#------------------------------------------------------------------------------
#$Date: 2019-11-15 10:40:50 +0100 (vie 15 de nov de 2019) $
#$Revision: 227875 $
#$URL: svn://www.crystallography.net/cod/cif/7/23/51/7235127.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_7235127
loop_
_publ_author_name
'N. A. Artiukhova'
'G. V. Romanenko'
'A. S. Bogomyakov'
'I. Yu. Barskaya'
'S. L. Veber'
'M. V. Fedin'
'K. Yu. Maryunina'
'K. Inoue'
'V. I. Ovcharenko'
_publ_section_title
;
 Cu(ii) complex with nitronyl nitroxide whose paramagnetism is suppressed
 by temperature decrease and/or pressure increase
;
_journal_name_full               'Journal of Materials Chemistry C'
_journal_page_first              11157
_journal_page_last               11163
_journal_paper_doi               10.1039/C6TC03216H
_journal_volume                  4
_journal_year                    2016
_chemical_formula_sum            'C26 H25 Cu F12 N4 O6'
_chemical_formula_weight         781.04
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_cell_angle_alpha                90
_cell_angle_beta                 111.173(19)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   13.113(6)
_cell_length_b                   15.597(7)
_cell_length_c                   16.766(8)
_cell_measurement_reflns_used    3605
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      22.70
_cell_measurement_theta_min      2.85
_cell_volume                     3198(3)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-2014/6 (Sheldrick, 2014)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.992
_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  0.0416
_diffrn_reflns_av_unetI/netI     0.0636
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.992
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            20570
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.992
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         28.334
_diffrn_reflns_theta_min         2.116
_exptl_absorpt_coefficient_mu    0.799
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            'dark green-blue'
_exptl_crystal_density_diffrn    1.622
_exptl_crystal_description       bulk
_exptl_crystal_F_000             1576
_exptl_crystal_preparation       'Magnetic properties'
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.12
_refine_diff_density_max         0.345
_refine_diff_density_min         -0.308
_refine_diff_density_rms         0.053
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.004
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     523
_refine_ls_number_reflns         7920
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.004
_refine_ls_R_factor_all          0.1081
_refine_ls_R_factor_gt           0.0495
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0639P)²+0.1810P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1164
_refine_ls_wR_factor_ref         0.1391
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                4391
_reflns_number_total             7920
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            J-Mater-Chem-C-2016-4-11157.cif
_cod_data_source_block           78
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               7235127
_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. 
;
_shelxl_version_number           2014/6
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -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 0.82084(3) 0.56369(2) 0.69580(2) 0.04671(14) Uani 1 1 d . . . . .
N4R N 0.7388(2) 0.44348(15) 0.72987(16) 0.0504(6) Uani 1 1 d . . . . .
N3R N 0.7191(2) 0.36414(14) 0.69443(15) 0.0476(6) Uani 1 1 d . . . . .
C1 C 0.6417(4) 0.5522(3) 0.4289(2) 0.0661(9) Uani 1 1 d . . . . .
F1 F 0.6613(15) 0.6172(8) 0.3878(6) 0.136(4) Uani 0.5 1 d . . P A 1
F2 F 0.5398(9) 0.5371(9) 0.3904(8) 0.114(5) Uani 0.5 1 d . . P A 1
F3 F 0.6924(14) 0.4873(12) 0.4152(7) 0.183(8) Uani 0.5 1 d . . P A 1
F1A F 0.7196(9) 0.5725(9) 0.4028(6) 0.100(3) Uani 0.5 1 d . . P A 2
F2A F 0.6390(11) 0.4693(5) 0.4223(7) 0.108(4) Uani 0.5 1 d . . P A 2
F3A F 0.5523(12) 0.5815(13) 0.3780(7) 0.167(8) Uani 0.5 1 d . . P A 2
C2 C 0.6697(3) 0.57504(18) 0.52362(19) 0.0472(7) Uani 1 1 d . . . . .
C3 C 0.5948(3) 0.6213(2) 0.5451(2) 0.0578(8) Uani 1 1 d . . . . .
H3A H 0.5287 0.6355 0.5024 0.069 Uiso 1 1 calc R U . . .
C4 C 0.6136(3) 0.64761(18) 0.6278(2) 0.0481(7) Uani 1 1 d . . . . .
