# Electronic Supplementary Material (ESI) for CrystEngComm
# This journal is © The Royal Society of Chemistry 2013

#######################################################################
#
#                 Cambridge Crystallographic Data Centre
#                                CCDC 
# 
#######################################################################
# 
#  This CIF contains data from an original supplementary publication
#  deposited with the CCDC, and may include chemical, crystal,
#  experimental, refinement, atomic coordinates,
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted.
#
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#  fide research purposes only. It may contain copyright material
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data_1

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C12 H15 N15 O15 Zn9'
_chemical_formula_weight         1197.72

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'
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'
Zn Zn 0.2839 1.4301 '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'

_symmetry_cell_setting           trigonal
_symmetry_space_group_name_H-M   P-3

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'-x, -y, -z'
'y, -x+y, -z'
'x-y, x, -z'

_cell_length_a                   13.9309(4)
_cell_length_b                   13.9309(4)
_cell_length_c                   27.6863(12)
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_volume                     4653.2(3)
_cell_formula_units_Z            6
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    4593
_cell_measurement_theta_min      2.9185
_cell_measurement_theta_max      26.2882

_exptl_crystal_description       block
_exptl_crystal_colour            colorless
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.20
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    2.564
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             3492
_exptl_absorpt_coefficient_mu    6.920
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.3113
_exptl_absorpt_correction_T_max  0.3382
_exptl_absorpt_process_details   '(SADABS; Sheldrick, 1996)'

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Bruker SMART CCD area-detector'
_diffrn_measurement_method       '\f and \w scans'
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            12471
_diffrn_reflns_av_R_equivalents  0.0332
_diffrn_reflns_av_sigmaI/netI    0.0376
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_l_min       -32
_diffrn_reflns_limit_l_max       32
_diffrn_reflns_theta_min         2.92
_diffrn_reflns_theta_max         25.00
_reflns_number_total             5474
_reflns_number_gt                2913
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       'SMART (Bruker, 2007)'
_computing_cell_refinement       'SAINT (Bruker, 2007)'
_computing_data_reduction        SAINT
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_molecular_graphics    'SHELXTL (Sheldrick, 2008)'
_computing_publication_material  'SHELXTL and PLATON (Spek, 2009)'

_refine_special_details          
; 
 Refinement of F^2^ against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F^2^, conventional R-factors R are based 
 on F, with F set to zero for negative F^2^. The threshold expression of 
 F^2^ > 2sigma(F^2^) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F^2^ are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[\s^2^(Fo^2^)+(0.1190P)^2^+48.9662P] where P=(Fo^2^+2Fc^2^)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         5474
_refine_ls_number_parameters     461
_refine_ls_number_restraints     205
_refine_ls_R_factor_all          0.0879
_refine_ls_R_factor_gt           0.0557
_refine_ls_wR_factor_ref         0.2221
_refine_ls_wR_factor_gt          0.1875
_refine_ls_goodness_of_fit_ref   1.052
_refine_ls_restrained_S_all      1.033
_refine_ls_shift/su_max          0.004
_refine_ls_shift/su_mean         0.001

