1 d .
C18 C 0.4786(6) 0.0602(6) 0.8204(3) 0.0203(10) Uani 1 1 d .
C19 C 1.2909(18) 0.9989(14) 0.9903(5) 0.116(4) Uani 1 1 d .
H19A H 1.3800 1.0529 1.0341 0.175 Uiso 1 1 calc R
H19B H 1.3543 0.9539 0.9582 0.175 Uiso 1 1 calc R
H19C H 1.1777 0.9095 1.0008 0.175 Uiso 1 1 calc R
H1W H 0.833(14) 0.872(13) 0.951(4) 0.140 Uiso 1 1 d D
H2W H 0.958(9) 0.873(12) 0.907(5) 0.140 Uiso 1 1 d D
H3W H 0.317(15) 0.783(11) 0.643(6) 0.140 Uiso 1 1 d D
H4W H 0.348(13) 0.904(12) 0.694(4) 0.140 Uiso 1 1 d D
H5W H -0.052(16) 0.673(12) 0.492(4) 0.140 Uiso 1 1 d D
H6W H 0.006(12) 0.571(10) 0.523(5) 0.140 Uiso 1 1 d 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'
Cu Cu 0.3201 1.2651 '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'
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
O5 Cu1 N3 175.92(15) 1_665 .
O5 Cu1 O9 90.89(15) 1_665 .
N3 Cu1 O9 86.17(16) . .
O5 Cu1 O7 88.21(13) 1_665 1_565
N3 Cu1 O7 93.40(15) . 1_565
O9 Cu1 O7 157.12(18) . 1_565
O5 Cu1 O1 87.37(13) 1_665 .
N3 Cu1 O1 96.16(15) . .
O9 Cu1 O1 106.45(19) . .
O7 Cu1 O1 96.35(15) 1_565 .
O2 Cu2 O3 85.95(13) 1_455 .
O2 Cu2 O10 174.52(14) 1_455 .
O3 Cu2 O10 88.57(14) . .
O2 Cu2 N6 99.01(15) 1_455 .
O3 Cu2 N6 170.88(16) . .
O10 Cu2 N6 86.45(15) . .
O2 Cu2 O11 87.49(15) 1_455 .
O3 Cu2 O11 101.06(15) . .
O10 Cu2 O11 93.32(16) . .
N6 Cu2 O11 86.86(15) . .
C15 O1 Cu1 153.4(3) . .
C15 O2 Cu2 118.4(3) . 1_655
C16 O3 Cu2 124.4(3) . .
C17 O5 Cu1 121.3(3) . 1_445
C18 O7 Cu1 112.4(3) . 1_545
Cu1 O9 H1W 107(9) . .
Cu1 O9 H2W 103(8) . .
H1W O9 H2W 112(6) . .
Cu2 O10 H3W 100(8) . .
Cu2 O10 H4W 119(7) . .
H3W O10 H4W 99(9) . .
Cu2 O11 H5W 132(8) . .
Cu2 O11 H6W 103(6) . .
H5W O11 H6W 106(10) . .
C19 O13 H13 109.5 . .
C4 N1 N2 110.2(4) . .
C4 N1 C2 129.6(4) . .
N2 N1 C2 120.2(4) . .
C3 N2 N1 102.7(4) . .
C4 N3 C3 103.3(4) . .
C4 N3 Cu1 130.2(3) . .
C3 N3 Cu1 126.5(3) . .
C8 N4 N5 110.2(4) . .
C8 N4 C6 129.3(4) . .
N5 N4 C6 120.1(4) . .
C7 N5 N4 102.6(4) . .
C8 N6 C7 103.8(4) . .
C8 N6 Cu2 131.7(3) . .
C7 N6 Cu2 124.2(3) . .
C2 C1 C1 114.2(5) . 2_567
C2 C1 H1A 108.7 . .
C1 C1 H1A 108.7 2_567 .
C2 C1 H1B 108.7 . .
C1 C1 H1B 108.7 2_567 .
H1A C1 H1B 107.6 . .
N1 C2 C1 111.7(4) . .
N1 C2 H2A 109.3 . .
C1 C2 H2A 109.3 . .
N1 C2 H2B 109.3 . .
C1 C2 H2B 109.3 . .
H2A C2 H2B 107.9 . .
N2 C3 N3 114.4(4) . .
N2 C3 H3A 122.8 . .
N3 C3 H3A 122.8 . .
N3 C4 N1 109.3(4) . .
N3 C4 H4A 125.3 . .
N1 C4 H4A 125.3 . .
C6 C5 C5 113.9(5) . 2_476
C6 C5 H5A 108.8 . .
C5 C5 H5A 108.8 2_476 .
C6 C5 H5B 108.8 . .
C5 C5 H5B 108.8 2_476 .
H5A C5 H5B 107.7 . .
N4 C6 C5 110.7(4) . .
N4 C6 H6A 109.5 . .
C5 C6 H6A 109.5 . .
N4 C6 H6B 109.5 . .
