#------------------------------------------------------------------------------
#$Date: 2016-03-23 20:48:37 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179425 $
#$URL: svn://www.crystallography.net/cod/cif/4/33/22/4332223.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the Crystal Eye server at
# http://wwmm.ch.cam.ac.uk/crystaleye/, created by Nick Day at the
# Peter Murray-Rust laboratory.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_4332223
loop_
_publ_author_name
'Tretyakov, Eugene'
'Fokin, Sergei'
'Romanenko, Galina'
'Ikorskii, Vladimir'
'Vasilevsky, Sergei'
'Ovcharenko, Victor'
_publ_section_title
;
 2D and 3D Cu(hfac)2Complexes with Nitronyl Nitroxide Biradicals
;
_journal_issue                   9
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              3671
_journal_page_last               3678
_journal_paper_doi               10.1021/ic060132e
_journal_volume                  45
_journal_year                    2006
_chemical_formula_sum            'C48 H48 Cu2 F24 N8 O13'
_chemical_formula_weight         1528.02
_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                93.574(6)
_cell_angle_beta                 113.391(6)
_cell_angle_gamma                103.059(5)
_cell_formula_units_Z            1
_cell_length_a                   11.281(3)
_cell_length_b                   11.598(4)
_cell_length_c                   13.742(4)
_cell_measurement_reflns_used    2682
_cell_measurement_temperature    200(2)
_cell_measurement_theta_max      22.99
_cell_measurement_theta_min      2.24
_cell_volume                     1584.1(8)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_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      200(2)
_diffrn_measured_fraction_theta_full 0.986
_diffrn_measured_fraction_theta_max 0.986
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0677
_diffrn_reflns_av_sigmaI/netI    0.0717
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       12
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            6921
_diffrn_reflns_theta_full        23.33
_diffrn_reflns_theta_max         23.33
_diffrn_reflns_theta_min         1.64
_exptl_absorpt_coefficient_mu    0.805
_exptl_absorpt_correction_type   none
_exptl_crystal_density_diffrn    1.604
_exptl_crystal_density_meas      0
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             772
_refine_diff_density_max         0.669
_refine_diff_density_min         -0.457
_refine_diff_density_rms         0.071
_refine_ls_extinction_coef       0.0000(10)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   0.908
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     537
_refine_ls_number_reflns         4538
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.908
_refine_ls_R_factor_all          0.0593
_refine_ls_R_factor_gt           0.0463
_refine_ls_shift/su_max          6.540
_refine_ls_shift/su_mean         0.016
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0850P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1208
_refine_ls_wR_factor_ref         0.1250
_reflns_number_gt                3270
_reflns_number_total             4538
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic060132esup1.cif
_cod_data_source_block           4_200
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 1891 2012-01-12 08:04:46Z andrius 
;
_cod_original_cell_volume        1584.0(8)
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               4332223
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 0.5000 0.5000 1.0000 0.0467(2) Uani 1 2 d S
O1 O 0.4008(3) 0.5358(2) 1.0813(2) 0.0514(7) Uani 1 1 d .
C1 C 0.2348(5) 0.5868(5) 1.1204(5) 0.0795(16) Uani 1 1 d .
F1 F 0.1189(3) 0.6148(4) 1.0729(3) 0.1243(15) Uani 1 1 d .
F2 F 0.3181(3) 0.6837(3) 1.1820(3) 0.1085(12) Uani 1 1 d .
F3 F 0.2168(6) 0.5096(4) 1.1790(4) 0.166(2) Uani 1 1 d .
C2 C 0.2814(4) 0.5387(4) 1.0384(4) 0.0530(11) Uani 1 1 d .
C3 C 0.1912(5) 0.5016(4) 0.9323(4) 0.0573(12) Uani 1 1 d .
H3A H 0.115(4) 0.507(3) 0.912(3) 0.035(11) Uiso 1 1 d .
C4 C 0.2267(4) 0.4534(3) 0.8565(3) 0.0465(10) Uani 1 1 d .
C5 C 0.1206(5) 0.4057(5) 0.7413(5) 0.0655(14) Uani 1 1 d .
F4 F -0.0006(2) 0.4176(2) 0.7275(2) 0.0655(7) Uani 1 1 d .