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
Zn1 Zn 0.33145(13) 0.99364(13) 1.05273(4) 0.0161(3) Uani 1 1 d . . 1
Zn2 Zn 0.26181(11) 0.86204(11) 0.93673(5) 0.0135(3) Uani 1 1 d . . 1
Zn3 Zn 0.40610(11) 1.12697(11) 0.93680(5) 0.0140(3) Uani 1 1 d . . 1
Zn4 Zn 0.32981(13) 1.00376(13) 0.71920(4) 0.0147(3) Uani 1 1 d . . 1
Zn5 Zn 0.52884(11) 0.93382(11) 0.72996(5) 0.0134(3) Uani 1 1 d . . 1
Zn6 Zn 0.79375(11) 1.05441(12) 0.73009(5) 0.0141(3) Uani 1 1 d . . 1
Zn7 Zn 0.66137(13) 0.99708(15) 0.61428(4) 0.0160(3) Uani 1 1 d . . 1
Zn8 Zn 0.38749(11) 0.92718(11) 0.60320(5) 0.0141(3) Uani 1 1 d . . 1
Zn9 Zn 0.26710(11) 1.07133(11) 0.60333(6) 0.0144(4) Uani 1 1 d . . 1
O1 O 0.3897(6) 0.8752(6) 1.0591(3) 0.0105(6) Uani 1 1 d U . 1
O2 O 0.5197(6) 1.1218(6) 1.0584(3) 0.0113(10) Uani 1 1 d U . 1
O3 O 0.2722(6) 0.8167(7) 0.7246(3) 0.017(2) Uani 1 1 d . A 1
O4 O 0.7902(6) 0.8482(7) 0.7247(4) 0.018(2) Uani 1 1 d . . 1
O5 O 0.5425(6) 0.8181(7) 0.6085(4) 0.021(2) Uani 1 1 d . B 1
O6 O 0.0621(7) 0.8504(7) 0.6106(4) 0.025(2) Uani 1 1 d . C 1
O7 O 0.3646(6) 0.9936(7) 0.9795(3) 0.0162(10) Uani 1 1 d U . 1
H7 H 0.4328 0.9895 0.9797 0.019 Uiso 1 1 calc R . 1
O8 O 0.6611(6) 0.9615(6) 0.6891(2) 0.0099(16) Uani 1 1 d U D 1
H8 H 0.6571 0.8892 0.6889 0.012 Uiso 1 1 calc R D 1
O9 O 0.2953(6) 0.9690(6) 0.6434(2) 0.0112(10) Uani 1 1 d U E 1
H9 H 0.2229 0.9009 0.6435 0.013 Uiso 1 1 calc R E 1
O10 O 0.1149(7) 0.8241(8) 0.9523(3) 0.024(2) Uani 1 1 d . F 1
H10A H 0.0946 0.8678 0.9319 0.029 Uiso 1 1 d R F 1
O11 O 0.2964(6) 1.1681(6) 0.9486(3) 0.0130(10) Uani 1 1 d U . 1
H11A H 0.2658 1.1397 0.9804 0.016 Uiso 1 1 d R . 1
O12 O 0.4927(7) 1.0457(8) 0.7109(3) 0.0205(10) Uani 1 1 d U G 1
H12B H 0.5377 1.1116 0.7300 0.025 Uiso 1 1 d R G 1
O13 O 0.8350(7) 1.2048(7) 0.7151(4) 0.021(2) Uani 1 1 d . H 1
H13B H 0.8103 1.2052 0.6824 0.025 Uiso 1 1 d R H 1
O14 O 0.5397(7) 1.0376(7) 0.6192(3) 0.021(2) Uani 1 1 d . I 1
H14A H 0.5401 1.0622 0.6520 0.025 Uiso 1 1 d R I 1
O15 O 0.3761(6) 1.2198(6) 0.6228(3) 0.0112(19) Uani 1 1 d . . 1
H15A H 0.4438 1.2418 0.6048 0.013 Uiso 1 1 d R . 1
N1 N 0.3321(8) 0.9988(9) 1.1287(3) 0.0167(10) Uani 1 1 d U . 1
N2 N 0.3939(8) 1.0285(9) 1.2041(3) 0.020(2) Uani 1 1 d . . 1
N3 N 0.2820(7) 0.9870(8) 1.2043(3) 0.0125(10) Uani 1 1 d U . 1
N4 N 0.3390(9) 0.9930(9) 0.7953(3) 0.0154(10) Uani 1 1 d U J 1
N5 N 0.3017(8) 0.9373(9) 0.8719(4) 0.0190(11) Uani 1 1 d U J 1
N6 N 0.3705(8) 1.0498(9) 0.8713(4) 0.0174(10) Uani 1 1 d U J 1
N7 N 0.6691(9) 0.9944(10) 0.5385(3) 0.0177(5) Uani 1 1 d U K 1
N8 N 0.6968(8) 0.9675(8) 0.4633(4) 0.0179(5) Uani 1 1 d U . 1
N9 N 0.6544(9) 1.0394(8) 0.4617(4) 0.0176(5) Uani 1 1 d U . 1
N10 N 0.4455(7) 0.7498(8) 1.0597(4) 0.0108(6) Uani 1 1 d U . 1
N11 N 0.7002(7) 1.2554(8) 1.0595(4) 0.0110(10) Uani 1 1 d U . 1
N12 N 0.4127(7) 0.7788(8) 0.7253(4) 0.0109(10) Uani 1 1 d U . 1
N13 N 0.9211(7) 1.0312(8) 0.7253(4) 0.015(2) Uani 1 1 d . . 1
N14 N 0.3611(8) 0.7743(8) 0.6081(4) 0.0141(10) Uani 1 1 d U L 1
N15 N 0.1108(9) 1.0329(9) 0.6090(4) 0.0195(10) Uani 1 1 d U M 1
C1 C 0.4244(11) 1.0381(11) 1.1599(4) 0.023(3) Uani 1 1 d U . 1
H1 H 0.4973 1.0671 1.1497 0.028 Uiso 1 1 calc R . 1
C2 C 0.2531(10) 0.9773(9) 1.1593(4) 0.0164(11) Uani 1 1 d U . 1
H2 H 0.1814 0.9566 1.1496 0.020 Uiso 1 1 calc R . 1
C3 C 0.2805(10) 0.9091(10) 0.8257(5) 0.0174(11) Uani 1 1 d U J 1
H3 H 0.2298 0.8378 0.8155 0.021 Uiso 1 1 calc R J 1
C4 C 0.3877(10) 1.0806(11) 0.8265(5) 0.0189(11) Uani 1 1 d U J 1
H4 H 0.4287 1.1542 0.8167 0.023 Uiso 1 1 calc R J 1
C5 C 0.7023(10) 0.9451(11) 0.5096(5) 0.0180(5) Uani 1 1 d U K 1
H5 H 0.7278 0.8983 0.5199 0.022 Uiso 1 1 calc R K 1
C6 C 0.6413(10) 1.0557(10) 0.5090(4) 0.0176(5) Uani 1 1 d U K 1
H6 H 0.6165 1.1026 0.5200 0.021 Uiso 1 1 calc R K 1
C7 C 0.3637(9) 0.7764(9) 1.0591(4) 0.0101(7) Uani 1 1 d U . 1
C8 C 0.5898(8) 1.2263(8) 1.0588(4) 0.0032(10) Uani 1 1 d U . 1
C9 C 0.3004(10) 0.7433(10) 0.7238(4) 0.0132(11) Uani 1 1 d U A 1
C10 C 0.8912(10) 0.9196(10) 0.7260(4) 0.015(3) Uani 1 1 d . N 1
C11 C 0.4406(9) 0.7456(10) 0.6088(4) 0.0113(11) Uani 1 1 d U . 1
C12 C 0.0341(10) 0.9224(11) 0.6086(5) 0.0186(11) Uani 1 1 d U . 1

loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_23
_atom_site_aniso_U_13
_atom_site_aniso_U_12
Zn1 0.0286(6) 0.0177(6) 0.0030(5) -0.0017(6) -0.0013(6) 0.0125(6)
Zn2 0.0178(6) 0.0152(6) 0.0057(6) 0.0001(5) 0.0001(6) 0.0070(5)
Zn3 0.0164(6) 0.0145(6) 0.0060(6) -0.0004(6) 0.0007(6) 0.0040(5)
Zn4 0.0151(6) 0.0199(7) 0.0120(6) 0.0013(7) 0.0024(6) 0.0109(6)
Zn5 0.0102(6) 0.0118(6) 0.0156(7) 0.0007(6) -0.0009(6) 0.0036(5)
Zn6 0.0107(6) 0.0178(7) 0.0149(7) 0.0012(6) 0.0019(6) 0.0080(5)
Zn7 0.0119(6) 0.0187(7) 0.0170(6) 0.0025(8) 0.0006(7) 0.0073(6)
Zn8 0.0156(6) 0.0120(6) 0.0177(7) -0.0007(6) -0.0017(6) 0.0092(5)
Zn9 0.0106(6) 0.0133(6) 0.0203(8) -0.0037(6) 0.0002(7) 0.0066(5)
O1 0.0108(9) 0.0104(6) 0.0096(11) -0.0004(8) 0.0005(8) 0.0049(6)
O2 0.0115(11) 0.0114(11) 0.0106(12) -0.0001(8) 0.0001(8) 0.0054(7)
O3 0.018(4) 0.020(4) 0.020(4) -0.010(4) -0.006(4) 0.014(3)
O4 0.010(3) 0.012(4) 0.034(5) -0.007(4) -0.002(4) 0.006(3)
O5 0.007(4) 0.010(4) 0.039(5) 0.006(4) 0.001(4) -0.001(3)
O6 0.016(4) 0.016(4) 0.048(6) 0.006(4) -0.004(4) 0.010(3)
O7 0.0163(11) 0.0163(11) 0.0157(12) 0.0000(8) -0.0001(8) 0.0079(7)
O8 0.009(3) 0.019(3) 0.003(3) 0.002(3) 0.002(3) 0.008(2)
O9 0.0114(11) 0.0113(11) 0.0113(12) 0.0002(8) 0.0003(8) 0.0059(7)
O10 0.026(4) 0.023(4) 0.019(4) 0.008(4) 0.008(4) 0.009(4)
O11 0.0131(11) 0.0131(11) 0.0125(12) 0.0001(8) -0.0003(8) 0.0063(7)
O12 0.0207(12) 0.0204(12) 0.0207(13) -0.0005(8) 0.0002(8) 0.0105(7)
O13 0.021(4) 0.013(4) 0.030(5) 0.004(4) -0.001(4) 0.009(3)
O14 0.025(4) 0.030(5) 0.014(4) 0.008(4) 0.008(4) 0.019(3)
O15 0.006(3) 0.007(3) 0.014(4) 0.006(3) 0.002(3) -0.002(3)
N1 0.0167(12) 0.0168(12) 0.0161(12) -0.0001(8) 0.0002(8) 0.0081(7)
N2 0.015(4) 0.037(6) 0.008(4) 0.002(4) -0.001(4) 0.013(4)
N3 0.0122(12) 0.0128(12) 0.0122(12) 0.0004(8) -0.0003(8) 0.0059(7)
N4 0.0157(12) 0.0151(12) 0.0151(12) -0.0001(8) -0.0002(8) 0.0075(7)
N5 0.0192(12) 0.0190(12) 0.0185(13) 0.0002(8) -0.0002(8) 0.0092(7)
N6 0.0176(12) 0.0172(12) 0.0169(13) 0.0000(8) 0.0002(8) 0.0084(7)
N7 0.0177(9) 0.0176(8) 0.0179(6) 0.0002(5) -0.0002(6) 0.0090(6)
N8 0.0179(8) 0.0178(8) 0.0179(6) 0.0000(6) 0.0000(7) 0.0090(6)
N9 0.0178(9) 0.0177(8) 0.0176(7) -0.0003(6) 0.0000(7) 0.0090(6)
N10 0.0107(8) 0.0112(8) 0.0104(11) -0.0003(8) 0.0006(8) 0.0054(6)
N11 0.0110(12) 0.0112(12) 0.0106(12) -0.0002(8) 0.0009(8) 0.0055(7)
N12 0.0109(12) 0.0109(12) 0.0114(12) 0.0005(8) -0.0005(8) 0.0057(7)
N13 0.010(4) 0.016(4) 0.020(5) 0.005(4) 0.002(4) 0.009(3)
N14 0.0142(12) 0.0141(12) 0.0143(13) 0.0000(8) -0.0001(8) 0.0072(7)
N15 0.0193(12) 0.0194(12) 0.0199(13) -0.0006(8) 0.0004(8) 0.0098(7)
C1 0.019(5) 0.033(5) 0.011(5) 0.001(4) -0.002(4) 0.008(4)
C2 0.0164(12) 0.0166(12) 0.0160(13) -0.0001(8) 0.0001(8) 0.0080(7)
C3 0.0174(12) 0.0173(12) 0.0169(13) -0.0002(9) 0.0000(9) 0.0083(8)
C4 0.0190(12) 0.0189(12) 0.0184(13) 0.0001(9) -0.0002(9) 0.0092(8)
C5 0.0181(7) 0.0180(6) 0.0180(7) 0.0000(5) -0.0001(5) 0.0091(5)
C6 0.0178(9) 0.0177(8) 0.0173(8) 0.0002(6) 0.0000(7) 0.0089(6)
C7 0.0101(9) 0.0104(7) 0.0094(11) -0.0001(8) 0.0001(9) 0.0049(6)
C8 0.0027(12) 0.0036(12) 0.0028(12) -0.0002(8) 0.0005(8) 0.0012(7)
C9 0.0133(12) 0.0132(12) 0.0131(13) -0.0002(8) -0.0002(8) 0.0065(7)
C10 0.023(6) 0.008(5) 0.010(5) -0.004(4) 0.000(5) 0.004(4)
C11 0.0116(12) 0.0111(12) 0.0113(13) 0.0000(9) -0.0002(9) 0.0058(8)
C12 0.0188(12) 0.0183(12) 0.0188(13) -0.0003(9) 0.0000(9) 0.0093(8)

