#------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176432 $
#$URL: svn://www.crystallography.net/cod/cif/7/20/72/7207239.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_7207239
loop_
_publ_author_name
'Maekawa, Masahiko'
'Tominaga, Toshi'
'Sugimoto, Kunihisa'
'Okubo, Takashi'
'Kuroda-Sowa, Takayoshi'
'Munakata, Megumu'
'Kitagawa, Susumu'
_publ_section_title
;
 Framework dimensionality of copper(i) coordination polymers of
 4,4′-bipyrimidine controlled by anions and solvents
;
_journal_issue                   4
_journal_name_full               CrystEngComm
_journal_page_first              1345
_journal_paper_doi               10.1039/c1ce06328f
_journal_volume                  14
_journal_year                    2012
_chemical_formula_moiety         'C20 H20 B2 Cu3 F8 N8, B F4'
_chemical_formula_sum            'C20 H20 B3 Cu3 F12 N8'
_chemical_formula_weight         823.49
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_cell_angle_alpha                90.00
_cell_angle_beta                 132.5660(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   20.8286(7)
_cell_length_b                   12.9965(5)
_cell_length_c                   15.3593(5)
_cell_measurement_reflns_used    16008
_cell_measurement_temperature    120(2)
_cell_measurement_theta_max      27.515
_cell_measurement_theta_min      3.135
_cell_volume                     3062.17(19)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      120(2)
_diffrn_detector_area_resol_mean 7.31
_diffrn_measured_fraction_theta_full 0.989
_diffrn_measured_fraction_theta_max 0.989
_diffrn_measurement_device_type  'Rigaku Mercury'
_diffrn_measurement_method       ω
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus rotating anode'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71070
_diffrn_reflns_av_R_equivalents  0.0310
_diffrn_reflns_av_sigmaI/netI    0.0242
_diffrn_reflns_limit_h_max       26
_diffrn_reflns_limit_h_min       -26
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            17589
_diffrn_reflns_theta_full        27.48
_diffrn_reflns_theta_max         27.48
_diffrn_reflns_theta_min         3.13
_exptl_absorpt_coefficient_mu    2.165
_exptl_absorpt_correction_T_max  0.897
_exptl_absorpt_correction_T_min  0.771
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Jacobson, R. (1998) Private communication'
_exptl_crystal_colour            orange
_exptl_crystal_density_diffrn    1.786
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Chip
_exptl_crystal_F_000             1624
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.05
_refine_diff_density_max         0.436
_refine_diff_density_min         -0.351
_refine_diff_density_rms         0.072
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.057
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     246
_refine_ls_number_reflns         3464
_refine_ls_number_restraints     36
_refine_ls_restrained_S_all      1.054
_refine_ls_R_factor_all          0.0418
_refine_ls_R_factor_gt           0.0326
_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)+(0.0296P)²+7.7916P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0719
_refine_ls_wR_factor_ref         0.0761
_reflns_number_gt                2955
_reflns_number_total             3464
_reflns_threshold_expression     >2σ(I)
_cod_data_source_file            c1ce06328f.txt
_cod_data_source_block
{[Cu3(bpm)2(C2H4)2](BF4)3}n_Complex-3-CCDC829825
_cod_original_sg_symbol_Hall     '-C 2yc '
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               7207239
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1 +X,+Y,+Z
2 -X,+Y,1/2-Z
3 -X,-Y,-Z
4 +X,-Y,1/2+Z
5 1/2+X,1/2+Y,+Z
6 1/2-X,1/2+Y,1/2-Z
7 1/2-X,1/2-Y,-Z
8 1/2+X,1/2-Y,1/2+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
Cu(1) Cu 0.646763(19) 0.79161(2) 0.65980(3) 0.02276(8) Uani 1.00 1 d .
Cu(2) Cu 0.5000 0.46377(3) 0.7500 0.02355(11) Uani 1.00 2 d S
F(1) F 0.54493(11) 0.15753(15) 0.73221(17) 0.0563(5) Uani 1.00 1 d .
F(2) F 0.55954(9) 0.03477(14) 0.84819(14) 0.0408(4) Uani 1.00 1 d .
F(3) F 0.8038(4) 0.8285(4) 0.8004(6) 0.0347(10) Uani 0.74 1 d P
F(4) F 0.8650(3) 0.8697(6) 0.9886(5) 0.0444(11) Uani 0.74 1 d P
F(5) F 0.94453(19) 0.8774(4) 0.9398(3) 0.0651(13) Uani 0.74 1 d P
F(6) F 0.8374(3) 0.9947(2) 0.8625(4) 0.0504(10) Uani 0.74 1 d P
F(7) F 0.8859(10) 0.9822(9) 0.9069(12) 0.059(2) Uani 0.26 1 d P
F(8) F 0.8291(10) 0.8743(15) 0.9537(16) 0.048(3) Uani 0.26 1 d P
F(9) F 0.7946(16) 0.8576(15) 0.788(2) 0.065(6) Uani 0.26 1 d P
F(10) F 0.9299(7) 0.8163(11) 0.9498(9) 0.071(3) Uani 0.26 1 d P
N(1) N 0.66355(13) 0.67806(15) 0.76203(18) 0.0237(4) Uani 1.00 1 d .
N(2) N 0.59933(12) 0.54265(15) 0.78424(17) 0.0210(4) Uani 1.00 1 d .
N(3) N 0.59977(12) 0.39514(15) 0.90220(17) 0.0204(4) Uani 1.00 1 d .
N(4) N 0.66600(12) 0.28424(14) 1.06559(17) 0.0209(4) Uani 1.00 1 d .
C(1) C 0.74205(16) 0.6515(2) 0.8654(2) 0.0282(5) Uani 1.00 1 d .
C(2) C 0.59533(15) 0.62137(18) 0.7252(2) 0.0236(4) Uani 1.00 1 d .
C(3) C 0.75255(16) 0.56955(19) 0.9306(2) 0.0271(5) Uani 1.00 1 d .
C(4) C 0.67875(14) 0.51599(17) 0.8877(2) 0.0200(4) Uani 1.00 1 d .
C(5) C 0.67938(14) 0.42977(17) 0.9511(2) 0.0197(4) Uani 1.00 1 d .
C(6) C 0.75450(15) 0.38810(18) 1.0551(2) 0.0235(4) Uani 1.00 1 d .
C(7) C 0.74504(15) 0.31520(18) 1.1109(2) 0.0236(4) Uani 1.00 1 d .