F5 F 0.1581(12) 0.4731(8) 0.6710(10) 0.057(3) Uani 0.50 1 d P
F6 F 0.1190(13) 0.3014(12) 0.7058(9) 0.053(2) Uani 0.50 1 d P
F51 F 0.1488(17) 0.4504(17) 0.6739(13) 0.164(8) Uani 0.50 1 d P
F61 F 0.0915(17) 0.2842(15) 0.7264(13) 0.166(8) Uani 0.50 1 d P
O2 O 0.3382(3) 0.4425(2) 0.8683(2) 0.0482(7) Uani 1 1 d .
Cu2 Cu 0.0000 0.0000 0.5000 0.0333(2) Uani 1 2 d S
O3 O -0.1168(2) 0.0690(2) 0.54649(18) 0.0372(6) Uani 1 1 d .
C6 C -0.2653(5) 0.1803(5) 0.5433(4) 0.0632(12) Uani 1 1 d .
F7 F -0.2742(13) 0.2927(9) 0.5391(14) 0.079(4) Uani 0.50 1 d P
F8 F -0.2502(17) 0.1621(16) 0.6368(12) 0.072(4) Uani 0.50 1 d P
F9 F -0.385(2) 0.108(3) 0.4747(14) 0.080(4) Uani 0.50 1 d P
F71 F -0.302(2) 0.2774(17) 0.5106(18) 0.165(9) Uani 0.50 1 d P
F81 F -0.223(2) 0.1955(18) 0.6499(16) 0.097(6) Uani 0.50 1 d P
F91 F -0.370(2) 0.091(3) 0.5062(18) 0.155(9) Uani 0.50 1 d P
C7 C -0.1561(4) 0.1576(3) 0.5122(3) 0.0424(9) Uani 1 1 d .
C8 C -0.1139(5) 0.2308(4) 0.4512(4) 0.0533(12) Uani 1 1 d .
H8A H -0.144(4) 0.285(4) 0.438(3) 0.047(13) Uiso 1 1 d .
C9 C -0.0143(4) 0.2183(3) 0.4207(3) 0.0457(10) Uani 1 1 d .
C10 C 0.0290(6) 0.3108(5) 0.3565(4) 0.0732(14) Uani 1 1 d .
F10 F 0.0882(3) 0.4181(3) 0.4163(3) 0.1013(11) Uani 1 1 d .
F11 F -0.0758(4) 0.3193(3) 0.2732(2) 0.1040(11) Uani 1 1 d .
F12 F 0.1104(5) 0.2819(4) 0.3219(4) 0.178(2) Uani 1 1 d .
O4 O 0.0502(2) 0.1421(2) 0.44013(18) 0.0397(6) Uani 1 1 d .
O01 O 0.5052(3) 0.2964(2) 1.0339(2) 0.0528(7) Uani 1 1 d .
N1 N 0.4137(3) 0.2136(3) 1.0440(2) 0.0463(8) Uani 1 1 d .
C01 C 0.4273(6) 0.1847(4) 1.1522(3) 0.0702(15) Uani 1 1 d .
C02 C 0.5291(10) 0.1073(7) 1.1821(5) 0.122(3) Uani 1 1 d .
H02A H 0.5426 0.0849 1.2510 0.23(4) Uiso 1 1 calc R
H02B H 0.6131 0.1530 1.1850 0.29(7) Uiso 1 1 calc R
H02C H 0.4942 0.0362 1.1286 0.22(4) Uiso 1 1 calc R
C03 C 0.4839(7) 0.2942(5) 1.2339(4) 0.0879(18) Uani 1 1 d .
H03A H 0.4194 0.3399 1.2195 0.11(2) Uiso 1 1 calc R
H03B H 0.5640 0.3417 1.2316 0.12(3) Uiso 1 1 calc R
H03C H 0.5051 0.2724 1.3039 0.11(2) Uiso 1 1 calc R
C04 C 0.2840(7) 0.1112(5) 1.1224(4) 0.0858(18) Uani 1 1 d .
C05 C 0.2606(8) 0.0185(7) 1.1834(6) 0.130(2) Uiso 1 1 d .
H05A H 0.3129 -0.0362 1.1829 0.000(6) Uiso 1 1 calc R
H05B H 0.1671 -0.0244 1.1515 0.055(11) Uiso 1 1 calc R
H05C H 0.2864 0.0544 1.2561 0.9(2) Uiso 1 1 calc R
C06 C 0.1909(8) 0.1937(8) 1.1227(6) 0.122(3) Uani 1 1 d .