_geom_special_details            
; 
 All esds (except the esd in the dihedral angle between two l.s. planes) 
 are estimated using the full covariance matrix.  The cell esds are taken 
 into account individually in the estimation of esds in distances, angles 
 and torsion angles; correlations between esds in cell parameters are only 
 used when they are defined by crystal symmetry.  An approximate (isotropic) 
 treatment of cell esds is used for estimating esds involving l.s. planes. 
;

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
Zn1 O10 2.037(9) 6_667 ?
Zn1 O11 2.050(8) 5_457 ?
Zn1 O7 2.080(7) . ?
Zn1 N1 2.105(9) . ?
Zn1 O1 2.179(9) . ?
Zn1 O2 2.326(7) . ?
Zn2 O10 1.891(10) . ?
Zn2 N11 1.958(10) 4_677 ?
Zn2 N5 2.013(11) . ?
Zn2 O7 2.046(8) . ?
Zn3 O11 1.909(9) . ?
Zn3 N10 1.919(9) 4_677 ?
Zn3 O7 2.027(8) . ?
Zn3 N6 2.039(11) . ?
Zn4 O13 2.029(8) 3_575 ?
Zn4 O12 2.055(9) . ?
Zn4 N4 2.121(9) . ?
Zn4 O9 2.154(7) . ?
Zn4 O4 2.186(8) 2_665 ?
Zn4 O3 2.317(9) . ?
Zn5 O12 1.935(10) . ?
Zn5 N12 1.950(9) . ?
Zn5 O8 2.029(7) . ?
Zn5 N2 2.050(10) 4_677 ?
Zn6 O13 1.920(9) . ?
Zn6 N13 1.960(10) . ?
Zn6 O8 1.997(7) . ?
Zn6 N3 2.033(9) 4_677 ?
Zn7 O15 2.011(9) 2_775 ?
Zn7 O14 2.042(9) . ?
Zn7 N7 2.103(9) . ?
Zn7 O8 2.128(7) . ?
Zn7 O5 2.203(8) . ?
Zn7 O6 2.296(9) 3_565 ?
Zn8 O14 1.949(9) . ?
Zn8 N14 1.977(11) . ?
Zn8 O9 1.994(8) . ?
Zn8 N9 2.014(11) 4_676 ?
Zn9 O15 1.932(8) . ?
Zn9 N15 1.971(11) . ?
Zn9 O9 1.993(8) . ?
Zn9 N8 2.054(10) 4_676 ?
O1 C7 1.236(14) . ?
O2 C8 1.286(12) . ?
O3 C9 1.265(16) . ?
O4 C10 1.254(14) . ?
O4 Zn4 2.186(8) 3_565 ?
O5 C11 1.266(13) . ?
O6 C12 1.246(17) . ?
O6 Zn7 2.296(9) 2_665 ?
O7 H7 0.9800 . ?
O8 H8 0.9800 . ?
O9 H9 0.9800 . ?
O10 Zn1 2.037(9) 5_457 ?
O10 H10A 0.9700 . ?
O11 Zn1 2.050(8) 6_667 ?
O11 H11A 0.9700 . ?
O12 H12B 0.9700 . ?
O13 Zn4 2.029(8) 2_775 ?
O13 H13B 0.9700 . ?
O14 H14A 0.9700 . ?
O15 Zn7 2.011(9) 3_575 ?
O15 H15A 0.9700 . ?
N1 C2 1.299(15) . ?
N1 C1 1.411(16) . ?
N2 C1 1.281(15) . ?
N2 N3 1.364(13) . ?
N2 Zn5 2.050(10) 4_677 ?
N3 C2 1.297(14) . ?
N3 Zn6 2.033(9) 4_677 ?
N4 C3 1.336(15) . ?
N4 C4 1.367(16) . ?
N5 C3 1.326(17) . ?
N5 N6 1.368(13) . ?
N6 C4 1.295(17) . ?
N7 C5 1.282(17) . ?
N7 C6 1.371(17) . ?
N8 C5 1.330(16) . ?
N8 N9 1.395(14) . ?
N8 Zn9 2.054(10) 4_676 ?
N9 C6 1.356(16) . ?
N9 Zn8 2.014(11) 4_676 ?
N10 C7 1.364(16) . ?
N10 C7 1.409(14) 3_565 ?
N10 Zn3 1.919(9) 4_677 ?
N11 C8 1.332(14) 2_775 ?
N11 C8 1.381(14) . ?
N11 Zn2 1.958(10) 4_677 ?
N12 C9 1.364(15) 3_565 ?
N12 C9 1.386(15) . ?
N13 C10 1.337(17) 3_675 ?
N13 C10 1.395(16) . ?
N14 C11 1.338(15) 2_665 ?
N14 C11 1.351(17) . ?
N15 C12 1.367(16) . ?
N15 C12 1.389(17) 2_675 ?
C1 H1 0.9300 . ?
C2 H2 0.9300 . ?
C3 H3 0.9300 . ?
C4 H4 0.9300 . ?
C5 H5 0.9300 . ?
C6 H6 0.9300 . ?
C7 N10 1.409(14) 2_665 ?
C8 N11 1.332(14) 3_575 ?
C9 N12 1.364(16) 2_665 ?
C10 N13 1.337(16) 2_765 ?
C11 N14 1.338(15) 3_565 ?
C12 N15 1.389(17) 3_465 ?