C(8) C 0.59669(15) 0.32375(18) 0.9612(2) 0.0215(4) Uani 1.00 1 d .
C(9) C 0.6003(2) 0.9155(2) 0.6811(3) 0.0544(9) Uani 1.00 1 d .
C(10) C 0.6040(2) 0.9353(2) 0.5969(3) 0.0522(9) Uani 1.00 1 d .
B(1) B 0.5000 0.0987(3) 0.7500 0.0277(8) Uani 1.00 2 d S
B(2) B 0.8628(2) 0.8918(2) 0.8989(2) 0.0318(6) Uani 1.00 1 d .
H(1) H 0.7907 0.6897 0.8937 0.034 Uiso 1.00 1 c R
H(2) H 0.5409 0.6383 0.6529 0.028 Uiso 1.00 1 c R
H(3) H 0.8074 0.5507 1.0012 0.033 Uiso 1.00 1 c R
H(4) H 0.8093 0.4085 1.0862 0.028 Uiso 1.00 1 c R
H(5) H 0.7946 0.2867 1.1816 0.028 Uiso 1.00 1 c R
H(6) H 0.5420 0.2994 0.9272 0.026 Uiso 1.00 1 c R
H(7) H 0.5426 0.9091 0.6536 0.065 Uiso 1.00 1 c R
H(8) H 0.6413 0.9525 0.7552 0.065 Uiso 1.00 1 c R
H(9) H 0.6473 0.9849 0.6177 0.063 Uiso 1.00 1 c R
H(10) H 0.5487 0.9415 0.5161 0.063 Uiso 1.00 1 c 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'
B B 0.0013 0.0007 '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'
F F 0.0171 0.0103 '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'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_publ_flag
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
N(1) Cu(1) N(4) 100.91(10) yes . 4_564
N(1) Cu(1) C(9) 108.02(18) yes . .
N(1) Cu(1) C(10) 147.6(2) yes . .
N(4) Cu(1) C(9) 149.65(15) yes 4_564 .
N(4) Cu(1) C(10) 110.49(18) yes 4_564 .
C(9) Cu(1) C(10) 39.8(2) yes . .
N(2) Cu(2) N(2) 119.46(8) yes . 2_656
N(2) Cu(2) N(3) 81.47(9) yes . .
N(2) Cu(2) N(3) 126.69(11) yes . 2_656
N(2) Cu(2) N(3) 126.69(11) yes 2_656 .
N(2) Cu(2) N(3) 81.47(9) yes 2_656 2_656
N(3) Cu(2) N(3) 127.08(7) yes . 2_656
F(9) F(3) B(2) 76(3) yes . .
F(8) F(4) B(2) 84(3) yes . .
F(7) F(5) F(10) 120.7(13) yes . .
F(7) F(5) B(2) 47.2(6) yes . .
F(10) F(5) B(2) 74.9(10) yes . .
F(7) F(6) B(2) 61.8(10) yes . .
F(5) F(7) F(6) 134.7(12) yes . .
F(5) F(7) B(2) 54.0(5) yes . .
F(6) F(7) B(2) 85.6(13) yes . .
F(4) F(8) B(2) 73(3) yes . .
F(3) F(9) B(2) 87(3) yes . .
F(5) F(10) B(2) 67.7(9) yes . .
Cu(1) N(1) C(1) 122.9(2) yes . .
Cu(1) N(1) C(2) 120.07(14) yes . .
C(1) N(1) C(2) 117.0(2) yes . .
Cu(2) N(2) C(2) 128.83(14) yes . .
Cu(2) N(2) C(4) 113.4(2) yes . .
C(2) N(2) C(4) 117.4(2) yes . .
Cu(2) N(3) C(5) 114.47(18) yes . .
Cu(2) N(3) C(8) 128.09(17) yes . .
C(5) N(3) C(8) 117.40(17) yes . .
Cu(1) N(4) C(7) 123.18(16) yes 4_565 .
Cu(1) N(4) C(8) 118.3(2) yes 4_565 .
C(7) N(4) C(8) 117.2(2) yes . .
N(1) C(1) C(3) 121.8(2) yes . .
N(1) C(1) H(1) 119.1 yes . .
C(3) C(1) H(1) 119.1 yes . .
N(1) C(2) N(2) 125.12(17) yes . .
N(1) C(2) H(2) 117.4 yes . .
N(2) C(2) H(2) 117.4 yes . .
C(1) C(3) C(4) 117.72(19) yes . .
C(1) C(3) H(3) 121.1 yes . .
C(4) C(3) H(3) 121.1 yes . .
N(2) C(4) C(3) 120.9(2) yes . .
N(2) C(4) C(5) 115.3(2) yes . .
C(3) C(4) C(5) 123.76(17) yes . .
N(3) C(5) C(4) 115.15(17) yes . .
N(3) C(5) C(6) 121.0(2) yes . .
C(4) C(5) C(6) 123.8(2) yes . .
C(5) C(6) C(7) 117.5(2) yes . .
C(5) C(6) H(4) 121.3 yes . .
C(7) C(6) H(4) 121.2 yes . .
N(4) C(7) C(6) 121.62(18) yes . .
N(4) C(7) H(5) 119.2 yes . .
C(6) C(7) H(5) 119.2 yes . .
N(3) C(8) N(4) 125.1(2) yes . .
N(3) C(8) H(6) 117.4 yes . .
N(4) C(8) H(6) 117.4 yes . .
Cu(1) C(9) C(10) 70.0(2) yes . .
Cu(1) C(9) H(7) 116.6 yes . .
Cu(1) C(9) H(8) 116.6 yes . .
C(10) C(9) H(7) 116.6 yes . .
C(10) C(9) H(8) 116.7 yes . .
H(7) C(9) H(8) 113.6 yes . .
Cu(1) C(10) C(9) 70.3(2) yes . .
Cu(1) C(10) H(9) 116.6 yes . .
Cu(1) C(10) H(10) 116.6 yes . .
C(9) C(10) H(9) 116.6 yes . .
C(9) C(10) H(10) 116.6 yes . .
H(9) C(10) H(10) 113.6 yes . .
F(1) B(1) F(1) 112.2(3) yes . 2_656
F(1) B(1) F(2) 108.53(10) yes . .
F(1) B(1) F(2) 109.98(13) yes . 2_656
F(1) B(1) F(2) 109.98(13) yes 2_656 .