H06A H 0.1016 0.1446 1.1039 0.21(4) Uiso 1 1 calc R
H06B H 0.1889 0.2464 1.0712 0.13(3) Uiso 1 1 calc R
H06C H 0.2254 0.2405 1.1931 0.15(3) Uiso 1 1 calc R
N2 N 0.2380(4) 0.0640(3) 1.0058(3) 0.0559(9) Uani 1 1 d .
O02 O 0.1346(4) -0.0229(3) 0.9516(2) 0.0816(11) Uani 1 1 d .
C07 C 0.3110(4) 0.1339(3) 0.9645(3) 0.0396(9) Uani 1 1 d .
C08 C 0.2858(3) 0.1247(3) 0.8532(3) 0.0346(8) Uani 1 1 d .
C09 C 0.1716(4) 0.0543(3) 0.7642(3) 0.0392(9) Uani 1 1 d .
H09A H 0.095(3) 0.008(3) 0.767(3) 0.033(9) Uiso 1 1 d .
N3 N 0.1851(3) 0.0672(2) 0.6732(2) 0.0369(7) Uani 1 1 d .
N4 N 0.3079(3) 0.1444(2) 0.7041(2) 0.0345(7) Uani 1 1 d .
C041 C 0.3595(5) 0.1812(3) 0.6254(3) 0.0415(9) Uani 1 1 d .
H04A H 0.293(4) 0.139(3) 0.558(3) 0.048(11) Uiso 1 1 d .
H04B H 0.440(4) 0.161(3) 0.642(3) 0.036(10) Uiso 1 1 d .
C042 C 0.3759(5) 0.3125(3) 0.6179(4) 0.0412(9) Uani 1 1 d .
H04C H 0.426(4) 0.358(4) 0.685(3) 0.051(12) Uiso 1 1 d .
H04D H 0.290(4) 0.329(3) 0.599(3) 0.035(10) Uiso 1 1 d .
C043 C 0.4388(5) 0.3492(4) 0.5411(4) 0.0500(11) Uani 1 1 d .
H04E H 0.508(4) 0.325(4) 0.556(3) 0.053(14) Uiso 1 1 d .
H04F H 0.373(4) 0.305(4) 0.463(3) 0.058(12) Uiso 1 1 d .
C044 C 0.4678(5) 0.4809(4) 0.5376(4) 0.0511(11) Uani 1 1 d .
H04G H 0.534(4) 0.526(4) 0.610(4) 0.065(13) Uiso 1 1 d .
H04H H 0.395(4) 0.511(4) 0.532(3) 0.059(13) Uiso 1 1 d .
C010 C 0.3693(4) 0.1801(3) 0.8100(3) 0.0383(9) Uani 1 1 d .
H01A H 0.443(3) 0.227(3) 0.837(3) 0.029(10) Uiso 1 1 d .
O1W O 0.3182(18) -0.1801(16) 1.0063(14) 0.268(8) Uani 0.50 1 d P
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
O2 Cu1 O2 180.000(1) 2_667 .
O2 Cu1 O1 87.65(11) 2_667 .
O2 Cu1 O1 92.35(11) . .
O2 Cu1 O1 92.35(11) 2_667 2_667
O2 Cu1 O1 87.65(11) . 2_667
O1 Cu1 O1 180.000(1) . 2_667
O2 Cu1 O01 92.54(10) 2_667 2_667
O2 Cu1 O01 87.46(10) . 2_667
O1 Cu1 O01 80.42(11) . 2_667
O1 Cu1 O01 99.58(11) 2_667 2_667
O2 Cu1 O01 87.46(10) 2_667 .
O2 Cu1 O01 92.54(10) . .
O1 Cu1 O01 99.58(11) . .
O1 Cu1 O01 80.42(11) 2_667 .
O01 Cu1 O01 180.000(1) 2_667 .
C2 O1 Cu1 123.6(3) . .
F3 C1 F2 108.4(5) . .
F3 C1 F1 106.7(5) . .
F2 C1 F1 105.0(5) . .
F3 C1 C2 111.7(5) . .
F2 C1 C2 112.3(4) . .
F1 C1 C2 112.4(5) . .