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
O10 Zn1 O11 91.8(4) 6_667 5_457 ?
O10 Zn1 O7 95.0(4) 6_667 . ?
O11 Zn1 O7 97.8(3) 5_457 . ?
O10 Zn1 N1 92.2(4) 6_667 . ?
O11 Zn1 N1 91.8(4) 5_457 . ?
O7 Zn1 N1 167.8(4) . . ?
O10 Zn1 O1 175.1(4) 6_667 . ?
O11 Zn1 O1 93.1(3) 5_457 . ?
O7 Zn1 O1 85.0(3) . . ?
N1 Zn1 O1 87.0(4) . . ?
O10 Zn1 O2 92.5(4) 6_667 . ?
O11 Zn1 O2 175.0(3) 5_457 . ?
O7 Zn1 O2 84.3(3) . . ?
N1 Zn1 O2 85.5(4) . . ?
O1 Zn1 O2 82.6(3) . . ?
O10 Zn2 N11 117.5(4) . 4_677 ?
O10 Zn2 N5 109.1(4) . . ?
N11 Zn2 N5 111.3(4) 4_677 . ?
O10 Zn2 O7 107.1(4) . . ?
N11 Zn2 O7 111.0(4) 4_677 . ?
N5 Zn2 O7 99.3(4) . . ?
O11 Zn3 N10 112.9(4) . 4_677 ?
O11 Zn3 O7 105.7(3) . . ?
N10 Zn3 O7 118.4(4) 4_677 . ?
O11 Zn3 N6 106.9(4) . . ?
N10 Zn3 N6 112.7(4) 4_677 . ?
O7 Zn3 N6 98.8(4) . . ?
O13 Zn4 O12 91.5(4) 3_575 . ?
O13 Zn4 N4 98.1(4) 3_575 . ?
O12 Zn4 N4 92.0(4) . . ?
O13 Zn4 O9 95.8(4) 3_575 . ?
O12 Zn4 O9 92.6(3) . . ?
N4 Zn4 O9 165.2(4) . . ?
O13 Zn4 O4 94.0(4) 3_575 2_665 ?
O12 Zn4 O4 173.9(4) . 2_665 ?
N4 Zn4 O4 90.0(4) . 2_665 ?
O9 Zn4 O4 84.1(3) . 2_665 ?
O13 Zn4 O3 176.3(3) 3_575 . ?
O12 Zn4 O3 92.2(3) . . ?
N4 Zn4 O3 81.7(4) . . ?
O9 Zn4 O3 84.1(3) . . ?
O4 Zn4 O3 82.3(3) 2_665 . ?
O12 Zn5 N12 117.9(4) . . ?
O12 Zn5 O8 105.8(3) . . ?
N12 Zn5 O8 110.2(4) . . ?
O12 Zn5 N2 110.6(4) . 4_677 ?
N12 Zn5 N2 112.4(4) . 4_677 ?
O8 Zn5 N2 97.9(3) . 4_677 ?
O13 Zn6 N13 111.3(4) . . ?
O13 Zn6 O8 105.0(4) . . ?
N13 Zn6 O8 118.3(4) . . ?
O13 Zn6 N3 109.4(4) . 4_677 ?
N13 Zn6 N3 113.5(4) . 4_677 ?
O8 Zn6 N3 98.2(3) . 4_677 ?
O15 Zn7 O14 91.5(3) 2_775 . ?
O15 Zn7 N7 96.6(4) 2_775 . ?
O14 Zn7 N7 97.4(4) . . ?
O15 Zn7 O8 92.7(3) 2_775 . ?
O14 Zn7 O8 95.4(3) . . ?
N7 Zn7 O8 163.9(4) . . ?
O15 Zn7 O5 174.3(3) 2_775 . ?
O14 Zn7 O5 93.4(4) . . ?
N7 Zn7 O5 85.6(4) . . ?
O8 Zn7 O5 83.9(3) . . ?
O15 Zn7 O6 92.6(3) 2_775 3_565 ?
O14 Zn7 O6 175.6(4) . 3_565 ?
N7 Zn7 O6 83.9(4) . 3_565 ?
O8 Zn7 O6 82.6(4) . 3_565 ?
O5 Zn7 O6 82.4(3) . 3_565 ?
O14 Zn8 N14 112.2(4) . . ?
O14 Zn8 O9 104.4(3) . . ?
N14 Zn8 O9 118.5(4) . . ?
O14 Zn8 N9 110.3(4) . 4_676 ?
N14 Zn8 N9 113.1(4) . 4_676 ?
O9 Zn8 N9 97.3(4) . 4_676 ?
O15 Zn9 N15 116.0(4) . . ?
O15 Zn9 O9 106.3(3) . . ?
N15 Zn9 O9 110.3(4) . . ?
O15 Zn9 N8 111.5(4) . 4_676 ?
N15 Zn9 N8 112.5(4) . 4_676 ?
O9 Zn9 N8 98.6(4) . 4_676 ?
C7 O1 Zn1 146.1(7) . . ?
C8 O2 Zn1 142.7(7) . . ?
C9 O3 Zn4 146.6(7) . . ?
C10 O4 Zn4 143.4(9) . 3_565 ?
C11 O5 Zn7 144.2(9) . . ?
C12 O6 Zn7 146.1(8) . 2_665 ?
Zn3 O7 Zn2 103.6(3) . . ?
Zn3 O7 Zn1 122.0(4) . . ?
Zn2 O7 Zn1 120.6(4) . . ?
Zn3 O7 H7 102.5 . . ?
Zn2 O7 H7 102.5 . . ?
Zn1 O7 H7 102.5 . . ?
Zn6 O8 Zn5 105.3(3) . . ?
Zn6 O8 Zn7 120.6(3) . . ?
Zn5 O8 Zn7 118.9(4) . . ?
Zn6 O8 H8 103.2 . . ?
Zn5 O8 H8 103.2 . . ?
Zn7 O8 H8 103.2 . . ?
Zn9 O9 Zn8 106.5(3) . . ?
