#------------------------------------------------------------------------------
#$Date: 2016-03-23 00:28:22 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179112 $
#$URL: svn://www.crystallography.net/cod/cif/4/30/74/4307455.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_4307455
loop_
_publ_author_name
'Xiao-Ping Zhou'
'Wen-Xiu Ni'
'Shun-Ze Zhan'
'Jia Ni'
'Dan Li'
'Ye-Gao Yin'
_publ_section_title
;
From Encapsulation to Polypseudorotaxane: Unusual Anion Networks Driven
by Predesigned Metal Bis(terpyridine) Complex Cations
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              2345
_journal_page_last               2347
_journal_paper_doi               10.1021/ic061927o
_journal_volume                  46
_journal_year                    2007
_chemical_formula_sum            'C52 H34 Cu7 N14'
_chemical_formula_weight         1299.71
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_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
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 103.7330(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   35.529(4)
_cell_length_b                   18.5537(18)
_cell_length_c                   16.2503(16)
_cell_measurement_reflns_used    7210
_cell_measurement_temperature    200(2)
_cell_measurement_theta_max      26.94
_cell_measurement_theta_min      2.22
_cell_volume                     10405.9(19)
_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 1.000
_diffrn_measured_fraction_theta_max 1.000
_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  0.0307
_diffrn_reflns_av_sigmaI/netI    0.0360
_diffrn_reflns_limit_h_max       42
_diffrn_reflns_limit_h_min       -33
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            26978
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         1.18
_exptl_absorpt_coefficient_mu    2.856
_exptl_absorpt_correction_T_max  0.5722
_exptl_absorpt_correction_T_min  0.4812
_exptl_absorpt_correction_type   none
_exptl_crystal_density_diffrn    1.659
_exptl_crystal_density_meas      0
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             5176
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.25
_exptl_crystal_size_min          0.22
_refine_diff_density_max         0.810
_refine_diff_density_min         -0.603
_refine_diff_density_rms         0.092
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.029
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     627
_refine_ls_number_reflns         9163
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.029
_refine_ls_R_factor_all          0.0558
_refine_ls_R_factor_gt           0.0412
_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)+(0.0610P)²+22.7418P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1049
_refine_ls_wR_factor_ref         0.1162
_reflns_number_gt                7180
_reflns_number_total             9163
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic061927osi20070210_104654_5.cif
_cod_data_source_block           2e
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_cell_volume        10405.8(18)
_cod_database_code               4307455
loop_
_symmetry_equiv_pos_as_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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.46843(11) 0.9452(2) 0.6440(2) 0.0386(10) Uani 1 1 d . . .
C2 C 0.45443(11) 0.9055(2) 0.3843(2) 0.0365(9) Uani 1 1 d . . .
C3 C 0.37367(11) 0.9744(2) 0.4026(2) 0.0291(8) Uani 1 1 d . . .
C4 C 0.26405(11) 1.0289(2) 0.1927(3) 0.0341(9) Uani 1 1 d . . .
C5 C 0.23522(13) 0.9915(3) -0.0704(3) 0.0454(11) Uani 1 1 d . . .
C6 C 0.15747(11) 0.9848(2) 0.0257(2) 0.0332(8) Uani 1 1 d . . .
C7 C 0.02747(13) 0.8855(3) -0.1381(3) 0.0498(12) Uani 1 1 d . . .
C8 C 0.04871(11) 0.9455(2) 0.1226(2) 0.0376(9) Uani 1 1 d . . .
C9 C 0.42588(14) 0.7462(2) 0.5671(3) 0.0519(12) Uani 1 1 d . . .
H9 H 0.4233 0.7972 0.5648 0.062 Uiso 1 1 calc R . .
C10 C 0.44951(14) 0.7136(3) 0.5218(3) 0.0554(12) Uani 1 1 d . . .
H10 H 0.4624 0.7414 0.4876 0.066 Uiso 1 1 calc R . .
C11 C 0.45399(13) 0.6407(3) 0.5270(3) 0.0508(11) Uani 1 1 d . . .
H11 H 0.4706 0.6170 0.4976 0.061 Uiso 1 1 calc R . .
C12 C 0.43409(12) 0.6016(2) 0.5755(3) 0.0394(9) Uani 1 1 d . . .
H12 H 0.4369 0.5507 0.5796 0.047 Uiso 1 1 calc R . .
C13 C 0.41011(10) 0.63679(19) 0.6178(2) 0.0276(8) Uani 1 1 d . . .
C14 C 0.38590(10) 0.59953(18) 0.6676(2) 0.0252(7) Uani 1 1 d . . .
C15 C 0.38634(10) 0.52605(18) 0.6815(2) 0.0264(8) Uani 1 1 d . . .
H15 H 0.4030 0.4959 0.6589 0.032 Uiso 1 1 calc R . .
C16 C 0.36219(10) 0.49631(18) 0.7289(2) 0.0270(8) Uani 1 1 d . . .
C17 C 0.36291(10) 0.41859(19) 0.7483(2) 0.0280(8) Uani 1 1 d . . .
C18 C 0.39785(12) 0.3810(2) 0.7687(2) 0.0392(9) Uiso 1 1 d . . .
H18 H 0.4214 0.4054 0.7690 0.047 Uiso 1 1 calc R . .
C19 C 0.39848(13) 0.3083(2) 0.7885(3) 0.0425(10) Uiso 1 1 d . . .
H19 H 0.4225 0.2835 0.8020 0.051 Uiso 1 1 calc R . .
C20 C 0.36485(12) 0.2713(2) 0.7889(3) 0.0404(10) Uiso 1 1 d . . .
C21 C 0.36512(15) 0.1925(2) 0.8107(3) 0.0551(12) Uiso 1 1 d . . .