C5 C 0.5272(4) 0.7020(3) 0.6455(3) 0.0651(9) Uani 1 1 d . . . . .
F4 F 0.5173(19) 0.6684(14) 0.7163(15) 0.111(7) Uani 0.5 1 d . . P B 1
F5 F 0.5658(17) 0.7880(14) 0.6614(12) 0.076(3) Uani 0.5 1 d . . P B 1
F6 F 0.438(2) 0.7002(17) 0.5863(18) 0.110(7) Uani 0.5 1 d . . P B 1
F5A F 0.5579(18) 0.7737(15) 0.6681(14) 0.106(7) Uani 0.5 1 d . . P B 2
F6A F 0.4296(16) 0.7124(14) 0.5763(16) 0.070(3) Uani 0.5 1 d . . P B 2
F4A F 0.4940(18) 0.6733(10) 0.7060(12) 0.071(3) Uani 0.5 1 d . . P B 2
O1 O 0.76135(18) 0.54851(12) 0.57171(13) 0.0514(5) Uani 1 1 d . . . . .
O2 O 0.69574(18) 0.63405(12) 0.69276(13) 0.0523(5) Uani 1 1 d . . . . .
O3 O 0.94766(18) 0.49546(12) 0.70023(13) 0.0509(5) Uani 1 1 d . . . . .
O4 O 0.88663(18) 0.59533(12) 0.81617(13) 0.0495(5) Uani 1 1 d . . . . .
C6 C 1.1157(4) 0.4256(3) 0.7545(3) 0.0754(11) Uani 1 1 d . . . . .
F8A F 1.1714(13) 0.4607(8) 0.7209(13) 0.124(4) Uani 0.5 1 d . . P C 1
F7A F 1.0678(7) 0.3595(7) 0.7111(9) 0.104(2) Uani 0.5 1 d . . P C 1
F9A F 1.1792(13) 0.3932(13) 0.8254(6) 0.138(5) Uani 0.5 1 d . . P C 1
F7 F 1.123(2) 0.3549(8) 0.791(2) 0.214(12) Uani 0.5 1 d . . P C 2
F8 F 1.1035(13) 0.4136(14) 0.6720(5) 0.150(5) Uani 0.5 1 d . . P C 2
F9 F 1.2153(8) 0.4589(11) 0.7805(16) 0.158(7) Uani 0.5 1 d . . P C 2
C7 C 1.0295(3) 0.48517(18) 0.7656(2) 0.0510(8) Uani 1 1 d . . . . .
C8 C 1.0527(3) 0.5204(2) 0.8466(2) 0.0642(9) Uani 1 1 d . . . . .
H8A H 1.1188 0.5075 0.8899 0.077 Uiso 1 1 calc R U . . .
C9 C 0.9802(3) 0.57395(19) 0.8640(2) 0.0522(8) Uani 1 1 d . . . . .
C10 C 1.0147(4) 0.6150(3) 0.9520(3) 0.0768(11) Uani 1 1 d . . . . .
F10 F 1.0302(3) 0.69772(16) 0.94565(17) 0.1220(10) Uani 1 1 d . . . . .
F11 F 1.1034(3) 0.5842(2) 1.00772(17) 0.1371(12) Uani 1 1 d . . . . .
F12 F 0.9371(3) 0.60807(18) 0.98500(15) 0.1156(9) Uani 1 1 d . . . . .
N1R N 0.5802(2) 0.25199(15) 0.86798(17) 0.0530(7) Uani 1 1 d . . . . .
O1R O 0.5747(2) 0.19069(13) 0.81472(15) 0.0645(6) Uani 1 1 d . . . . .
N2R N 0.6076(2) 0.37799(16) 0.92827(17) 0.0607(7) Uani 1 1 d . . . . .
O2R O 0.6374(2) 0.45549(15) 0.94420(17) 0.0863(9) Uani 1 1 d . . . . .
C5R C 0.7054(3) 0.44034(18) 0.79522(19) 0.0519(8) Uani 1 1 d . . . . .
H5RA H 0.7098 0.4861 0.8319 0.062 Uiso 1 1 calc R U . . .
C6R C 0.6728(2) 0.31316(18) 0.73583(19) 0.0490(7) Uani 1 1 d . . . . .
H6RA H 0.6515 0.2565 0.7222 0.059 Uiso 1 1 calc R U . . .