F(1) B(1) F(2) 108.53(10) yes 2_656 2_656
F(2) B(1) F(2) 107.5(2) yes . 2_656
F(3) B(2) F(4) 111.7(6) yes . .
F(3) B(2) F(5) 108.9(5) yes . .
F(3) B(2) F(6) 108.0(3) yes . .
F(3) B(2) F(7) 131.3(8) yes . .
F(3) B(2) F(8) 97.0(8) yes . .
F(3) B(2) F(9) 17.0(8) yes . .
F(3) B(2) F(10) 90.4(5) yes . .
F(4) B(2) F(5) 108.8(3) yes . .
F(4) B(2) F(6) 110.3(5) yes . .
F(4) B(2) F(7) 110.5(10) yes . .
F(4) B(2) F(8) 22.7(5) yes . .
F(4) B(2) F(9) 119.4(18) yes . .
F(4) B(2) F(10) 87.2(8) yes . .
F(5) B(2) F(6) 109.0(4) yes . .
F(5) B(2) F(7) 78.8(9) yes . .
F(5) B(2) F(8) 131.2(6) yes . .
F(5) B(2) F(9) 116.6(18) yes . .
F(5) B(2) F(10) 37.4(7) yes . .
F(6) B(2) F(7) 32.6(7) yes . .
F(6) B(2) F(8) 100.6(9) yes . .
F(6) B(2) F(9) 91.0(8) yes . .
F(6) B(2) F(10) 146.4(7) yes . .
F(7) B(2) F(8) 113.8(14) yes . .
F(7) B(2) F(9) 115.9(12) yes . .
F(7) B(2) F(10) 115.0(10) yes . .
F(8) B(2) F(9) 100.3(19) yes . .
F(8) B(2) F(10) 104.8(10) yes . .
F(9) B(2) F(10) 105.4(12) yes . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_publ_flag
_geom_bond_site_symmetry_2
Cu(1) N(1) 2.006(2) yes .
Cu(1) N(4) 2.003(3) yes 4_564
Cu(2) N(2) 2.034(2) yes .
Cu(2) N(2) 2.034(2) yes 2_656
Cu(2) N(3) 2.0017(16) yes .
Cu(2) N(3) 2.0017(16) yes 2_656
F(3) F(9) 0.41(2) yes .
F(3) B(2) 1.400(6) yes .
F(4) F(8) 0.555(15) yes .
F(4) B(2) 1.377(10) yes .
F(5) F(7) 1.663(16) yes .
F(5) F(10) 0.901(17) yes .
F(5) B(2) 1.372(5) yes .
F(6) F(7) 0.761(16) yes .
F(6) B(2) 1.407(4) yes .
F(7) B(2) 1.244(14) yes .
F(8) B(2) 1.43(3) yes .
F(9) B(2) 1.36(2) yes .
F(10) B(2) 1.433(14) yes .
N(1) C(1) 1.342(2) yes .
C(1) H(1) 0.930 yes .
C(2) H(2) 0.930 yes .
C(3) C(4) 1.382(4) yes .
C(3) H(3) 0.930 yes .
C(4) C(5) 1.479(4) yes .
C(5) C(6) 1.383(2) yes .
C(6) C(7) 1.378(4) yes .
C(6) H(4) 0.930 yes .
C(7) H(5) 0.930 yes .
C(8) H(6) 0.930 yes .
C(9) C(10) 1.370(9) yes .
C(9) H(7) 0.970 yes .
C(9) H(8) 0.970 yes .
C(10) H(9) 0.970 yes .
C(10) H(10) 0.970 yes .
loop_
_geom_contact_atom_site_label_1
_geom_contact_atom_site_label_2
_geom_contact_distance
_geom_contact_site_symmetry_2
Cu(1) F(3) 2.457(7) .
Cu(1) F(8) 3.573(15) .
Cu(1) F(9) 2.43(2) .
Cu(1) C(2) 2.917(3) .
Cu(1) C(7) 2.960(3) 4_564
Cu(1) C(8) 2.887(3) 4_564
Cu(1) C(9) 2.017(4) .
Cu(1) C(10) 2.013(2) .
Cu(1) H(2) 2.919 .
Cu(1) H(5) 3.038 4_564
Cu(1) H(6) 2.894 4_564
Cu(1) H(7) 2.601 .
Cu(1) H(8) 2.601 .
Cu(1) H(9) 2.596 .
Cu(1) H(10) 2.596 .
Cu(2) C(2) 3.050(3) .
Cu(2) C(2) 3.050(3) 2_656
Cu(2) C(4) 2.854(2) .
Cu(2) C(4) 2.854(2) 2_656
Cu(2) C(5) 2.8429(18) .
Cu(2) C(5) 2.8429(18) 2_656
Cu(2) C(8) 3.009(2) .
Cu(2) C(8) 3.009(2) 2_656
Cu(2) H(2) 3.134 .
Cu(2) H(2) 3.134 2_656
Cu(2) H(6) 3.085 .
Cu(2) H(6) 3.085 2_656
F(1) F(1) 2.277(4) 2_656
F(1) F(2) 2.274(2) 2_656
F(1) C(6) 3.164(2) 7_657
F(1) C(7) 3.287(3) 7_657
F(1) C(8) 3.215(2) 2_656
F(1) B(1) 1.371(3) .
F(1) H(4) 2.505 7_657
F(1) H(5) 2.732 7_657
F(1) H(6) 3.552 .
F(1) H(6) 2.584 2_656
F(1) H(7) 3.437 1_545
F(1) H(8) 3.208 1_545
F(1) H(10) 3.153 3_666
F(2) F(1) 2.274(2) 2_656
F(2) F(2) 2.2646(18) 2_656
F(2) C(3) 3.273(2) 7_657
F(2) C(6) 3.229(3) 7_657
F(2) C(9) 3.557(6) 1_545
F(2) C(9) 3.415(6) 2_646
F(2) C(10) 3.289(6) 4_565
F(2) B(1) 1.404(2) .
F(2) H(3) 2.365 7_657
F(2) H(4) 2.301 7_657
F(2) H(7) 3.210 1_545
F(2) H(7) 2.668 2_646
F(2) H(8) 3.060 1_545
F(2) H(8) 3.489 2_646
F(2) H(9) 3.210 4_565
F(2) H(10) 2.754 4_565
F(3) Cu(1) 2.457(7) .
F(3) F(4) 2.299(12) .