H21A H 0.3896 0.1709 0.8054 0.083 Uiso 1 1 calc R . .
H21B H 0.3435 0.1683 0.7718 0.083 Uiso 1 1 calc R . .
H21C H 0.3624 0.1870 0.8690 0.083 Uiso 1 1 calc R . .
C22 C 0.33026(13) 0.3089(2) 0.7679(3) 0.0399(9) Uiso 1 1 d . . .
H22 H 0.3067 0.2841 0.7664 0.048 Uiso 1 1 calc R . .
C23 C 0.32904(12) 0.3815(2) 0.7490(2) 0.0351(9) Uiso 1 1 d . . .
H23 H 0.3049 0.4063 0.7364 0.042 Uiso 1 1 calc R . .
C24 C 0.33706(10) 0.54210(18) 0.7580(2) 0.0266(8) Uani 1 1 d . . .
H24 H 0.3193 0.5231 0.7879 0.032 Uiso 1 1 calc R . .
C25 C 0.33811(10) 0.61560(18) 0.7431(2) 0.0239(7) Uani 1 1 d . . .
C26 C 0.31368(10) 0.66913(18) 0.7746(2) 0.0268(8) Uani 1 1 d . . .
C27 C 0.28631(11) 0.6503(2) 0.8181(2) 0.0364(9) Uani 1 1 d . . .
H27 H 0.2818 0.6011 0.8291 0.044 Uiso 1 1 calc R . .
C28 C 0.26536(13) 0.7050(2) 0.8458(3) 0.0477(11) Uani 1 1 d . . .
H28 H 0.2462 0.6934 0.8756 0.057 Uiso 1 1 calc R . .
C29 C 0.27252(13) 0.7756(2) 0.8299(3) 0.0450(11) Uani 1 1 d . . .
H29 H 0.2589 0.8135 0.8494 0.054 Uiso 1 1 calc R . .
C30 C 0.29973(12) 0.7899(2) 0.7851(3) 0.0404(10) Uani 1 1 d . . .
H30 H 0.3045 0.8388 0.7731 0.048 Uiso 1 1 calc R . .
C31 C 0.30396(13) 0.7002(2) 0.5110(3) 0.0407(10) Uani 1 1 d . . .
H31 H 0.3081 0.6522 0.5314 0.049 Uiso 1 1 calc R . .
C32 C 0.27984(12) 0.7120(2) 0.4323(3) 0.0436(10) Uani 1 1 d . . .
H32 H 0.2678 0.6728 0.3985 0.052 Uiso 1 1 calc R . .
C33 C 0.27364(12) 0.7815(2) 0.4039(3) 0.0409(10) Uani 1 1 d . . .
H33 H 0.2568 0.7910 0.3502 0.049 Uiso 1 1 calc R . .
C34 C 0.29191(11) 0.8380(2) 0.4533(2) 0.0334(9) Uani 1 1 d . . .
H34 H 0.2878 0.8864 0.4342 0.040 Uiso 1 1 calc R . .
C35 C 0.31628(10) 0.82228(19) 0.5312(2) 0.0267(8) Uani 1 1 d . . .
C36 C 0.33822(10) 0.87818(18) 0.5883(2) 0.0245(7) Uani 1 1 d . . .
C37 C 0.33622(10) 0.95102(18) 0.5714(2) 0.0244(7) Uani 1 1 d . . .
H37 H 0.3188 0.9689 0.5220 0.029 Uiso 1 1 calc R . .
C38 C 0.36010(10) 0.99852(18) 0.6276(2) 0.0263(8) Uani 1 1 d . . .
C39 C 0.35940(11) 1.07608(19) 0.6075(2) 0.0298(8) Uani 1 1 d . . .
C40 C 0.32502(12) 1.11096(19) 0.5701(2) 0.0350(9) Uani 1 1 d . . .
H40 H 0.3013 1.0849 0.5581 0.042 Uiso 1 1 calc R . .
C41 C 0.32508(13) 1.1832(2) 0.5504(3) 0.0414(10) Uani 1 1 d . . .
H41 H 0.3012 1.2061 0.5254 0.050 Uiso 1 1 calc R . .
C42 C 0.35881(14) 1.2234(2) 0.5659(3) 0.0440(10) Uani 1 1 d . . .
C43 C 0.35822(16) 1.3017(3) 0.5421(3) 0.0612(13) Uiso 1 1 d . . .
H43A H 0.3805 1.3262 0.5784 0.092 Uiso 1 1 calc R . .
H43B H 0.3342 1.3238 0.5495 0.092 Uiso 1 1 calc R . .
H43C H 0.3596 1.3061 0.4827 0.092 Uiso 1 1 calc R . .
C44 C 0.39310(14) 1.1883(2) 0.6033(3) 0.0478(11) Uani 1 1 d . . .
H44 H 0.4167 1.2146 0.6151 0.057 Uiso 1 1 calc R . .
C45 C 0.39362(12) 1.1157(2) 0.6238(3) 0.0408(10) Uani 1 1 d . . .
H45 H 0.4175 1.0929 0.6492 0.049 Uiso 1 1 calc R . .
C46 C 0.38414(10) 0.97008(18) 0.7004(2) 0.0251(7) Uani 1 1 d . . .
H46 H 0.4004 1.0010 0.7402 0.030 Uiso 1 1 calc R . .
C47 C 0.38437(10) 0.89663(18) 0.7146(2) 0.0249(7) Uani 1 1 d . . .
C48 C 0.40872(10) 0.85970(19) 0.7902(2) 0.0269(8) Uani 1 1 d . . .
C49 C 0.43358(11) 0.8951(2) 0.8565(2) 0.0362(9) Uani 1 1 d . . .
H49 H 0.4369 0.9459 0.8545 0.043 Uiso 1 1 calc R . .