C5 C6 H6B 109.5 . .
H6A C6 H6B 108.1 . .
N5 C7 N6 114.1(4) . .
N5 C7 H7A 123.0 . .
N6 C7 H7A 123.0 . .
N4 C8 N6 109.4(4) . .
N4 C8 H8A 125.3 . .
N6 C8 H8A 125.3 . .
C14 C9 C10 120.0(4) . .
C14 C9 C15 117.2(4) . .
C10 C9 C15 122.3(4) . .
C11 C10 C9 118.8(4) . .
C11 C10 C16 120.9(4) . .
C9 C10 C16 120.2(4) . .
C10 C11 C12 122.2(4) . .
C10 C11 H11A 118.9 . .
C12 C11 H11A 118.9 . .
C11 C12 C13 118.7(4) . .
C11 C12 C17 120.3(4) . .
C13 C12 C17 120.9(4) . .
C14 C13 C12 119.0(4) . .
C14 C13 C18 116.4(4) . .
C12 C13 C18 124.6(4) . .
C9 C14 C13 121.2(4) . .
C9 C14 H14A 119.4 . .
C13 C14 H14A 119.4 . .
O1 C15 O2 124.5(4) . .
O1 C15 C9 117.7(4) . .
O2 C15 C9 117.4(4) . .
O4 C16 O3 124.6(4) . .
O4 C16 C10 118.0(4) . .
O3 C16 C10 117.4(4) . .
O6 C17 O5 126.2(4) . .
O6 C17 C12 117.4(4) . .
O5 C17 C12 116.4(4) . .
O8 C18 O7 123.8(4) . .
O8 C18 C13 120.2(4) . .
O7 C18 C13 115.7(4) . .
O13 C19 H19A 109.5 . .
O13 C19 H19B 109.5 . .
H19A C19 H19B 109.5 . .
O13 C19 H19C 109.5 . .
H19A C19 H19C 109.5 . .
H19B C19 H19C 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Cu1 O5 1.942(3) 1_665
Cu1 N3 1.980(4) .
Cu1 O9 2.002(4) .
Cu1 O7 2.019(3) 1_565
Cu1 O1 2.196(4) .
Cu2 O2 1.954(3) 1_455
Cu2 O3 1.972(3) .
Cu2 O10 2.002(3) .
Cu2 N6 2.002(4) .
Cu2 O11 2.366(4) .
O1 C15 1.230(6) .
O2 C15 1.255(6) .
O2 Cu2 1.954(3) 1_655
O3 C16 1.273(6) .
O4 C16 1.257(6) .
O5 C17 1.273(6) .
O5 Cu1 1.942(3) 1_445
O6 C17 1.228(6) .
O7 C18 1.293(6) .
O7 Cu1 2.019(3) 1_545
O8 C18 1.233(6) .
O9 H1W 0.79(4) .
O9 H2W 0.82(5) .
O10 H3W 0.83(5) .
O10 H4W 0.90(5) .
O11 H5W 0.83(5) .
O11 H6W 0.78(5) .
O13 C19 1.548(12) .
O13 H13 0.8300 .
N1 C4 1.332(6) .
N1 N2 1.365(6) .
N1 C2 1.464(6) .
N2 C3 1.297(6) .
N3 C4 1.320(6) .
N3 C3 1.370(6) .
N4 C8 1.321(6) .
N4 N5 1.370(5) .
N4 C6 1.465(6) .
N5 C7 1.315(6) .
N6 C8 1.335(6) .
N6 C7 1.351(6) .
C1 C2 1.514(7) .
C1 C1 1.519(10) 2_567
C1 H1A 0.9800 .
C1 H1B 0.9800 .
C2 H2A 0.9800 .
C2 H2B 0.9800 .
C3 H3A 0.9400 .
C4 H4A 0.9400 .
C5 C6 1.520(7) .
C5 C5 1.532(10) 2_476
C5 H5A 0.9800 .
C5 H5B 0.9800 .
C6 H6A 0.9800 .
C6 H6B 0.9800 .
C7 H7A 0.9400 .
C8 H8A 0.9400 .
C9 C14 1.379(6) .
C9 C10 1.399(6) .
C9 C15 1.520(6) .
C10 C11 1.375(6) .
C10 C16 1.485(6) .
C11 C12 1.392(6) .
C11 H11A 0.9400 .
C12 C13 1.409(6) .
C12 C17 1.504(6) .
C13 C14 1.392(6) .
C13 C18 1.508(6) .
C14 H14A 0.9400 .
C19 H19A 0.9700 .
C19 H19B 0.9700 .
C19 H19C 0.9700 .
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
O9 H1W O13 0.79(4) 1.91(6) 2.628(10) 151(12) 2_777
O9 H2W O6 0.82(5) 2.07(7) 2.744(6) 139(10) 1_665
O9 H2W O13 0.82(5) 2.40(8) 3.030(9) 134(9) .
O10 H3W O4 0.83(5) 1.74(6) 2.544(5) 161(11) .