Zn9 O9 Zn4 118.9(4) . . ?
Zn8 O9 Zn4 120.3(4) . . ?
Zn9 O9 H9 102.7 . . ?
Zn8 O9 H9 102.7 . . ?
Zn4 O9 H9 102.7 . . ?
Zn2 O10 Zn1 118.4(5) . 5_457 ?
Zn2 O10 H10A 107.8 . . ?
Zn1 O10 H10A 108.3 5_457 . ?
Zn3 O11 Zn1 120.5(4) . 6_667 ?
Zn3 O11 H11A 106.7 . . ?
Zn1 O11 H11A 107.0 6_667 . ?
Zn5 O12 Zn4 115.8(4) . . ?
Zn5 O12 H12B 107.9 . . ?
Zn4 O12 H12B 107.8 . . ?
Zn6 O13 Zn4 119.9(5) . 2_775 ?
Zn6 O13 H13B 107.1 . . ?
Zn4 O13 H13B 107.2 2_775 . ?
Zn8 O14 Zn7 119.5(5) . . ?
Zn8 O14 H14A 107.7 . . ?
Zn7 O14 H14A 107.5 . . ?
Zn9 O15 Zn7 117.0(4) . 3_575 ?
Zn9 O15 H15A 108.3 . . ?
Zn7 O15 H15A 107.9 3_575 . ?
C2 N1 C1 101.2(9) . . ?
C2 N1 Zn1 130.9(8) . . ?
C1 N1 Zn1 127.7(8) . . ?
C1 N2 N3 107.3(10) . . ?
C1 N2 Zn5 136.1(9) . 4_677 ?
N3 N2 Zn5 116.5(7) . 4_677 ?
C2 N3 N2 105.6(9) . . ?
C2 N3 Zn6 137.6(8) . 4_677 ?
N2 N3 Zn6 116.5(7) . 4_677 ?
C3 N4 C4 101.3(9) . . ?
C3 N4 Zn4 131.0(8) . . ?
C4 N4 Zn4 125.8(8) . . ?
C3 N5 N6 104.7(11) . . ?
C3 N5 Zn2 138.0(9) . . ?
N6 N5 Zn2 117.3(9) . . ?
C4 N6 N5 107.4(11) . . ?
C4 N6 Zn3 136.1(9) . . ?
N5 N6 Zn3 116.1(9) . . ?
C5 N7 C6 104.6(10) . . ?
C5 N7 Zn7 131.9(9) . . ?
C6 N7 Zn7 123.4(9) . . ?
C5 N8 N9 107.1(11) . . ?
C5 N8 Zn9 138.8(10) . 4_676 ?
N9 N8 Zn9 114.1(8) . 4_676 ?
C6 N9 N8 103.4(11) . . ?
C6 N9 Zn8 138.0(10) . 4_676 ?
N8 N9 Zn8 118.0(8) . 4_676 ?
C7 N10 C7 117.4(11) . 3_565 ?
C7 N10 Zn3 115.5(7) . 4_677 ?
C7 N10 Zn3 127.1(8) 3_565 4_677 ?
C8 N11 C8 116.4(11) 2_775 . ?
C8 N11 Zn2 124.7(7) 2_775 4_677 ?
C8 N11 Zn2 118.9(7) . 4_677 ?
C9 N12 C9 117.4(12) 3_565 . ?
C9 N12 Zn5 118.5(8) 3_565 . ?
C9 N12 Zn5 124.0(8) . . ?
C10 N13 C10 119.3(12) 3_675 . ?
C10 N13 Zn6 127.2(8) 3_675 . ?
C10 N13 Zn6 113.1(8) . . ?
C11 N14 C11 119.5(11) 2_665 . ?
C11 N14 Zn8 114.9(8) 2_665 . ?
C11 N14 Zn8 125.5(8) . . ?
C12 N15 C12 120.6(14) . 2_675 ?
C12 N15 Zn9 116.1(10) . . ?
C12 N15 Zn9 122.9(9) 2_675 . ?
N2 C1 N1 110.7(11) . . ?
N2 C1 H1 124.7 . . ?
N1 C1 H1 124.7 . . ?
N3 C2 N1 114.7(11) . . ?
N3 C2 H2 122.6 . . ?
N1 C2 H2 122.6 . . ?
N5 C3 N4 113.6(11) . . ?
N5 C3 H3 123.2 . . ?
N4 C3 H3 123.2 . . ?
N6 C4 N4 112.4(11) . . ?
N6 C4 H4 123.8 . . ?
N4 C4 H4 123.8 . . ?
N7 C5 N8 113.4(12) . . ?
N7 C5 H5 123.3 . . ?
N8 C5 H5 123.3 . . ?
N9 C6 N7 111.5(12) . . ?
N9 C6 H6 124.3 . . ?
N7 C6 H6 124.3 . . ?
O1 C7 N10 118.9(9) . . ?
O1 C7 N10 118.5(10) . 2_665 ?
N10 C7 N10 122.6(11) . 2_665 ?
O2 C8 N11 120.6(10) . 3_575 ?
O2 C8 N11 115.8(10) . . ?
N11 C8 N11 123.6(11) 3_575 . ?
O3 C9 N12 119.8(11) . 2_665 ?
O3 C9 N12 117.6(10) . . ?
N12 C9 N12 122.4(12) 2_665 . ?
O4 C10 N13 120.9(11) . 2_765 ?
O4 C10 N13 118.3(12) . . ?
N13 C10 N13 120.6(12) 2_765 . ?
O5 C11 N14 118.1(11) . 3_565 ?
O5 C11 N14 121.4(11) . . ?
N14 C11 N14 120.5(11) 3_565 . ?
O6 C12 N15 121.6(12) . . ?
O6 C12 N15 118.9(11) . 3_465 ?
N15 C12 N15 119.4(13) . 3_465 ?