C50 C 0.45350(13) 0.8557(3) 0.9257(3) 0.0489(11) Uani 1 1 d . . .
H50 H 0.4707 0.8790 0.9718 0.059 Uiso 1 1 calc R . .
C51 C 0.44795(13) 0.7825(3) 0.9263(3) 0.0550(12) Uani 1 1 d . . .
H51 H 0.4606 0.7544 0.9737 0.066 Uiso 1 1 calc R . .
C52 C 0.42372(13) 0.7502(2) 0.8571(3) 0.0478(11) Uani 1 1 d . . .
H52 H 0.4208 0.6993 0.8568 0.057 Uiso 1 1 calc R . .
Cu1 Cu 0.5000 1.10808(5) 0.7500 0.0583(2) Uani 1 2 d S . .
Cu2 Cu 0.5000 0.94738(5) 0.7500 0.0513(2) Uani 1 2 d S . .
Cu3 Cu 0.423371(15) 0.94143(3) 0.45881(3) 0.04206(15) Uani 1 1 d . . .
Cu4 Cu 0.291025(15) 1.01528(3) 0.30697(3) 0.03957(14) Uani 1 1 d . . .
Cu5 Cu 0.208589(15) 1.00205(3) 0.01605(3) 0.04124(15) Uani 1 1 d . . .
Cu6 Cu 0.075722(15) 0.93806(3) 0.03673(3) 0.04427(15) Uani 1 1 d . . .
Cu7 Cu 0.0000 0.95372(5) 0.2500 0.0533(2) Uani 1 2 d S . .
Cu8 Cu 0.0000 0.88273(5) -0.2500 0.0587(2) Uani 1 2 d S . .
Cu9 Cu 0.363336(13) 0.74823(2) 0.68016(3) 0.02880(12) Uani 1 1 d . . .
N1 N 0.52819(14) 1.1053(3) 0.6641(3) 0.0719(13) Uani 1 1 d . . .
N2 N 0.45039(12) 0.9429(2) 0.5756(3) 0.0565(10) Uani 1 1 d . . .
N3 N 0.34305(12) 0.9924(2) 0.3659(2) 0.0501(10) Uani 1 1 d . . .
N4 N 0.25516(12) 1.0149(2) 0.3831(2) 0.0573(11) Uani 1 1 d . . .
N5 N 0.24370(10) 1.02876(19) 0.1253(2) 0.0429(8) Uani 1 1 d . . .
N6 N 0.12651(12) 0.9690(2) 0.0319(2) 0.0480(9) Uani 1 1 d . . .
N7 N 0.04503(11) 0.8969(2) -0.0700(3) 0.0552(10) Uani 1 1 d . . .
N8 N 0.03084(12) 0.9500(2) 0.1733(3) 0.0577(11) Uani 1 1 d . . .
N9 N 0.40653(9) 0.70890(17) 0.6143(2) 0.0367(8) Uani 1 1 d . . .
N10 N 0.36239(8) 0.64343(15) 0.69974(18) 0.0252(6) Uani 1 1 d . . .
N11 N 0.32011(9) 0.73822(15) 0.75716(19) 0.0293(7) Uani 1 1 d . . .
N12 N 0.32181(9) 0.75418(15) 0.55983(19) 0.0307(7) Uani 1 1 d . . .
N13 N 0.36216(8) 0.85185(15) 0.65870(18) 0.0258(6) Uani 1 1 d . . .
N14 N 0.40430(9) 0.78767(17) 0.7909(2) 0.0352(7) Uani 1 1 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'
N N 0.0061 0.0033 '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
_geom_angle_publ_flag
N2 C1 Cu2 176.1(4) . . ?
N1 C2 Cu3 169.6(4) 5_676 . ?
N3 C3 Cu3 177.3(4) . . ?
N5 C4 Cu4 169.2(4) . . ?
N4 C5 Cu5 172.7(4) 6_575 . ?
N6 C6 Cu5 175.2(4) . . ?
N7 C7 Cu8 170.9(5) . . ?
N8 C8 Cu6 177.6(4) . . ?
N9 C9 C10 122.6(4) . . ?
N9 C9 H9 118.7 . . ?
C10 C9 H9 118.7 . . ?
C11 C10 C9 118.6(4) . . ?
C11 C10 H10 120.7 . . ?
C9 C10 H10 120.7 . . ?
C10 C11 C12 119.2(4) . . ?
C10 C11 H11 120.4 . . ?
C12 C11 H11 120.4 . . ?
C13 C12 C11 119.7(4) . . ?
C13 C12 H12 120.1 . . ?
C11 C12 H12 120.1 . . ?
N9 C13 C12 120.9(3) . . ?
N9 C13 C14 115.2(3) . . ?
C12 C13 C14 123.9(3) . . ?
N10 C14 C15 120.9(3) . . ?
N10 C14 C13 114.8(3) . . ?
C15 C14 C13 124.3(3) . . ?
C14 C15 C16 119.7(3) . . ?
C14 C15 H15 120.1 . . ?
C16 C15 H15 120.1 . . ?
C24 C16 C15 118.3(3) . . ?
C24 C16 C17 120.2(3) . . ?
C15 C16 C17 121.5(3) . . ?
C23 C17 C18 118.4(3) . . ?
C23 C17 C16 121.0(3) . . ?
C18 C17 C16 120.6(3) . . ?
C19 C18 C17 120.5(4) . . ?
C19 C18 H18 119.8 . . ?
C17 C18 H18 119.8 . . ?
C20 C19 C18 121.3(4) . . ?
C20 C19 H19 119.4 . . ?
C18 C19 H19 119.4 . . ?
C19 C20 C22 117.9(4) . . ?
C19 C20 C21 121.9(4) . . ?