C7R C 0.6626(2) 0.35982(17) 0.80250(18) 0.0461(7) Uani 1 1 d . . . . .
C8R C 0.6183(2) 0.33031(18) 0.8645(2) 0.0496(7) Uani 1 1 d . . . . .
C16R C 0.5184(3) 0.2490(2) 0.9280(2) 0.0615(9) Uani 1 1 d . . . . .
C15R C 0.5743(3) 0.3230(2) 0.9878(2) 0.0668(10) Uani 1 1 d . . . . .
C13R C 0.5243(3) 0.1601(2) 0.9686(3) 0.0837(13) Uani 1 1 d . . . . .
H13A H 0.5751 0.1238 0.9542 0.100 Uiso 1 1 calc R U . . .
H13B H 0.5490 0.1650 1.0304 0.100 Uiso 1 1 calc R U . . .
C14R C 0.5026(4) 0.3743(3) 1.0268(3) 0.1000(16) Uani 1 1 d . . . . .
H14A H 0.4720 0.4247 0.9926 0.120 Uiso 1 1 calc R U . . .
H14B H 0.4432 0.3390 1.0300 0.120 Uiso 1 1 calc R U . . .
C11R C 0.3378(5) 0.1870(5) 0.8897(4) 0.142(2) Uani 1 1 d . . . . .
H11A H 0.2944 0.2046 0.9230 0.170 Uiso 1 1 calc R U . . .
H11B H 0.2890 0.1632 0.8360 0.170 Uiso 1 1 calc R U . . .
C12R C 0.4167(6) 0.1242(4) 0.9356(6) 0.170(3) Uani 1 1 d . . . . .
H12A H 0.4154 0.0768 0.8979 0.205 Uiso 1 1 calc R U . . .
H12B H 0.3977 0.1021 0.9825 0.205 Uiso 1 1 calc R U . . .
C10R C 0.3968(3) 0.2608(3) 0.8734(3) 0.0902(13) Uani 1 1 d . . . . .
H10A H 0.3696 0.3136 0.8890 0.108 Uiso 1 1 calc R U . . .
H10B H 0.3869 0.2636 0.8133 0.108 Uiso 1 1 calc R U . . .
C19R C 0.5785(8) 0.3995(5) 1.1150(4) 0.175(3) Uani 1 1 d . . . . .
H19A H 0.6109 0.4552 1.1136 0.209 Uiso 1 1 calc R U . . .
H19B H 0.5393 0.4022 1.1541 0.209 Uiso 1 1 calc R U . . .
C18R C 0.6618(9) 0.3342(5) 1.1414(4) 0.196(4) Uani 1 1 d . . . . .
H18A H 0.6391 0.2879 1.1700 0.235 Uiso 1 1 calc R U . . .
H18B H 0.7296 0.3580 1.1808 0.235 Uiso 1 1 calc R U . . .
C17R C 0.6777(4) 0.3016(3) 1.0635(3) 0.1026(15) Uani 1 1 d . . . . .
H17A H 0.6895 0.2401 1.0676 0.123 Uiso 1 1 calc R U . . .
H17B H 0.7407 0.3288 1.0569 0.123 Uiso 1 1 calc R U . . .
C1R C 0.7466(4) 0.3438(2) 0.6192(2) 0.0735(11) Uani 1 1 d . . . . .
H1RA H 0.6845 0.3585 0.5683 0.088 Uiso 1 1 calc R U . . .
H1RB H 0.8073 0.3799 0.6201 0.088 Uiso 1 1 calc R U . . .
C2R C 0.7754(5) 0.2565(3) 0.6122(3) 0.1118(18) Uani 1 1 d . . . . .
H2RA H 0.7920 0.2495 0.5612 0.168 Uiso 1 1 calc R U . . .
H2RB H 0.8383 0.2414 0.6612 0.168 Uiso 1 1 calc R U . . .
H2RC H 0.7153 0.2199 0.6093 0.168 Uiso 1 1 calc R U . . .
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'
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
O4 Cu1 O3 92.65(9) . .
O4 Cu1 O1 171.68(8) . .
O3 Cu1 O1 88.94(9) . .
O4 Cu1 O2 86.47(9) . .
O3 Cu1 O2 178.78(10) . .
O1 Cu1 O2 91.81(9) . .