F(3) F(5) 2.256(7) .
F(3) F(6) 2.272(7) .
F(3) F(7) 2.410(13) .
F(3) F(8) 2.12(2) .
F(3) F(10) 2.010(11) .
F(3) N(1) 3.221(10) .
F(3) N(4) 3.064(6) 4_564
F(3) C(1) 3.111(10) .
F(3) C(7) 2.939(8) 4_564
F(3) C(9) 3.478(10) .
F(3) C(10) 3.379(7) .
F(3) H(1) 2.432 .
F(3) H(5) 2.266 4_564
F(3) H(8) 3.371 .
F(3) H(9) 3.203 .
F(4) F(3) 2.299(12) .
F(4) F(5) 2.235(10) .
F(4) F(6) 2.284(9) .
F(4) F(7) 2.15(2) .
F(4) F(9) 2.36(3) .
F(4) F(10) 1.94(2) .
F(4) N(2) 3.243(9) 7_667
F(4) N(3) 3.321(8) 7_667
F(4) C(1) 3.409(7) .
F(4) C(2) 3.556(5) 8_565
F(4) C(3) 3.503(10) 7_667
F(4) C(4) 2.999(9) 7_667
F(4) C(5) 3.109(8) 7_667
F(4) H(1) 2.634 .
F(4) H(2) 2.701 8_565
F(5) F(3) 2.256(7) .
F(5) F(4) 2.235(10) .
F(5) F(6) 2.264(6) .
F(5) F(7) 3.178(15) 3_777
F(5) F(8) 2.55(2) .
F(5) F(9) 2.33(2) .
F(5) C(2) 3.234(4) 8_565
F(5) C(8) 3.038(6) 5_555
F(5) H(2) 2.428 8_565
F(5) H(6) 2.392 5_555
F(6) F(3) 2.272(7) .
F(6) F(4) 2.284(9) .
F(6) F(5) 2.264(6) .
F(6) F(8) 2.18(2) .
F(6) F(9) 1.98(2) .
F(6) F(10) 2.719(14) .
F(6) N(1) 3.047(6) 6_656
F(6) N(2) 3.349(9) 6_656
F(6) N(3) 3.230(6) 7_667
F(6) N(4) 3.097(4) 7_667
F(6) C(1) 3.363(5) 6_656
F(6) C(2) 3.006(8) 6_656
F(6) C(5) 3.263(8) 7_667
F(6) C(6) 3.298(8) 7_667
F(6) C(7) 3.190(6) 7_667
F(6) C(8) 3.124(5) 7_667
F(6) H(2) 3.281 6_656
F(6) H(6) 3.596 7_667
F(6) H(8) 3.257 .
F(6) H(9) 3.113 .
F(7) F(3) 2.410(13) .
F(7) F(4) 2.15(2) .
F(7) F(5) 3.178(15) 3_777
F(7) F(7) 3.55(2) 3_777
F(7) F(8) 2.24(3) .
F(7) F(9) 2.21(2) .
F(7) F(10) 2.260(19) .
F(7) N(1) 3.265(15) 6_656
F(7) N(2) 3.25(2) 6_656
F(7) N(3) 3.17(2) 7_667
F(7) N(4) 3.344(15) 7_667
F(7) C(2) 2.94(2) 6_656
F(7) C(5) 3.45(2) 7_667
F(7) C(8) 3.099(16) 7_667
F(7) H(2) 3.030 6_656
F(7) H(2) 3.263 8_565
F(7) H(6) 3.410 7_667
F(8) Cu(1) 3.573(15) .
F(8) F(3) 2.12(2) .
F(8) F(5) 2.55(2) .
F(8) F(6) 2.18(2) .
F(8) F(7) 2.24(3) .
F(8) F(9) 2.14(4) .
F(8) F(10) 2.27(3) .
F(8) N(2) 3.39(2) 7_667
F(8) N(3) 3.41(2) 7_667
F(8) C(1) 3.191(19) .
F(8) C(3) 3.27(2) 7_667
F(8) C(4) 2.92(2) 7_667
F(8) C(5) 3.00(2) 7_667
F(8) C(6) 3.50(2) 7_667
F(8) H(1) 2.500 .
F(8) H(2) 3.254 8_565
F(8) H(3) 3.491 7_667
F(8) H(8) 3.082 .
F(9) Cu(1) 2.43(2) .
F(9) F(4) 2.36(3) .
F(9) F(5) 2.33(2) .
F(9) F(6) 1.98(2) .
F(9) F(7) 2.21(2) .
F(9) F(8) 2.14(4) .
F(9) F(10) 2.22(2) .
F(9) N(1) 3.41(3) .
F(9) N(4) 3.14(2) 4_564
F(9) C(1) 3.40(3) .
F(9) C(7) 3.11(2) 4_564
F(9) C(9) 3.27(3) .
F(9) C(10) 3.10(2) .
F(9) H(1) 2.759 .
F(9) H(5) 2.483 4_564
F(9) H(8) 3.134 .
F(9) H(9) 2.851 .
F(10) F(3) 2.010(11) .
F(10) F(4) 1.94(2) .
F(10) F(6) 2.719(14) .
F(10) F(7) 2.260(19) .
F(10) F(8) 2.27(3) .
F(10) F(9) 2.22(2) .
F(10) C(2) 3.272(9) 8_565
F(10) C(8) 3.359(18) 5_555
F(10) H(1) 2.912 .
F(10) H(2) 2.380 8_565
F(10) H(5) 3.317 4_564
F(10) H(6) 2.592 5_555
N(1) F(3) 3.221(10) .
N(1) F(6) 3.047(6) 6_646
N(1) F(7) 3.265(15) 6_646
N(1) F(9) 3.41(3) .
N(1) C(2) 1.340(3) .
N(1) C(3) 2.374(3) .
N(1) C(4) 2.727(3) .
N(1) C(9) 3.255(3) .
N(1) H(2) 1.951 .
N(1) H(3) 3.212 .
N(1) H(7) 3.529 .
N(1) H(8) 3.589 .
N(2) F(4) 3.243(9) 7_667
N(2) F(6) 3.349(9) 6_646
N(2) F(7) 3.25(2) 6_646
N(2) F(8) 3.39(2) 7_667
N(2) C(2) 1.331(3) .
N(2) C(3) 2.378(2) .
N(2) C(4) 1.351(2) .
N(2) C(5) 2.391(3) .