C22 C20 C21 120.3(4) . . ?
C20 C21 H21A 109.5 . . ?
C20 C21 H21B 109.5 . . ?
H21A C21 H21B 109.5 . . ?
C20 C21 H21C 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
C23 C22 C20 121.8(4) . . ?
C23 C22 H22 119.1 . . ?
C20 C22 H22 119.1 . . ?
C22 C23 C17 120.2(4) . . ?
C22 C23 H23 119.9 . . ?
C17 C23 H23 119.9 . . ?
C25 C24 C16 119.6(3) . . ?
C25 C24 H24 120.2 . . ?
C16 C24 H24 120.2 . . ?
N10 C25 C24 121.2(3) . . ?
N10 C25 C26 115.2(3) . . ?
C24 C25 C26 123.6(3) . . ?
N11 C26 C27 121.8(3) . . ?
N11 C26 C25 114.9(3) . . ?
C27 C26 C25 123.3(3) . . ?
C26 C27 C28 118.5(4) . . ?
C26 C27 H27 120.8 . . ?
C28 C27 H27 120.8 . . ?
C29 C28 C27 119.8(4) . . ?
C29 C28 H28 120.1 . . ?
C27 C28 H28 120.1 . . ?
C30 C29 C28 118.3(4) . . ?
C30 C29 H29 120.9 . . ?
C28 C29 H29 120.9 . . ?
N11 C30 C29 123.1(4) . . ?
N11 C30 H30 118.4 . . ?
C29 C30 H30 118.4 . . ?
N12 C31 C32 122.3(4) . . ?
N12 C31 H31 118.9 . . ?
C32 C31 H31 118.9 . . ?
C33 C32 C31 118.5(4) . . ?
C33 C32 H32 120.8 . . ?
C31 C32 H32 120.8 . . ?
C32 C33 C34 120.1(4) . . ?
C32 C33 H33 120.0 . . ?
C34 C33 H33 120.0 . . ?
C35 C34 C33 118.5(4) . . ?
C35 C34 H34 120.8 . . ?
C33 C34 H34 120.8 . . ?
N12 C35 C34 121.5(3) . . ?
N12 C35 C36 115.4(3) . . ?
C34 C35 C36 123.1(3) . . ?
N13 C36 C37 121.2(3) . . ?
N13 C36 C35 114.2(3) . . ?
C37 C36 C35 124.5(3) . . ?
C36 C37 C38 119.5(3) . . ?
C36 C37 H37 120.2 . . ?
C38 C37 H37 120.2 . . ?
C46 C38 C37 118.1(3) . . ?
C46 C38 C39 122.3(3) . . ?
C37 C38 C39 119.6(3) . . ?
C40 C39 C45 118.4(3) . . ?
C40 C39 C38 121.2(3) . . ?
C45 C39 C38 120.4(3) . . ?
C41 C40 C39 120.4(4) . . ?
C41 C40 H40 119.8 . . ?
C39 C40 H40 119.8 . . ?
C40 C41 C42 122.1(4) . . ?
C40 C41 H41 119.0 . . ?
C42 C41 H41 119.0 . . ?
C41 C42 C44 117.4(4) . . ?
C41 C42 C43 121.0(4) . . ?
C44 C42 C43 121.6(4) . . ?
C42 C43 H43A 109.5 . . ?
C42 C43 H43B 109.5 . . ?
H43A C43 H43B 109.5 . . ?
C42 C43 H43C 109.5 . . ?
H43A C43 H43C 109.5 . . ?
H43B C43 H43C 109.5 . . ?
C45 C44 C42 121.4(4) . . ?
C45 C44 H44 119.3 . . ?
C42 C44 H44 119.3 . . ?
C44 C45 C39 120.4(4) . . ?
C44 C45 H45 119.8 . . ?
C39 C45 H45 119.8 . . ?
C47 C46 C38 119.7(3) . . ?
C47 C46 H46 120.1 . . ?
C38 C46 H46 120.1 . . ?
N13 C47 C46 121.2(3) . . ?
N13 C47 C48 114.0(3) . . ?
C46 C47 C48 124.8(3) . . ?
N14 C48 C49 121.3(3) . . ?
N14 C48 C47 114.6(3) . . ?
C49 C48 C47 124.1(3) . . ?
C48 C49 C50 119.2(4) . . ?
C48 C49 H49 120.4 . . ?
C50 C49 H49 120.4 . . ?
C51 C50 C49 118.7(4) . . ?
C51 C50 H50 120.6 . . ?
C49 C50 H50 120.6 . . ?
C50 C51 C52 119.1(4) . . ?
C50 C51 H51 120.5 . . ?
C52 C51 H51 120.5 . . ?
N14 C52 C51 122.5(4) . . ?
N14 C52 H52 118.8 . . ?
C51 C52 H52 118.8 . . ?
N1 Cu1 N1 176.9(3) . 2_656 ?
N1 Cu1 Cu2 88.43(15) . . ?
N1 Cu1 Cu2 88.43(15) 2_656 . ?
C1 Cu2 C1 177.4(3) . 2_656 ?
C1 Cu2 Cu1 91.28(14) . . ?
C1 Cu2 Cu1 91.28(14) 2_656 . ?
C3 Cu3 N2 131.86(16) . . ?
C3 Cu3 C2 114.52(16) . . ?
N2 Cu3 C2 113.46(17) . . ?
C4 Cu4 N3 136.34(16) . . ?
C4 Cu4 N4 111.29(16) . . ?
N3 Cu4 N4 112.01(15) . . ?
C5 Cu5 C6 135.15(17) . . ?
C5 Cu5 N5 112.04(16) . . ?
C6 Cu5 N5 112.50(15) . . ?
C8 Cu6 N6 131.47(16) . . ?