O4 Cu1 N4R 91.19(9) . .
O3 Cu1 N4R 90.82(9) . .
O1 Cu1 N4R 96.96(9) . .
O2 Cu1 N4R 90.05(9) . .
O4 Cu1 O1R 79.64(8) . 2_656
O3 Cu1 O1R 87.30(8) . 2_656
O1 Cu1 O1R 92.29(8) . 2_656
O2 Cu1 O1R 91.71(8) . 2_656
N4R Cu1 O1R 170.53(9) . 2_656
C5R N4R N3R 105.2(2) . .
C5R N4R Cu1 123.62(19) . .
N3R N4R Cu1 131.15(16) . .
C6R N3R N4R 111.5(2) . .
C6R N3R C1R 128.1(3) . .
N4R N3R C1R 120.4(2) . .
F2 C1 F3 106.3(10) . .
F3A C1 F1A 109.8(8) . .
F3A C1 F2A 108.3(10) . .
F1A C1 F2A 102.5(6) . .
F2 C1 F1 104.2(8) . .
F3 C1 F1 107.8(8) . .
F3A C1 C2 115.6(6) . .
F2 C1 C2 112.4(6) . .
F3 C1 C2 115.1(6) . .
F1A C1 C2 111.8(5) . .
F2A C1 C2 108.0(6) . .
F1 C1 C2 110.3(5) . .
O1 C2 C3 128.2(3) . .
O1 C2 C1 113.8(3) . .
C3 C2 C1 117.9(3) . .
O1 C2 Cu1 34.31(13) . .
C3 C2 Cu1 93.9(2) . .
C1 C2 Cu1 148.1(2) . .
C2 C3 C4 122.5(3) . .
C2 C3 Cu1 61.27(19) . .
C4 C3 Cu1 61.30(18) . .
O2 C4 C3 127.9(3) . .
O2 C4 C5 113.1(3) . .
C3 C4 C5 119.0(3) . .
O2 C4 Cu1 34.28(12) . .
C3 C4 Cu1 93.65(19) . .
C5 C4 Cu1 147.3(3) . .
F5A C5 F4A 103.9(13) . .
F6 C5 F4 109.7(16) . .
F5A C5 F6A 104.8(15) . .
F4A C5 F6A 102.7(13) . .
F6 C5 F5 110.0(15) . .
F4 C5 F5 110.1(12) . .
F5A C5 C4 113.0(10) . .
F6 C5 C4 112.6(13) . .
F4A C5 C4 115.8(9) . .
F4 C5 C4 105.7(10) . .
F6A C5 C4 115.2(10) . .
F5 C5 C4 108.8(9) . .
C2 O1 Cu1 124.54(18) . .
C4 O2 Cu1 124.79(18) . .
C7 O3 Cu1 123.99(18) . .
C9 O4 Cu1 124.29(19) . .
F8A C6 F9A 108.1(8) . .
F8A C6 F7A 110.8(8) . .
F9A C6 F7A 103.2(8) . .
F7 C6 F9 107.1(11) . .
F7 C6 F8 109.8(11) . .
F9 C6 F8 97.5(8) . .
F8A C6 C7 112.5(5) . .
F7 C6 C7 114.1(6) . .
F9A C6 C7 112.9(6) . .
F7A C6 C7 109.0(5) . .
F9 C6 C7 114.0(6) . .
F8 C6 C7 113.1(5) . .
O3 C7 C8 128.8(3) . .
O3 C7 C6 114.5(3) . .
C8 C7 C6 116.7(3) . .
O3 C7 Cu1 34.82(13) . .
C8 C7 Cu1 94.0(2) . .
C6 C7 Cu1 149.3(3) . .
C9 C8 C7 121.5(3) . .
C9 C8 Cu1 60.9(2) . .
C7 C8 Cu1 60.63(19) . .
O4 C9 C8 128.6(3) . .
O4 C9 C10 113.0(3) . .
C8 C9 C10 118.4(3) . .
O4 C9 Cu1 34.51(13) . .
C8 C9 Cu1 94.2(2) . .
C10 C9 Cu1 147.2(3) . .
F10 C10 F11 107.4(4) . .
F10 C10 F12 106.1(3) . .
F11 C10 F12 107.1(4) . .
F10 C10 C9 109.6(3) . .
F11 C10 C9 114.8(3) . .