N(2) H(2) 1.944 .
N(2) H(3) 3.219 .
N(3) F(4) 3.321(8) 7_667
N(3) F(6) 3.230(6) 7_667
N(3) F(7) 3.17(2) 7_667
N(3) F(8) 3.41(2) 7_667
N(3) C(4) 2.391(4) .
N(3) C(5) 1.353(3) .
N(3) C(6) 2.381(2) .
N(3) C(7) 2.718(2) .
N(3) C(8) 1.329(4) .
N(3) H(4) 3.222 .
N(3) H(6) 1.941 .
N(4) F(3) 3.064(6) 4_565
N(4) F(6) 3.097(4) 7_667
N(4) F(7) 3.344(15) 7_667
N(4) F(9) 3.14(2) 4_565
N(4) C(5) 2.722(4) .
N(4) C(6) 2.377(4) .
N(4) C(7) 1.344(3) .
N(4) C(8) 1.337(2) .
N(4) C(10) 3.299(4) 4_565
N(4) H(4) 3.216 .
N(4) H(5) 1.973 .
N(4) H(6) 1.949 .
N(4) H(10) 3.555 4_565
C(1) F(3) 3.111(10) .
C(1) F(4) 3.409(7) .
C(1) F(6) 3.363(5) 6_646
C(1) F(8) 3.191(19) .
C(1) F(9) 3.40(3) .
C(1) C(2) 2.286(3) .
C(1) C(3) 1.375(4) .
C(1) C(4) 2.360(4) .
C(1) H(2) 3.120 .
C(1) H(3) 2.019 .
C(1) H(9) 3.043 6_646
C(2) Cu(1) 2.917(3) .
C(2) Cu(2) 3.050(3) .
C(2) F(4) 3.556(5) 8_464
C(2) F(5) 3.234(4) 8_464
C(2) F(6) 3.006(8) 6_646
C(2) F(7) 2.94(2) 6_646
C(2) F(10) 3.272(10) 8_464
C(2) N(1) 1.340(3) .
C(2) N(2) 1.331(3) .
C(2) C(1) 2.286(3) .
C(2) C(3) 2.674(2) .
C(2) C(4) 2.292(3) .
C(2) H(1) 3.130 .
C(3) F(2) 3.273(2) 7_657
C(3) F(4) 3.503(10) 7_667
C(3) F(8) 3.27(2) 7_667
C(3) N(1) 2.374(3) .
C(3) N(2) 2.378(2) .
C(3) C(1) 1.375(4) .
C(3) C(2) 2.674(2) .
C(3) C(5) 2.524(4) .
C(3) C(6) 3.018(4) .
C(3) H(1) 2.000 .
C(3) H(4) 2.769 .
C(3) H(9) 2.865 6_646
C(4) Cu(2) 2.854(2) .
C(4) F(4) 2.999(9) 7_667
C(4) F(8) 2.92(2) 7_667
C(4) N(1) 2.727(3) .
C(4) N(2) 1.351(2) .
C(4) N(3) 2.391(4) .
C(4) C(1) 2.360(4) .
C(4) C(2) 2.292(3) .
C(4) C(6) 2.525(3) .
C(4) H(1) 3.201 .
C(4) H(2) 3.126 .
C(4) H(3) 2.026 .
C(4) H(4) 2.725 .
C(5) Cu(2) 2.8429(18) .
C(5) F(4) 3.109(8) 7_667
C(5) F(6) 3.263(8) 7_667
C(5) F(7) 3.45(2) 7_667
C(5) F(8) 3.00(2) 7_667
C(5) N(2) 2.391(3) .
C(5) N(3) 1.353(3) .
C(5) N(4) 2.722(4) .
C(5) C(3) 2.524(4) .
C(5) C(7) 2.360(3) .
C(5) C(8) 2.292(4) .
C(5) H(3) 2.720 .
C(5) H(4) 2.027 .
C(5) H(5) 3.202 .
C(5) H(6) 3.126 .
C(6) F(1) 3.164(2) 7_657
C(6) F(2) 3.229(3) 7_657
C(6) F(6) 3.298(8) 7_667
C(6) F(8) 3.50(2) 7_667
C(6) N(3) 2.381(2) .
C(6) N(4) 2.377(4) .
C(6) C(3) 3.018(4) .
C(6) C(4) 2.525(3) .
C(6) C(8) 2.678(4) .
C(6) H(3) 2.757 .
C(6) H(5) 2.004 .
C(6) H(8) 2.989 7_667
C(7) Cu(1) 2.960(3) 4_565
C(7) F(1) 3.287(3) 7_657
C(7) F(3) 2.939(8) 4_565
C(7) F(6) 3.190(6) 7_667
C(7) F(9) 3.11(2) 4_565
C(7) N(3) 2.718(2) .
C(7) N(4) 1.344(3) .
C(7) C(5) 2.360(3) .
C(7) C(8) 2.288(2) .
C(7) H(4) 2.023 .
C(7) H(6) 3.121 .
C(7) H(8) 3.516 7_667
C(8) Cu(1) 2.887(3) 4_565
C(8) Cu(2) 3.009(2) .
C(8) F(1) 3.215(2) 2_656
C(8) F(5) 3.038(6) 5_445
C(8) F(6) 3.124(5) 7_667
C(8) F(7) 3.099(16) 7_667
C(8) F(10) 3.359(18) 5_445
C(8) N(3) 1.329(4) .
C(8) N(4) 1.337(2) .
C(8) C(5) 2.292(4) .
C(8) C(6) 2.678(4) .
C(8) C(7) 2.288(2) .
C(8) H(5) 3.131 .
C(9) Cu(1) 2.017(4) .
C(9) F(2) 3.557(6) 1_565
C(9) F(2) 3.415(6) 2_666
C(9) F(3) 3.478(10) .
C(9) F(9) 3.27(3) .
C(9) N(1) 3.255(3) .
C(9) H(4) 3.528 7_667
C(9) H(9) 2.002 .
C(9) H(10) 2.002 .
C(9) H(10) 3.089 3_676
C(10) Cu(1) 2.013(2) .
C(10) F(2) 3.289(6) 4_564
C(10) F(3) 3.379(7) .
C(10) F(9) 3.10(2) .
C(10) N(4) 3.299(4) 4_564
C(10) H(3) 3.419 6_656
C(10) H(7) 2.003 .
C(10) H(7) 3.511 3_676
C(10) H(8) 2.003 .