C8 Cu6 N7 114.15(17) . . ?
N6 Cu6 N7 114.23(15) . . ?
N8 Cu7 N8 175.8(3) 2 . ?
N8 Cu7 Cu8 92.12(13) 2 5_575 ?
N8 Cu7 Cu8 92.12(13) . 5_575 ?
C7 Cu8 C7 176.9(3) . 2_554 ?
C7 Cu8 Cu7 88.43(16) . 5_575 ?
C7 Cu8 Cu7 88.43(16) 2_554 5_575 ?
N13 Cu9 N10 177.81(12) . . ?
N13 Cu9 N12 78.84(11) . . ?
N10 Cu9 N12 99.37(11) . . ?
N13 Cu9 N14 78.25(12) . . ?
N10 Cu9 N14 103.53(12) . . ?
N12 Cu9 N14 157.09(11) . . ?
N13 Cu9 N9 103.20(12) . . ?
N10 Cu9 N9 77.95(11) . . ?
N12 Cu9 N9 88.96(12) . . ?
N14 Cu9 N9 96.21(12) . . ?
N13 Cu9 N11 101.29(11) . . ?
N10 Cu9 N11 77.57(11) . . ?
N12 Cu9 N11 95.75(12) . . ?
N14 Cu9 N11 88.74(12) . . ?
N9 Cu9 N11 155.51(11) . . ?
C2 N1 Cu1 171.1(5) 5_676 . ?
C1 N2 Cu3 176.0(4) . . ?
C3 N3 Cu4 175.8(4) . . ?
C5 N4 Cu4 174.0(4) 6_576 . ?
C4 N5 Cu5 165.4(3) . . ?
C6 N6 Cu6 176.2(4) . . ?
C7 N7 Cu6 167.3(4) . . ?
C8 N8 Cu7 176.5(4) . . ?
C9 N9 C13 118.9(4) . . ?
C9 N9 Cu9 128.4(3) . . ?
C13 N9 Cu9 112.4(2) . . ?
C25 N10 C14 120.2(3) . . ?
C25 N10 Cu9 120.2(2) . . ?
C14 N10 Cu9 119.6(2) . . ?
C30 N11 C26 118.5(3) . . ?
C30 N11 Cu9 129.4(3) . . ?
C26 N11 Cu9 112.1(2) . . ?
C31 N12 C35 119.2(3) . . ?
C31 N12 Cu9 128.7(3) . . ?
C35 N12 Cu9 112.0(2) . . ?
C47 N13 C36 120.2(3) . . ?
C47 N13 Cu9 120.3(2) . . ?
C36 N13 Cu9 119.5(2) . . ?
C52 N14 C48 119.1(3) . . ?
C52 N14 Cu9 128.1(3) . . ?
C48 N14 Cu9 112.8(2) . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
C1 N2 1.144(6) . ?
C1 Cu2 1.819(4) . ?
C2 N1 1.127(6) 5_676 ?
C2 Cu3 1.939(4) . ?
C3 N3 1.158(5) . ?
C3 Cu3 1.887(4) . ?
C4 N5 1.160(5) . ?
C4 Cu4 1.893(4) . ?
C5 N4 1.157(6) 6_575 ?
C5 Cu5 1.882(5) . ?
C6 N6 1.165(5) . ?
C6 Cu5 1.887(4) . ?
C7 N7 1.153(6) . ?
C7 Cu8 1.849(4) . ?
C8 N8 1.156(6) . ?
C8 Cu6 1.877(4) . ?
C9 N9 1.338(5) . ?
C9 C10 1.382(7) . ?
C9 H9 0.9500 . ?
C10 C11 1.362(7) . ?
C10 H10 0.9500 . ?
C11 C12 1.383(6) . ?
C11 H11 0.9500 . ?
C12 C13 1.380(5) . ?
C12 H12 0.9500 . ?
C13 N9 1.344(5) . ?
C13 C14 1.484(5) . ?
C14 N10 1.357(4) . ?
C14 C15 1.381(5) . ?
C15 C16 1.395(5) . ?
C15 H15 0.9500 . ?
C16 C24 1.394(5) . ?
C16 C17 1.475(5) . ?
C17 C23 1.388(5) . ?
C17 C18 1.394(5) . ?
C18 C19 1.385(6) . ?
C18 H18 0.9500 . ?
C19 C20 1.379(6) . ?
C19 H19 0.9500 . ?
C20 C22 1.383(6) . ?
C20 C21 1.504(6) . ?
C21 H21A 0.9800 . ?
C21 H21B 0.9800 . ?
C21 H21C 0.9800 . ?
C22 C23 1.380(5) . ?
C22 H22 0.9500 . ?
C23 H23 0.9500 . ?
C24 C25 1.387(5) . ?
C24 H24 0.9500 . ?
C25 N10 1.340(4) . ?
C25 C26 1.488(5) . ?
C26 N11 1.344(4) . ?
C26 C27 1.376(5) . ?
C27 C28 1.395(6) . ?
C27 H27 0.9500 . ?
C28 C29 1.370(6) . ?
C28 H28 0.9500 . ?
C29 C30 1.367(6) . ?
C29 H29 0.9500 . ?
C30 N11 1.344(5) . ?
C30 H30 0.9500 . ?
C31 N12 1.340(5) . ?
C31 C32 1.378(6) . ?
C31 H31 0.9500 . ?
C32 C33 1.370(6) . ?
C32 H32 0.9500 . ?
C33 C34 1.385(5) . ?
C33 H33 0.9500 . ?
C34 C35 1.384(5) . ?
C34 H34 0.9500 . ?
C35 N12 1.345(4) . ?
C35 C36 1.484(5) . ?
C36 N13 1.345(4) . ?
C36 C37 1.378(5) . ?