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
O11 Zn1 O1 C7 6.2(15) 5_457 . . . ?
O7 Zn1 O1 C7 -91.4(15) . . . . ?
N1 Zn1 O1 C7 97.8(15) . . . . ?
O2 Zn1 O1 C7 -176.3(15) . . . . ?
O10 Zn1 O2 C8 -0.6(13) 6_667 . . . ?
O7 Zn1 O2 C8 94.2(13) . . . . ?
N1 Zn1 O2 C8 -92.6(13) . . . . ?
O1 Zn1 O2 C8 179.9(13) . . . . ?
O12 Zn4 O3 C9 -1.1(15) . . . . ?
N4 Zn4 O3 C9 -92.8(15) . . . . ?
O9 Zn4 O3 C9 91.3(15) . . . . ?
O4 Zn4 O3 C9 176.1(15) 2_665 . . . ?
O14 Zn7 O5 C11 -2.9(16) . . . . ?
N7 Zn7 O5 C11 -100.1(16) . . . . ?
O8 Zn7 O5 C11 92.2(16) . . . . ?
O6 Zn7 O5 C11 175.6(16) 3_565 . . . ?
O11 Zn3 O7 Zn2 89.9(4) . . . . ?
N10 Zn3 O7 Zn2 -142.4(4) 4_677 . . . ?
N6 Zn3 O7 Zn2 -20.6(4) . . . . ?
O11 Zn3 O7 Zn1 -50.3(5) . . . . ?
N10 Zn3 O7 Zn1 77.4(6) 4_677 . . . ?
N6 Zn3 O7 Zn1 -160.7(5) . . . . ?
O10 Zn2 O7 Zn3 -95.7(4) . . . . ?
N11 Zn2 O7 Zn3 134.9(4) 4_677 . . . ?
N5 Zn2 O7 Zn3 17.7(5) . . . . ?
O10 Zn2 O7 Zn1 45.1(6) . . . . ?
N11 Zn2 O7 Zn1 -84.3(5) 4_677 . . . ?
N5 Zn2 O7 Zn1 158.5(5) . . . . ?
O10 Zn1 O7 Zn3 23.3(5) 6_667 . . . ?
O11 Zn1 O7 Zn3 115.9(4) 5_457 . . . ?
N1 Zn1 O7 Zn3 -102.6(19) . . . . ?
O1 Zn1 O7 Zn3 -151.7(4) . . . . ?
O2 Zn1 O7 Zn3 -68.7(4) . . . . ?
O10 Zn1 O7 Zn2 -110.4(5) 6_667 . . . ?
O11 Zn1 O7 Zn2 -17.8(5) 5_457 . . . ?
N1 Zn1 O7 Zn2 123.7(17) . . . . ?
O1 Zn1 O7 Zn2 74.6(5) . . . . ?
O2 Zn1 O7 Zn2 157.7(5) . . . . ?
O13 Zn6 O8 Zn5 -90.4(4) . . . . ?
N13 Zn6 O8 Zn5 144.7(4) . . . . ?
N3 Zn6 O8 Zn5 22.3(4) 4_677 . . . ?
O13 Zn6 O8 Zn7 47.5(5) . . . . ?
N13 Zn6 O8 Zn7 -77.4(6) . . . . ?
N3 Zn6 O8 Zn7 160.2(5) 4_677 . . . ?
O12 Zn5 O8 Zn6 95.6(4) . . . . ?
N12 Zn5 O8 Zn6 -135.9(4) . . . . ?
N2 Zn5 O8 Zn6 -18.5(5) 4_677 . . . ?
O12 Zn5 O8 Zn7 -43.3(5) . . . . ?
N12 Zn5 O8 Zn7 85.2(5) . . . . ?
N2 Zn5 O8 Zn7 -157.4(4) 4_677 . . . ?
O15 Zn7 O8 Zn6 -23.2(5) 2_775 . . . ?
O14 Zn7 O8 Zn6 -114.9(5) . . . . ?
N7 Zn7 O8 Zn6 102.4(13) . . . . ?
O5 Zn7 O8 Zn6 152.2(5) . . . . ?
O6 Zn7 O8 Zn6 69.1(4) 3_565 . . . ?
O15 Zn7 O8 Zn5 109.3(4) 2_775 . . . ?
O14 Zn7 O8 Zn5 17.6(4) . . . . ?
N7 Zn7 O8 Zn5 -125.1(13) . . . . ?
O5 Zn7 O8 Zn5 -75.3(4) . . . . ?
O6 Zn7 O8 Zn5 -158.4(4) 3_565 . . . ?
O15 Zn9 O9 Zn8 -97.0(4) . . . . ?
N15 Zn9 O9 Zn8 136.5(4) . . . . ?
N8 Zn9 O9 Zn8 18.5(4) 4_676 . . . ?
O15 Zn9 O9 Zn4 43.0(5) . . . . ?
N15 Zn9 O9 Zn4 -83.5(5) . . . . ?
N8 Zn9 O9 Zn4 158.5(4) 4_676 . . . ?
O14 Zn8 O9 Zn9 91.1(4) . . . . ?
N14 Zn8 O9 Zn9 -143.4(4) . . . . ?
N9 Zn8 O9 Zn9 -22.1(4) 4_676 . . . ?
O14 Zn8 O9 Zn4 -48.2(5) . . . . ?
N14 Zn8 O9 Zn4 77.4(5) . . . . ?