C(10) H(10) 2.868 3_676
B(1) F(1) 1.371(3) .
B(1) F(1) 1.371(3) 2_656
B(1) F(2) 1.404(2) .
B(1) F(2) 1.404(2) 2_656
B(1) H(4) 2.931 7_657
B(1) H(4) 2.931 8_454
B(1) H(6) 3.428 .
B(1) H(6) 3.428 2_656
B(1) H(7) 3.292 1_545
B(1) H(7) 3.292 2_646
B(1) H(8) 3.457 1_545
B(1) H(8) 3.457 2_646
B(1) H(10) 3.520 3_666
B(1) H(10) 3.520 4_565
B(2) H(1) 2.999 .
B(2) H(2) 3.091 8_565
B(2) H(5) 3.482 4_564
H(1) F(3) 2.432 .
H(1) F(4) 2.634 .
H(1) F(8) 2.500 .
H(1) F(9) 2.759 .
H(1) F(10) 2.912 .
H(1) C(2) 3.130 .
H(1) C(3) 2.000 .
H(1) C(4) 3.201 .
H(1) B(2) 2.999 .
H(1) H(3) 2.308 .
H(1) H(5) 3.328 4_564
H(1) H(9) 3.015 6_646
H(2) Cu(1) 2.919 .
H(2) Cu(2) 3.134 .
H(2) F(4) 2.701 8_464
H(2) F(5) 2.428 8_464
H(2) F(6) 3.281 6_646
H(2) F(7) 3.030 6_646
H(2) F(7) 3.263 8_464
H(2) F(8) 3.254 8_464
H(2) F(10) 2.380 8_464
H(2) N(1) 1.951 .
H(2) N(2) 1.944 .
H(2) C(1) 3.120 .
H(2) C(4) 3.126 .
H(2) B(2) 3.091 8_464
H(2) H(6) 3.574 4_564
H(2) H(7) 3.518 .
H(3) F(2) 2.365 7_657
H(3) F(8) 3.491 7_667
H(3) N(1) 3.212 .
H(3) N(2) 3.219 .
H(3) C(1) 2.019 .
H(3) C(4) 2.026 .
H(3) C(5) 2.720 .
H(3) C(6) 2.757 .
H(3) C(10) 3.419 6_646
H(3) H(1) 2.308 .
H(3) H(4) 2.248 .
H(3) H(8) 3.119 7_667
H(3) H(9) 2.699 6_646
H(3) H(10) 3.485 6_646
H(4) F(1) 2.505 7_657
H(4) F(2) 2.301 7_657
H(4) N(3) 3.222 .
H(4) N(4) 3.216 .
H(4) C(3) 2.769 .
H(4) C(4) 2.725 .
H(4) C(5) 2.027 .
H(4) C(7) 2.023 .
H(4) C(9) 3.528 7_667
H(4) B(1) 2.931 7_657
H(4) H(3) 2.248 .
H(4) H(5) 2.314 .
H(4) H(8) 2.620 7_667
H(5) Cu(1) 3.038 4_565
H(5) F(1) 2.732 7_657
H(5) F(3) 2.266 4_565
H(5) F(9) 2.483 4_565
H(5) F(10) 3.317 4_565
H(5) N(4) 1.973 .
H(5) C(5) 3.202 .
H(5) C(6) 2.004 .
H(5) C(8) 3.131 .
H(5) B(2) 3.482 4_565
H(5) H(1) 3.328 4_565
H(5) H(4) 2.314 .
H(5) H(8) 3.530 7_667
H(6) Cu(1) 2.894 4_565
H(6) Cu(2) 3.085 .
H(6) F(1) 3.552 .
H(6) F(1) 2.584 2_656
H(6) F(5) 2.392 5_445
H(6) F(6) 3.596 7_667
H(6) F(7) 3.410 7_667
H(6) F(10) 2.592 5_445
H(6) N(3) 1.941 .
H(6) N(4) 1.949 .
H(6) C(5) 3.126 .
H(6) C(7) 3.121 .
H(6) B(1) 3.428 .
H(6) H(2) 3.574 4_565
H(6) H(10) 3.379 4_565
H(7) Cu(1) 2.601 .
H(7) F(1) 3.437 1_565
H(7) F(2) 3.210 1_565
H(7) F(2) 2.668 2_666
H(7) N(1) 3.529 .
H(7) C(10) 2.003 .
H(7) C(10) 3.511 3_676
H(7) B(1) 3.292 1_565
H(7) H(2) 3.518 .
H(7) H(8) 1.624 .
H(7) H(9) 2.766 .
H(7) H(9) 3.551 3_676
H(7) H(10) 2.240 .
H(7) H(10) 2.734 3_676
H(8) Cu(1) 2.601 .
H(8) F(1) 3.208 1_565
H(8) F(2) 3.060 1_565
H(8) F(2) 3.489 2_666
H(8) F(3) 3.371 .
H(8) F(6) 3.257 .
H(8) F(8) 3.082 .
H(8) F(9) 3.134 .
H(8) N(1) 3.589 .
H(8) C(6) 2.989 7_667
H(8) C(7) 3.516 7_667
H(8) C(10) 2.003 .
H(8) B(1) 3.457 1_565
H(8) H(3) 3.119 7_667
H(8) H(4) 2.620 7_667
H(8) H(5) 3.530 7_667
H(8) H(7) 1.624 .
H(8) H(9) 2.240 .
H(8) H(10) 2.766 .
H(8) H(10) 3.551 3_676
H(9) Cu(1) 2.596 .
H(9) F(2) 3.210 4_564
H(9) F(3) 3.203 .
H(9) F(6) 3.113 .
H(9) F(9) 2.851 .
H(9) C(1) 3.043 6_656
H(9) C(3) 2.865 6_656
H(9) C(9) 2.002 .
H(9) H(1) 3.015 6_656
H(9) H(3) 2.699 6_656
H(9) H(7) 2.766 .
H(9) H(7) 3.551 3_676
H(9) H(8) 2.240 .
H(9) H(10) 1.623 .
H(9) H(10) 3.233 3_676
H(10) Cu(1) 2.596 .
H(10) F(1) 3.153 3_666
H(10) F(2) 2.754 4_564
H(10) N(4) 3.555 4_564
H(10) C(9) 2.002 .