C37 C38 1.401(5) . ?
C37 H37 0.9500 . ?
C38 C46 1.388(5) . ?
C38 C39 1.475(5) . ?
C39 C40 1.388(5) . ?
C39 C45 1.392(5) . ?
C40 C41 1.378(5) . ?
C40 H40 0.9500 . ?
C41 C42 1.383(6) . ?
C41 H41 0.9500 . ?
C42 C44 1.387(6) . ?
C42 C43 1.503(6) . ?
C43 H43A 0.9800 . ?
C43 H43B 0.9800 . ?
C43 H43C 0.9800 . ?
C44 C45 1.386(6) . ?
C44 H44 0.9500 . ?
C45 H45 0.9500 . ?
C46 C47 1.382(5) . ?
C46 H46 0.9500 . ?
C47 N13 1.341(4) . ?
C47 C48 1.491(5) . ?
C48 N14 1.346(5) . ?
C48 C49 1.386(5) . ?
C49 C50 1.386(6) . ?
C49 H49 0.9500 . ?
C50 C51 1.374(7) . ?
C50 H50 0.9500 . ?
C51 C52 1.380(7) . ?
C51 H51 0.9500 . ?
C52 N14 1.328(5) . ?
C52 H52 0.9500 . ?
Cu1 N1 1.903(5) . ?
Cu1 N1 1.903(5) 2_656 ?
Cu1 Cu2 2.9816(14) . ?
Cu2 C1 1.819(4) 2_656 ?
Cu3 N2 1.913(5) . ?
Cu4 N3 1.917(4) . ?
Cu4 N4 1.976(4) . ?
Cu5 N5 1.976(4) . ?
Cu6 N6 1.913(4) . ?
Cu6 N7 1.971(4) . ?
Cu7 N8 1.846(4) 2 ?
Cu7 N8 1.846(4) . ?
Cu7 Cu8 3.0346(14) 5_575 ?
Cu8 C7 1.849(4) 2_554 ?
Cu8 Cu7 3.0346(14) 5_575 ?
Cu9 N13 1.953(3) . ?
Cu9 N10 1.972(3) . ?
Cu9 N12 2.155(3) . ?
Cu9 N14 2.156(3) . ?
Cu9 N9 2.193(3) . ?
Cu9 N11 2.207(3) . ?
N1 C2 1.127(6) 5_676 ?
N4 C5 1.157(6) 6_576 ?
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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N9 C9 C10 C11 -1.7(8) . . . . ?
C9 C10 C11 C12 1.7(7) . . . . ?
C10 C11 C12 C13 -0.1(7) . . . . ?
C11 C12 C13 N9 -1.7(6) . . . . ?
C11 C12 C13 C14 176.6(4) . . . . ?
N9 C13 C14 N10 2.5(4) . . . . ?
C12 C13 C14 N10 -175.8(3) . . . . ?
N9 C13 C14 C15 -177.6(3) . . . . ?
C12 C13 C14 C15 4.1(6) . . . . ?
N10 C14 C15 C16 0.3(5) . . . . ?
C13 C14 C15 C16 -179.6(3) . . . . ?
C14 C15 C16 C24 2.5(5) . . . . ?
C14 C15 C16 C17 -177.4(3) . . . . ?
C24 C16 C17 C23 37.7(5) . . . . ?
C15 C16 C17 C23 -142.4(4) . . . . ?
C24 C16 C17 C18 -140.5(4) . . . . ?
C15 C16 C17 C18 39.3(5) . . . . ?
C23 C17 C18 C19 0.4(6) . . . . ?
C16 C17 C18 C19 178.7(4) . . . . ?
C17 C18 C19 C20 -0.2(6) . . . . ?
C18 C19 C20 C22 0.7(6) . . . . ?
C18 C19 C20 C21 -179.7(4) . . . . ?
C19 C20 C22 C23 -1.5(6) . . . . ?
C21 C20 C22 C23 178.8(4) . . . . ?
C20 C22 C23 C17 1.8(6) . . . . ?
C18 C17 C23 C22 -1.2(6) . . . . ?
C16 C17 C23 C22 -179.5(3) . . . . ?
C15 C16 C24 C25 -3.2(5) . . . . ?
C17 C16 C24 C25 176.7(3) . . . . ?
C16 C24 C25 N10 1.2(5) . . . . ?
C16 C24 C25 C26 -177.3(3) . . . . ?
N10 C25 C26 N11 -1.7(4) . . . . ?
C24 C25 C26 N11 177.0(3) . . . . ?
N10 C25 C26 C27 178.0(3) . . . . ?
C24 C25 C26 C27 -3.4(5) . . . . ?
N11 C26 C27 C28 -1.2(6) . . . . ?
C25 C26 C27 C28 179.2(4) . . . . ?
C26 C27 C28 C29 -0.4(6) . . . . ?
C27 C28 C29 C30 1.5(7) . . . . ?
C28 C29 C30 N11 -1.0(7) . . . . ?
N12 C31 C32 C33 -0.9(7) . . . . ?
C31 C32 C33 C34 1.1(6) . . . . ?
C32 C33 C34 C35 0.0(6) . . . . ?
C33 C34 C35 N12 -1.3(6) . . . . ?
C33 C34 C35 C36 178.2(4) . . . . ?
N12 C35 C36 N13 3.4(5) . . . . ?
C34 C35 C36 N13 -176.1(3) . . . . ?
N12 C35 C36 C37 -179.1(3) . . . . ?
C34 C35 C36 C37 1.4(6) . . . . ?
N13 C36 C37 C38 1.3(5) . . . . ?
C35 C36 C37 C38 -176.0(3) . . . . ?
C36 C37 C38 C46 -2.2(5) . . . . ?
C36 C37 C38 C39 177.0(3) . . . . ?