O1 C2 C3 128.2(4) . .
O1 C2 C1 112.4(4) . .
C3 C2 C1 119.3(4) . .
O1 C2 Cu1 34.98(18) . .
C3 C2 Cu1 93.7(3) . .
C1 C2 Cu1 146.8(3) . .
C2 C3 C4 121.5(4) . .
C2 C3 Cu1 61.2(3) . .
C4 C3 Cu1 60.6(2) . .
O2 C4 C3 128.4(4) . .
O2 C4 C5 112.0(4) . .
C3 C4 C5 119.6(4) . .
O2 C4 Cu1 34.33(17) . .
C3 C4 Cu1 94.2(3) . .
C5 C4 Cu1 146.2(3) . .
F51 C5 F6 93.5(11) . .
F51 C5 F4 108.1(10) . .
F6 C5 F4 114.2(7) . .
F51 C5 F61 114.4(12) . .
F6 C5 F61 22.3(10) . .
F4 C5 F61 98.9(8) . .
F51 C5 F5 7.7(12) . .
F6 C5 F5 100.9(7) . .
F4 C5 F5 106.3(6) . .
F61 C5 F5 122.1(10) . .
F51 C5 C4 114.4(9) . .
F6 C5 C4 112.9(7) . .
F4 C5 C4 112.5(5) . .
F61 C5 C4 107.6(8) . .
F5 C5 C4 109.1(6) . .
F61 F6 C5 88(3) . .
F6 F61 C5 69(3) . .
C4 O2 Cu1 124.5(3) . .
O4 Cu2 O4 180.00(9) . 2_556
O4 Cu2 O3 92.45(10) . .
O4 Cu2 O3 87.55(10) 2_556 .
O4 Cu2 O3 87.55(10) . 2_556
O4 Cu2 O3 92.45(10) 2_556 2_556
O3 Cu2 O3 180.00(12) . 2_556
O4 Cu2 N3 95.22(10) . .
O4 Cu2 N3 84.78(9) 2_556 .
O3 Cu2 N3 92.28(10) . .
O3 Cu2 N3 87.72(10) 2_556 .
O4 Cu2 N3 84.78(9) . 2_556
O4 Cu2 N3 95.22(10) 2_556 2_556
O3 Cu2 N3 87.72(10) . 2_556
O3 Cu2 N3 92.28(10) 2_556 2_556
N3 Cu2 N3 180.0 . 2_556
C7 O3 Cu2 122.9(2) . .
F8 C6 F91 88.0(14) . .
F8 C6 F71 118.6(12) . .
F91 C6 F71 108.2(15) . .
F8 C6 F81 18.0(17) . .
F91 C6 F81 105.3(14) . .
F71 C6 F81 107.5(13) . .
F8 C6 F7 106.3(11) . .
F91 C6 F7 121.3(14) . .
F71 C6 F7 16.8(15) . .
F81 C6 F7 92.9(12) . .
F8 C6 F9 106.8(12) . .
F91 C6 F9 20.5(16) . .
F71 C6 F9 91.7(15) . .
F81 C6 F9 123.2(12) . .
F7 C6 F9 107.0(13) . .
F8 C6 C7 114.5(7) . .
F91 C6 C7 112.2(12) . .
F71 C6 C7 112.6(10) . .
F81 C6 C7 110.6(10) . .
F7 C6 C7 112.1(7) . .
F9 C6 C7 109.7(11) . .
C6 F8 F91 46.3(10) . .
C6 F91 F8 45.7(10) . .
O3 C7 C8 127.8(4) . .
O3 C7 C6 113.2(4) . .
C8 C7 C6 119.0(4) . .
O3 C7 Cu2 35.41(16) . .
C8 C7 Cu2 92.7(3) . .
C6 C7 Cu2 147.6(3) . .
C7 C8 C9 123.1(4) . .
C7 C8 Cu2 62.1(2) . .
C9 C8 Cu2 61.4(2) . .
O4 C9 C8 128.4(4) . .
O4 C9 C10 113.6(4) . .
C8 C9 C10 118.0(4) . .
O4 C9 Cu2 35.58(17) . .
C8 C9 Cu2 93.3(3) . .
C10 C9 Cu2 148.3(3) . .
F12 C10 F11 107.8(5) . .
F12 C10 F10 108.0(6) . .