H(10) C(9) 3.089 3_676
H(10) C(10) 2.868 3_676
H(10) B(1) 3.520 3_666
H(10) H(3) 3.485 6_656
H(10) H(6) 3.379 4_564
H(10) H(7) 2.240 .
H(10) H(7) 2.734 3_676
H(10) H(8) 2.766 .
H(10) H(8) 3.551 3_676
H(10) H(9) 1.623 .
H(10) H(9) 3.233 3_676
H(10) H(10) 2.306 3_676
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_3
_geom_torsion_site_symmetry_4
N(1) Cu(1) N(4) C(7) -73.5(2) . 4_564 4_564
N(1) Cu(1) N(4) C(8) 92.75(19) . 4_564 4_564
N(4) Cu(1) N(1) C(1) 86.3(2) 4_564 . .
N(4) Cu(1) N(1) C(2) -90.2(2) 4_564 . .
N(1) Cu(1) C(9) C(10) -176.02(19) . . .
N(1) Cu(1) C(9) H(7) -65.5 . . .
N(1) Cu(1) C(9) H(8) 73.4 . . .
C(9) Cu(1) N(1) C(1) -103.0(2) . . .
C(9) Cu(1) N(1) C(2) 80.5(2) . . .
N(1) Cu(1) C(10) C(9) 7.1(3) . . .
N(1) Cu(1) C(10) H(9) 117.7 . . .
N(1) Cu(1) C(10) H(10) -103.6 . . .
C(10) Cu(1) N(1) C(1) -107.7(3) . . .
C(10) Cu(1) N(1) C(2) 75.8(3) . . .
N(4) Cu(1) C(9) C(10) -14.3(3) 4_564 . .
N(4) Cu(1) C(9) H(7) 96.3 4_564 . .
N(4) Cu(1) C(9) H(8) -124.8 4_564 . .
C(9) Cu(1) N(4) C(7) 124.1(3) . 4_564 4_564
C(9) Cu(1) N(4) C(8) -69.6(3) . 4_564 4_564
N(4) Cu(1) C(10) C(9) 172.35(19) 4_564 . .
N(4) Cu(1) C(10) H(9) -77.0 4_564 . .
N(4) Cu(1) C(10) H(10) 61.7 4_564 . .
C(10) Cu(1) N(4) C(7) 114.4(2) . 4_564 4_564
C(10) Cu(1) N(4) C(8) -79.3(2) . 4_564 4_564
C(9) Cu(1) C(10) H(9) 110.6 . . .
C(9) Cu(1) C(10) H(10) -110.6 . . .
C(10) Cu(1) C(9) H(7) 110.6 . . .
C(10) Cu(1) C(9) H(8) -110.5 . . .
N(2) Cu(2) N(2) C(2) -47.7(3) . 2_656 2_656
N(2) Cu(2) N(2) C(4) 125.2(2) . 2_656 2_656
N(2) Cu(2) N(2) C(2) -47.7(3) 2_656 . .
N(2) Cu(2) N(2) C(4) 125.2(2) 2_656 . .
N(2) Cu(2) N(3) C(5) -0.7(2) . . .
N(2) Cu(2) N(3) C(8) 176.9(2) . . .
N(3) Cu(2) N(2) C(2) -175.3(2) . . .
N(3) Cu(2) N(2) C(4) -2.4(2) . . .
N(2) Cu(2) N(3) C(5) -121.3(2) . 2_656 2_656
N(2) Cu(2) N(3) C(8) 56.3(2) . 2_656 2_656
N(3) Cu(2) N(2) C(2) 54.3(3) 2_656 . .
N(3) Cu(2) N(2) C(4) -132.8(2) 2_656 . .
N(2) Cu(2) N(3) C(5) -121.3(2) 2_656 . .
N(2) Cu(2) N(3) C(8) 56.3(2) 2_656 . .
N(3) Cu(2) N(2) C(2) 54.3(3) . 2_656 2_656
N(3) Cu(2) N(2) C(4) -132.8(2) . 2_656 2_656
N(2) Cu(2) N(3) C(5) -0.7(2) 2_656 2_656 2_656
N(2) Cu(2) N(3) C(8) 176.9(2) 2_656 2_656 2_656
N(3) Cu(2) N(2) C(2) -175.3(2) 2_656 2_656 2_656
N(3) Cu(2) N(2) C(4) -2.4(2) 2_656 2_656 2_656
N(3) Cu(2) N(3) C(5) 129.4(2) . 2_656 2_656
N(3) Cu(2) N(3) C(8) -53.1(3) . 2_656 2_656
N(3) Cu(2) N(3) C(5) 129.4(2) 2_656 . .
N(3) Cu(2) N(3) C(8) -53.1(3) 2_656 . .
F(9) F(3) B(2) F(4) 120(6) . . .
F(9) F(3) B(2) F(5) -120(6) . . .
F(9) F(3) B(2) F(6) -1(5) . . .
F(9) F(3) B(2) F(7) -28(7) . . .
F(9) F(3) B(2) F(8) 102(6) . . .
F(9) F(3) B(2) F(10) -153(6) . . .
F(8) F(4) B(2) F(3) -52(2) . . .
F(8) F(4) B(2) F(5) -172(2) . . .
F(8) F(4) B(2) F(6) 68(2) . . .
F(8) F(4) B(2) F(7) 103(2) . . .
F(8) F(4) B(2) F(9) -35(2) . . .
F(8) F(4) B(2) F(10) -141(2) . . .
F(7) F(5) F(10) B(2) 12.0(9) . . .
F(10) F(5) F(7) F(6) -47(3) . . .
F(10) F(5) F(7) B(2) -15.8(13) . . .
F(7) F(5) B(2) F(3) 130.0(10) . . .
F(7) F(5) B(2) F(4) -108.0(9) . . .
F(7) F(5) B(2) F(6) 12.3(9) . . .
F(7) F(5) B(2) F(8) -111.8(14) . . .
F(7) F(5) B(2) F(9) 113.5(15) . . .
F(7) F(5) B(2) F(10) -166.0(13) . . .
B(2) F(5) F(7) F(6) -32(2) . . .
F(10) F(5) B(2) F(3) -64.1(10) . . .
F(10) F(5) B(2) F(4) 58.0(10) . . .
F(10) F(5) B(2) F(6) 178.3(10) . . .
F(10) F(5) B(2) F(7) 166.0(13) . . .
F(10) F(5) B(2) F(8) 54.1(15) . . .
F(10) F(5) B(2) F(9) -80.5(15) . . .