C46 C38 C39 C40 -142.4(4) . . . . ?
C37 C38 C39 C40 38.5(5) . . . . ?
C46 C38 C39 C45 39.3(5) . . . . ?
C37 C38 C39 C45 -139.8(4) . . . . ?
C45 C39 C40 C41 -0.4(6) . . . . ?
C38 C39 C40 C41 -178.8(4) . . . . ?
C39 C40 C41 C42 0.6(6) . . . . ?
C40 C41 C42 C44 -0.7(7) . . . . ?
C40 C41 C42 C43 178.7(4) . . . . ?
C41 C42 C44 C45 0.5(7) . . . . ?
C43 C42 C44 C45 -178.9(4) . . . . ?
C42 C44 C45 C39 -0.3(7) . . . . ?
C40 C39 C45 C44 0.2(6) . . . . ?
C38 C39 C45 C44 178.6(4) . . . . ?
C37 C38 C46 C47 1.0(5) . . . . ?
C39 C38 C46 C47 -178.1(3) . . . . ?
C38 C46 C47 N13 1.0(5) . . . . ?
C38 C46 C47 C48 -179.8(3) . . . . ?
N13 C47 C48 N14 -0.7(4) . . . . ?
C46 C47 C48 N14 -179.9(3) . . . . ?
N13 C47 C48 C49 -179.3(3) . . . . ?
C46 C47 C48 C49 1.5(6) . . . . ?
N14 C48 C49 C50 -1.6(6) . . . . ?
C47 C48 C49 C50 176.9(4) . . . . ?
C48 C49 C50 C51 0.1(6) . . . . ?
C49 C50 C51 C52 1.9(7) . . . . ?
C50 C51 C52 N14 -2.6(7) . . . . ?
N2 C1 Cu2 C1 -77(6) . . . 2_656 ?
N2 C1 Cu2 Cu1 103(6) . . . . ?
N1 Cu1 Cu2 C1 -67.58(18) . . . . ?
N1 Cu1 Cu2 C1 112.42(18) 2_656 . . . ?
N1 Cu1 Cu2 C1 112.42(18) . . . 2_656 ?
N1 Cu1 Cu2 C1 -67.58(18) 2_656 . . 2_656 ?
N3 C3 Cu3 N2 -144(8) . . . . ?
N3 C3 Cu3 C2 41(8) . . . . ?
N1 C2 Cu3 C3 59(2) 5_676 . . . ?
N1 C2 Cu3 N2 -117(2) 5_676 . . . ?
N5 C4 Cu4 N3 123.8(19) . . . . ?
N5 C4 Cu4 N4 -49(2) . . . . ?
N4 C5 Cu5 C6 -160(3) 6_575 . . . ?
N4 C5 Cu5 N5 13(4) 6_575 . . . ?
N6 C6 Cu5 C5 74(4) . . . . ?
N6 C6 Cu5 N5 -99(4) . . . . ?
N8 C8 Cu6 N6 155(9) . . . . ?
N8 C8 Cu6 N7 -21(10) . . . . ?
N7 C7 Cu8 C7 -9(3) . . . 2_554 ?
N7 C7 Cu8 Cu7 -9(3) . . . 5_575 ?
N1 Cu1 N1 C2 -13(3) 2_656 . . 5_676 ?
Cu2 Cu1 N1 C2 -13(3) . . . 5_676 ?
Cu2 C1 N2 Cu3 -33(11) . . . . ?
C3 Cu3 N2 C1 -133(6) . . . . ?
C2 Cu3 N2 C1 42(6) . . . . ?
Cu3 C3 N3 Cu4 55(11) . . . . ?
C4 Cu4 N3 C3 -108(5) . . . . ?
N4 Cu4 N3 C3 64(5) . . . . ?
C4 Cu4 N4 C5 118(4) . . . 6_576 ?
N3 Cu4 N4 C5 -56(4) . . . 6_576 ?
Cu4 C4 N5 Cu5 -36(3) . . . . ?
C5 Cu5 N5 C4 -97.6(13) . . . . ?
C6 Cu5 N5 C4 77.1(13) . . . . ?
Cu5 C6 N6 Cu6 -43(9) . . . . ?
C8 Cu6 N6 C6 153(5) . . . . ?
N7 Cu6 N6 C6 -32(6) . . . . ?
Cu8 C7 N7 Cu6 -5(4) . . . . ?
C8 Cu6 N7 C7 111.1(18) . . . . ?
N6 Cu6 N7 C7 -65.1(18) . . . . ?
Cu6 C8 N8 Cu7 32(15) . . . . ?
N8 Cu7 N8 C8 55(7) 2 . . . ?
Cu8 Cu7 N8 C8 -125(7) 5_575 . . . ?
C10 C9 N9 C13 -0.1(7) . . . . ?
C10 C9 N9 Cu9 -173.1(4) . . . . ?
C12 C13 N9 C9 1.7(6) . . . . ?
C14 C13 N9 C9 -176.6(4) . . . . ?
C12 C13 N9 Cu9 175.9(3) . . . . ?
C14 C13 N9 Cu9 -2.5(4) . . . . ?
N13 Cu9 N9 C9 -3.2(4) . . . . ?
N10 Cu9 N9 C9 174.9(4) . . . . ?
N12 Cu9 N9 C9 75.1(4) . . . . ?
N14 Cu9 N9 C9 -82.5(4) . . . . ?
N11 Cu9 N9 C9 176.8(3) . . . . ?
N13 Cu9 N9 C13 -176.6(2) . . . . ?
N10 Cu9 N9 C13 1.5(2) . . . . ?
N12 Cu9 N9 C13 -98.3(3) . . . . ?
N14 Cu9 N9 C13 104.0(3) . . . . ?