F12 C10 C9 111.5(3) . .
O1R N1R C8R 125.3(2) . .
O1R N1R C16R 122.1(2) . .
C8R N1R C16R 111.1(2) . .
N1R O1R Cu1 139.0(2) . 2_646
O2R N2R C8R 125.4(2) . .
O2R N2R C15R 123.2(2) . .
C8R N2R C15R 110.6(3) . .
N4R C5R C7R 111.7(2) . .
N4R C5R Cu1 36.65(14) . .
C7R C5R Cu1 148.32(19) . .
N3R C6R C7R 107.6(2) . .
C6R C7R C5R 104.1(2) . .
C6R C7R C8R 126.8(3) . .
C5R C7R C8R 129.1(3) . .
N1R C8R N2R 108.8(2) . .
N1R C8R C7R 125.7(3) . .
N2R C8R C7R 125.5(3) . .
N1R C16R C15R 99.7(2) . .
N1R C16R C13R 111.8(2) . .
C15R C16R C13R 117.2(3) . .
N1R C16R C10R 106.9(3) . .
C15R C16R C10R 116.6(3) . .
C13R C16R C10R 104.3(3) . .
N2R C15R C17R 107.3(3) . .
N2R C15R C16R 100.5(3) . .
C17R C15R C16R 116.9(3) . .
N2R C15R C14R 110.8(3) . .
C17R C15R C14R 104.7(3) . .
C16R C15R C14R 116.4(3) . .
C12R C13R C16R 107.4(4) . .
C19R C14R C15R 105.2(5) . .
C12R C11R C10R 108.0(5) . .
C11R C12R C13R 111.1(5) . .
C11R C10R C16R 107.4(4) . .
C18R C19R C14R 106.0(5) . .
C19R C18R C17R 107.6(6) . .
C18R C17R C15R 107.1(5) . .
C2R C1R N3R 115.6(3) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Cu1 O4 1.950(2) .
Cu1 O3 1.953(2) .
Cu1 O1 1.955(2) .
Cu1 O2 1.959(2) .
Cu1 N4R 2.333(2) .
Cu1 O1R 2.451(2) 2_656
N4R C5R 1.320(3) .
N4R N3R 1.357(3) .
N3R C6R 1.336(3) .
N3R C1R 1.467(3) .
C1 F3A 1.260(11) .
C1 F2 1.278(11) .
C1 F3 1.277(11) .
C1 F1A 1.288(8) .
C1 F2A 1.297(9) .
C1 F1 1.303(9) .
C1 C2 1.537(4) .
C2 O1 1.252(4) .
C2 C3 1.367(4) .
C3 C4 1.379(4) .
C4 O2 1.243(3) .
C4 C5 1.528(4) .
C5 F5A 1.20(2) .
C5 F6 1.23(3) .
C5 F4A 1.319(16) .
C5 F4 1.35(2) .
C5 F6A 1.39(2) .
C5 F5 1.42(2) .
O3 C7 1.236(4) .
O4 C9 1.244(4) .
C6 F8A 1.203(8) .
C6 F7 1.247(11) .
C6 F9A 1.283(9) .
C6 F7A 1.287(8) .
C6 F9 1.324(10) .
C6 F8 1.346(8) .
C6 C7 1.525(5) .
C7 C8 1.394(4) .
C8 C9 1.373(4) .
C9 C10 1.520(5) .
C10 F10 1.317(4) .
C10 F11 1.293(5) .
C10 F12 1.327(4) .
N1R O1R 1.292(3) .
N1R C8R 1.329(4) .
N1R C16R 1.504(3) .
O1R Cu1 2.451(2) 2_646
N2R O2R 1.269(3) .
N2R C8R 1.351(4) .
N2R C15R 1.494(4) .
C5R C7R 1.399(4) .
C6R C7R 1.380(4) .
C7R C8R 1.437(4) .
C16R C15R 1.531(5) .
C16R C13R 1.534(5) .
C16R C10R 1.536(5) .
C15R C17R 1.523(6) .
C15R C14R 1.548(4) .
C13R C12R 1.431(7) .
C14R C19R 1.506(8) .
C11R C12R 1.430(8) .
C11R C10R 1.468(6) .
C19R C18R 1.441(10) .
C18R C17R 1.484(7) .
C1R C2R 1.429(5) .