F11 C10 F10 107.4(4) . .
F12 C10 C9 112.2(4) . .
F11 C10 C9 110.4(5) . .
F10 C10 C9 110.8(4) . .
C9 O4 Cu2 122.7(3) . .
N1 O01 Cu1 128.4(2) . .
O01 N1 C07 126.2(3) . .
O01 N1 C01 121.5(3) . .
C07 N1 C01 111.6(3) . .
C03 C01 N1 111.4(4) . .
C03 C01 C04 118.6(5) . .
N1 C01 C04 99.7(3) . .
C03 C01 C02 108.6(5) . .
N1 C01 C02 104.7(4) . .
C04 C01 C02 112.7(5) . .
C05 C04 N2 113.2(5) . .
C05 C04 C01 119.1(5) . .
N2 C04 C01 101.4(4) . .
C05 C04 C06 106.5(6) . .
N2 C04 C06 104.1(5) . .
C01 C04 C06 111.6(5) . .
O02 N2 C07 124.9(3) . .
O02 N2 C04 124.1(3) . .
C07 N2 C04 110.6(3) . .
N1 C07 N2 109.0(3) . .
N1 C07 C08 124.8(3) . .
N2 C07 C08 126.1(3) . .
C010 C08 C09 104.4(3) . .
C010 C08 C07 127.7(3) . .
C09 C08 C07 127.9(3) . .
N3 C09 C08 110.9(3) . .
C09 N3 N4 105.0(3) . .
C09 N3 Cu2 122.4(2) . .
N4 N3 Cu2 131.0(2) . .
C010 N4 N3 111.9(3) . .
C010 N4 C041 126.9(3) . .
N3 N4 C041 121.2(3) . .
N4 C041 C042 113.0(3) . .
C041 C042 C043 111.4(3) . .
C044 C043 C042 113.5(4) . .
C043 C044 C044 114.1(5) . 2_666
N4 C010 C08 107.9(3) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Cu1 O2 1.931(3) 2_667
Cu1 O2 1.931(3) .
Cu1 O1 1.953(3) .
Cu1 O1 1.953(3) 2_667
Cu1 O01 2.444(3) 2_667
Cu1 O01 2.444(3) .
O1 C2 1.247(5) .
C1 F3 1.277(7) .
C1 F2 1.279(5) .
C1 F1 1.335(6) .
C1 C2 1.544(6) .
C2 C3 1.376(6) .
C3 C4 1.385(6) .
C4 O2 1.239(4) .
C4 C5 1.527(6) .
C5 F51 1.203(16) .
C5 F6 1.269(14) .
C5 F4 1.344(6) .
C5 F61 1.356(17) .
C5 F5 1.411(12) .
F6 F61 0.51(2) .
Cu2 O4 1.957(2) .
Cu2 O4 1.957(2) 2_556
Cu2 O3 1.966(2) .
Cu2 O3 1.966(2) 2_556
Cu2 N3 2.392(3) .
Cu2 N3 2.392(3) 2_556
O3 C7 1.255(4) .
C6 F8 1.264(16) .
C6 F91 1.28(3) .
C6 F71 1.329(19) .
C6 F81 1.33(2) .
C6 F7 1.333(13) .
C6 F9 1.34(3) .
C6 C7 1.524(6) .
F8 F91 1.76(3) .
C7 C8 1.369(6) .
C8 C9 1.378(6) .
C9 O4 1.244(4) .
C9 C10 1.547(6) .
C10 F12 1.282(6) .
C10 F11 1.308(6) .
C10 F10 1.317(6) .
O01 N1 1.300(4) .
N1 C07 1.332(5) .
N1 C01 1.499(5) .
C01 C03 1.473(6) .
C01 C04 1.521(7) .
C01 C02 1.559(8) .
C04 C05 1.445(7) .
C04 N2 1.496(5) .
C04 C06 1.574(9) .
N2 O02 1.271(4) .
N2 C07 1.335(5) .
C07 C08 1.432(5) .
C08 C010 1.368(5) .
C08 C09 1.404(5) .
C09 N3 1.331(4) .
N3 N4 1.351(4) .
N4 C010 1.328(5) .
N4 C041 1.461(5) .
C041 C042 1.507(5) .
C042 C043 1.521(5) .
C043 C044 1.496(6) .
C044 C044 1.517(8) 2_666