N11 Cu9 N9 C13 3.3(5) . . . . ?
C24 C25 N10 C14 1.7(5) . . . . ?
C26 C25 N10 C14 -179.6(3) . . . . ?
C24 C25 N10 Cu9 -179.7(2) . . . . ?
C26 C25 N10 Cu9 -1.0(4) . . . . ?
C15 C14 N10 C25 -2.5(5) . . . . ?
C13 C14 N10 C25 177.4(3) . . . . ?
C15 C14 N10 Cu9 178.9(2) . . . . ?
C13 C14 N10 Cu9 -1.2(4) . . . . ?
N13 Cu9 N10 C25 -57(3) . . . . ?
N12 Cu9 N10 C25 -91.8(3) . . . . ?
N14 Cu9 N10 C25 87.7(3) . . . . ?
N9 Cu9 N10 C25 -178.7(3) . . . . ?
N11 Cu9 N10 C25 2.1(2) . . . . ?
N13 Cu9 N10 C14 122(3) . . . . ?
N12 Cu9 N10 C14 86.8(3) . . . . ?
N14 Cu9 N10 C14 -93.7(3) . . . . ?
N9 Cu9 N10 C14 -0.1(2) . . . . ?
N11 Cu9 N10 C14 -179.3(3) . . . . ?
C29 C30 N11 C26 -0.5(6) . . . . ?
C29 C30 N11 Cu9 177.3(3) . . . . ?
C27 C26 N11 C30 1.6(5) . . . . ?
C25 C26 N11 C30 -178.7(3) . . . . ?
C27 C26 N11 Cu9 -176.5(3) . . . . ?
C25 C26 N11 Cu9 3.1(4) . . . . ?
N13 Cu9 N11 C30 -2.7(3) . . . . ?
N10 Cu9 N11 C30 179.2(3) . . . . ?
N12 Cu9 N11 C30 -82.4(3) . . . . ?
N14 Cu9 N11 C30 75.1(3) . . . . ?
N9 Cu9 N11 C30 177.4(3) . . . . ?
N13 Cu9 N11 C26 175.3(2) . . . . ?
N10 Cu9 N11 C26 -2.8(2) . . . . ?
N12 Cu9 N11 C26 95.5(2) . . . . ?
N14 Cu9 N11 C26 -107.0(2) . . . . ?
N9 Cu9 N11 C26 -4.7(4) . . . . ?
C32 C31 N12 C35 -0.3(6) . . . . ?
C32 C31 N12 Cu9 -175.5(3) . . . . ?
C34 C35 N12 C31 1.4(6) . . . . ?
C36 C35 N12 C31 -178.1(3) . . . . ?
C34 C35 N12 Cu9 177.4(3) . . . . ?
C36 C35 N12 Cu9 -2.1(4) . . . . ?
N13 Cu9 N12 C31 175.9(4) . . . . ?
N10 Cu9 N12 C31 -5.4(4) . . . . ?
N14 Cu9 N12 C31 175.8(3) . . . . ?
N9 Cu9 N12 C31 72.2(4) . . . . ?
N11 Cu9 N12 C31 -83.7(4) . . . . ?
N13 Cu9 N12 C35 0.4(2) . . . . ?
N10 Cu9 N12 C35 179.2(2) . . . . ?
N14 Cu9 N12 C35 0.4(5) . . . . ?
N9 Cu9 N12 C35 -103.2(3) . . . . ?
N11 Cu9 N12 C35 100.8(3) . . . . ?
C46 C47 N13 C36 -2.0(5) . . . . ?
C48 C47 N13 C36 178.8(3) . . . . ?
C46 C47 N13 Cu9 179.6(2) . . . . ?
C48 C47 N13 Cu9 0.4(4) . . . . ?
C37 C36 N13 C47 0.8(5) . . . . ?
C35 C36 N13 C47 178.4(3) . . . . ?
C37 C36 N13 Cu9 179.2(3) . . . . ?
C35 C36 N13 Cu9 -3.2(4) . . . . ?
N10 Cu9 N13 C47 145(3) . . . . ?
N12 Cu9 N13 C47 -180.0(3) . . . . ?
N14 Cu9 N13 C47 0.0(3) . . . . ?
N9 Cu9 N13 C47 -93.7(3) . . . . ?
N11 Cu9 N13 C47 86.3(3) . . . . ?
N10 Cu9 N13 C36 -34(3) . . . . ?
N12 Cu9 N13 C36 1.6(3) . . . . ?
N14 Cu9 N13 C36 -178.4(3) . . . . ?
N9 Cu9 N13 C36 87.8(3) . . . . ?
N11 Cu9 N13 C36 -92.1(3) . . . . ?
C51 C52 N14 C48 1.0(7) . . . . ?
C51 C52 N14 Cu9 -176.9(3) . . . . ?
C49 C48 N14 C52 1.1(6) . . . . ?
C47 C48 N14 C52 -177.6(4) . . . . ?
C49 C48 N14 Cu9 179.4(3) . . . . ?
C47 C48 N14 Cu9 0.7(4) . . . . ?
N13 Cu9 N14 C52 177.7(4) . . . . ?
N10 Cu9 N14 C52 -1.0(4) . . . . ?
N12 Cu9 N14 C52 177.7(3) . . . . ?
N9 Cu9 N14 C52 -80.1(4) . . . . ?
N11 Cu9 N14 C52 75.9(4) . . . . ?
N13 Cu9 N14 C48 -0.4(2) . . . . ?
N10 Cu9 N14 C48 -179.1(2) . . . . ?
N12 Cu9 N14 C48 -0.3(5) . . . . ?
N9 Cu9 N14 C48 101.8(3) . . . . ?
N11 Cu9 N14 C48 -102.2(3) . . . . ?