O10 H4W O7 0.90(5) 1.84(6) 2.712(5) 164(10) 1_565
O11 H5W N5 0.83(5) 2.20(6) 3.006(6) 162(10) 2_576
O11 H6W O11 0.78(5) 2.07(2) 2.780(8) 150(5) 2_566
O13 H13 N2 0.83 2.34 2.840(8) 119.1 1_665
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
O5 Cu1 O1 C15 173.9(9) 1_665
N3 Cu1 O1 C15 -4.0(9) .
O9 Cu1 O1 C15 83.8(9) .
O7 Cu1 O1 C15 -98.1(9) 1_565
O2 Cu2 O3 C16 147.9(4) 1_455
O10 Cu2 O3 C16 -31.8(4) .
O11 Cu2 O3 C16 61.3(4) .
C4 N1 N2 C3 -0.2(5) .
C2 N1 N2 C3 -179.7(4) .
O9 Cu1 N3 C4 148.1(5) .
O7 Cu1 N3 C4 -8.9(4) 1_565
O1 Cu1 N3 C4 -105.7(4) .
O9 Cu1 N3 C3 -31.9(4) .
O7 Cu1 N3 C3 171.0(4) 1_565
O1 Cu1 N3 C3 74.3(4) .
C8 N4 N5 C7 -1.1(5) .
C6 N4 N5 C7 -174.5(4) .
O2 Cu2 N6 C8 19.6(5) 1_455
O10 Cu2 N6 C8 -159.9(4) .
O11 Cu2 N6 C8 106.5(4) .
O2 Cu2 N6 C7 -152.0(4) 1_455
O10 Cu2 N6 C7 28.5(4) .
O11 Cu2 N6 C7 -65.1(4) .
C4 N1 C2 C1 -125.0(5) .
N2 N1 C2 C1 54.4(6) .
C1 C1 C2 N1 57.7(7) 2_567
N1 N2 C3 N3 -0.3(6) .
C4 N3 C3 N2 0.7(6) .
Cu1 N3 C3 N2 -179.3(3) .
C3 N3 C4 N1 -0.8(5) .
Cu1 N3 C4 N1 179.2(3) .
N2 N1 C4 N3 0.6(6) .
C2 N1 C4 N3 -180.0(4) .
C8 N4 C6 C5 -101.2(6) .
N5 N4 C6 C5 70.7(5) .
C5 C5 C6 N4 57.7(7) 2_476
N4 N5 C7 N6 1.4(5) .
C8 N6 C7 N5 -1.2(6) .
Cu2 N6 C7 N5 172.4(3) .
N5 N4 C8 N6 0.4(5) .
C6 N4 C8 N6 173.0(4) .
C7 N6 C8 N4 0.4(5) .
Cu2 N6 C8 N4 -172.4(3) .
C14 C9 C10 C11 2.0(7) .
C15 C9 C10 C11 -170.5(4) .
C14 C9 C10 C16 -175.9(4) .
C15 C9 C10 C16 11.6(7) .
C9 C10 C11 C12 -0.7(7) .
C16 C10 C11 C12 177.2(4) .
C10 C11 C12 C13 -0.3(7) .
C10 C11 C12 C17 -179.0(4) .
C11 C12 C13 C14 -0.2(7) .
C17 C12 C13 C14 178.6(4) .
C11 C12 C13 C18 176.9(4) .
C17 C12 C13 C18 -4.4(7) .
C10 C9 C14 C13 -2.5(7) .
C15 C9 C14 C13 170.4(4) .
C12 C13 C14 C9 1.5(7) .
C18 C13 C14 C9 -175.7(4) .
Cu1 O1 C15 O2 -170.4(6) .
Cu2 O2 C15 O1 16.0(6) 1_655
Cu2 O2 C15 C9 -157.0(3) 1_655
C14 C9 C15 O1 -103.5(5) .
C10 C9 C15 O1 69.2(6) .
C14 C9 C15 O2 70.0(6) .
C10 C9 C15 O2 -117.3(5) .
Cu2 O3 C16 O4 -6.5(7) .
Cu2 O3 C16 C10 172.8(3) .
C11 C10 C16 O4 -155.5(5) .
C9 C10 C16 O4 22.3(7) .
C11 C10 C16 O3 25.1(6) .
C9 C10 C16 O3 -157.1(4) .
Cu1 O5 C17 O6 -7.8(8) 1_445
Cu1 O5 C17 C12 172.8(3) 1_445
C11 C12 C17 O6 165.1(5) .
C13 C12 C17 O6 -13.7(8) .
C11 C12 C17 O5 -15.4(7) .
C13 C12 C17 O5 165.8(4) .
Cu1 O7 C18 O8 -10.4(6) 1_545
Cu1 O7 C18 C13 162.7(3) 1_545
C14 C13 C18 O8 94.5(5) .
C12 C13 C18 O8 -82.6(6) .
C14 C13 C18 O7 -78.8(5) .
C12 C13 C18 O7 104.1(5) .