F(7) F(6) B(2) F(3) -141(2) . . .
F(7) F(6) B(2) F(4) 97(2) . . .
F(7) F(6) B(2) F(5) -23(2) . . .
F(7) F(6) B(2) F(8) 118(2) . . .
F(7) F(6) B(2) F(9) -141(2) . . .
F(7) F(6) B(2) F(10) -21(2) . . .
B(2) F(6) F(7) F(5) 25(2) . . .
F(5) F(7) B(2) F(3) -105.4(11) . . .
F(5) F(7) B(2) F(4) 106.0(5) . . .
F(5) F(7) B(2) F(6) -158.0(19) . . .
F(5) F(7) B(2) F(8) 130.3(7) . . .
F(5) F(7) B(2) F(9) -114(2) . . .
F(5) F(7) B(2) F(10) 9.4(9) . . .
F(6) F(7) B(2) F(3) 53(2) . . .
F(6) F(7) B(2) F(4) -95.9(16) . . .
F(6) F(7) B(2) F(5) 158.0(19) . . .
F(6) F(7) B(2) F(8) -71.7(18) . . .
F(6) F(7) B(2) F(9) 44(2) . . .
F(6) F(7) B(2) F(10) 167.4(15) . . .
F(4) F(8) B(2) F(3) 132(2) . . .
F(4) F(8) B(2) F(5) 9(2) . . .
F(4) F(8) B(2) F(6) -118(2) . . .
F(4) F(8) B(2) F(7) -86(2) . . .
F(4) F(8) B(2) F(9) 149(2) . . .
F(4) F(8) B(2) F(10) 40(2) . . .
F(3) F(9) B(2) F(4) -67(6) . . .
F(3) F(9) B(2) F(5) 67(6) . . .
F(3) F(9) B(2) F(6) 179(4) . . .
F(3) F(9) B(2) F(7) 157(5) . . .
F(3) F(9) B(2) F(8) -80(6) . . .
F(3) F(9) B(2) F(10) 28(7) . . .
F(5) F(10) B(2) F(3) 121.7(9) . . .
F(5) F(10) B(2) F(4) -126.5(8) . . .
F(5) F(10) B(2) F(6) -3.0(17) . . .
F(5) F(10) B(2) F(7) -15.2(15) . . .
F(5) F(10) B(2) F(8) -140.9(10) . . .
F(5) F(10) B(2) F(9) 113.8(19) . . .
Cu(1) N(1) C(1) C(3) -176.1(2) . . .
Cu(1) N(1) C(1) H(1) 3.9 . . .
Cu(1) N(1) C(2) N(2) 178.1(2) . . .
Cu(1) N(1) C(2) H(2) -1.9 . . .
C(1) N(1) C(2) N(2) 1.4(5) . . .
C(1) N(1) C(2) H(2) -178.6 . . .
C(2) N(1) C(1) C(3) 0.5(5) . . .
C(2) N(1) C(1) H(1) -179.5 . . .
Cu(2) N(2) C(2) N(1) 170.7(2) . . .
Cu(2) N(2) C(2) H(2) -9.3 . . .
Cu(2) N(2) C(4) C(3) -173.1(2) . . .
Cu(2) N(2) C(4) C(5) 4.8(3) . . .
C(2) N(2) C(4) C(3) 0.7(4) . . .
C(2) N(2) C(4) C(5) 178.6(2) . . .
C(4) N(2) C(2) N(1) -2.0(5) . . .
C(4) N(2) C(2) H(2) 178.1 . . .
Cu(2) N(3) C(5) C(4) 3.4(3) . . .
Cu(2) N(3) C(5) C(6) -178.7(2) . . .
Cu(2) N(3) C(8) N(4) -176.8(2) . . .
Cu(2) N(3) C(8) H(6) 3.2 . . .
C(5) N(3) C(8) N(4) 0.7(4) . . .
C(5) N(3) C(8) H(6) -179.3 . . .
C(8) N(3) C(5) C(4) -174.4(2) . . .
C(8) N(3) C(5) C(6) 3.5(4) . . .
Cu(1) N(4) C(7) C(6) -163.5(2) 4_565 . .
Cu(1) N(4) C(7) H(5) 16.5 4_565 . .
Cu(1) N(4) C(8) N(3) 163.2(2) 4_565 . .
Cu(1) N(4) C(8) H(6) -16.8 4_565 . .
C(7) N(4) C(8) N(3) -3.9(4) . . .
C(7) N(4) C(8) H(6) 176.1 . . .
C(8) N(4) C(7) C(6) 2.9(4) . . .
C(8) N(4) C(7) H(5) -177.0 . . .
N(1) C(1) C(3) C(4) -1.6(5) . . .
N(1) C(1) C(3) H(3) 178.4 . . .
H(1) C(1) C(3) C(4) 178.4 . . .
H(1) C(1) C(3) H(3) -1.6 . . .
C(1) C(3) C(4) N(2) 1.0(5) . . .
C(1) C(3) C(4) C(5) -176.7(3) . . .
H(3) C(3) C(4) N(2) -179.0 . . .
H(3) C(3) C(4) C(5) 3.4 . . .
N(2) C(4) C(5) N(3) -5.5(4) . . .
N(2) C(4) C(5) C(6) 176.6(3) . . .
C(3) C(4) C(5) N(3) 172.3(3) . . .
C(3) C(4) C(5) C(6) -5.6(5) . . .
N(3) C(5) C(6) C(7) -4.3(4) . . .
N(3) C(5) C(6) H(4) 175.7 . . .
C(4) C(5) C(6) C(7) 173.5(2) . . .
C(4) C(5) C(6) H(4) -6.6 . . .
C(5) C(6) C(7) N(4) 1.0(4) . . .
C(5) C(6) C(7) H(5) -179.0 . . .
H(4) C(6) C(7) N(4) -179.0 . . .
H(4) C(6) C(7) H(5) 1.0 . . .
Cu(1) C(9) C(10) H(9) -110.6 . . .
Cu(1) C(9) C(10) H(10) 110.6 . . .
H(7) C(9) C(10) Cu(1) -110.5 . . .
H(7) C(9) C(10) H(9) 138.9 . . .
H(7) C(9) C(10) H(10) 0.1 . . .
H(8) C(9) C(10) Cu(1) 110.6 . . .
H(8) C(9) C(10) H(9) -0.0 . . .
H(8) C(9) C(10) H(10) -138.8 . . .