N9 Zn8 O9 Zn4 -161.4(4) 4_676 . . . ?
O13 Zn4 O9 Zn9 -18.1(4) 3_575 . . . ?
O12 Zn4 O9 Zn9 -109.8(4) . . . . ?
N4 Zn4 O9 Zn9 142.1(13) . . . . ?
O4 Zn4 O9 Zn9 75.3(4) 2_665 . . . ?
O3 Zn4 O9 Zn9 158.2(4) . . . . ?
O13 Zn4 O9 Zn8 116.3(4) 3_575 . . . ?
O12 Zn4 O9 Zn8 24.6(5) . . . . ?
N4 Zn4 O9 Zn8 -83.5(15) . . . . ?
O4 Zn4 O9 Zn8 -150.3(4) 2_665 . . . ?
O3 Zn4 O9 Zn8 -67.4(4) . . . . ?
N11 Zn2 O10 Zn1 -22.5(7) 4_677 . . 5_457 ?
N5 Zn2 O10 Zn1 105.3(6) . . . 5_457 ?
O7 Zn2 O10 Zn1 -148.0(5) . . . 5_457 ?
N10 Zn3 O11 Zn1 14.6(6) 4_677 . . 6_667 ?
O7 Zn3 O11 Zn1 145.6(4) . . . 6_667 ?
N6 Zn3 O11 Zn1 -109.9(5) . . . 6_667 ?
N12 Zn5 O12 Zn4 28.7(6) . . . . ?
O8 Zn5 O12 Zn4 152.4(4) . . . . ?
N2 Zn5 O12 Zn4 -102.6(5) 4_677 . . . ?
O13 Zn4 O12 Zn5 162.3(5) 3_575 . . . ?
N4 Zn4 O12 Zn5 64.1(5) . . . . ?
O9 Zn4 O12 Zn5 -101.8(5) . . . . ?
O3 Zn4 O12 Zn5 -17.6(5) . . . . ?
N13 Zn6 O13 Zn4 -20.4(7) . . . 2_775 ?
O8 Zn6 O13 Zn4 -149.6(5) . . . 2_775 ?
N3 Zn6 O13 Zn4 105.8(5) 4_677 . . 2_775 ?
N14 Zn8 O14 Zn7 22.1(6) . . . . ?
O9 Zn8 O14 Zn7 151.6(4) . . . . ?
N9 Zn8 O14 Zn7 -104.9(5) 4_676 . . . ?
O15 Zn7 O14 Zn8 169.4(5) 2_775 . . . ?
N7 Zn7 O14 Zn8 72.5(5) . . . . ?
O8 Zn7 O14 Zn8 -97.7(5) . . . . ?
O5 Zn7 O14 Zn8 -13.5(5) . . . . ?
N15 Zn9 O15 Zn7 -30.1(6) . . . 3_575 ?
O9 Zn9 O15 Zn7 -153.1(4) . . . 3_575 ?
N8 Zn9 O15 Zn7 100.5(5) 4_676 . . 3_575 ?
O10 Zn1 N1 C2 62.9(12) 6_667 . . . ?
O11 Zn1 N1 C2 -29.0(12) 5_457 . . . ?
O7 Zn1 N1 C2 -171.0(15) . . . . ?
O1 Zn1 N1 C2 -122.0(12) . . . . ?
O2 Zn1 N1 C2 155.2(12) . . . . ?
O10 Zn1 N1 C1 -110.2(12) 6_667 . . . ?
O11 Zn1 N1 C1 157.8(11) 5_457 . . . ?
O7 Zn1 N1 C1 16(3) . . . . ?
O1 Zn1 N1 C1 64.9(11) . . . . ?
O2 Zn1 N1 C1 -17.9(11) . . . . ?
C1 N2 N3 C2 -1.8(15) . . . . ?
Zn5 N2 N3 C2 175.4(8) 4_677 . . . ?
C1 N2 N3 Zn6 173.2(9) . . . 4_677 ?
Zn5 N2 N3 Zn6 -9.6(12) 4_677 . . 4_677 ?
O13 Zn4 N4 C3 146.2(12) 3_575 . . . ?
O12 Zn4 N4 C3 -122.0(12) . . . . ?
O9 Zn4 N4 C3 -14(2) . . . . ?
O4 Zn4 N4 C3 52.2(12) 2_665 . . . ?
O3 Zn4 N4 C3 -30.0(12) . . . . ?
O13 Zn4 N4 C4 -15.3(11) 3_575 . . . ?
O12 Zn4 N4 C4 76.5(11) . . . . ?
O9 Zn4 N4 C4 -175.4(12) . . . . ?
O4 Zn4 N4 C4 -109.3(11) 2_665 . . . ?
O3 Zn4 N4 C4 168.5(11) . . . . ?
O10 Zn2 N5 C3 -75.8(15) . . . . ?
N11 Zn2 N5 C3 55.5(15) 4_677 . . . ?
O7 Zn2 N5 C3 172.4(14) . . . . ?
O10 Zn2 N5 N6 104.7(9) . . . . ?
N11 Zn2 N5 N6 -124.0(9) 4_677 . . . ?
O7 Zn2 N5 N6 -7.1(10) . . . . ?
C3 N5 N6 C4 -1.3(15) . . . . ?
Zn2 N5 N6 C4 178.3(9) . . . . ?
C3 N5 N6 Zn3 172.5(8) . . . . ?
Zn2 N5 N6 Zn3 -7.8(12) . . . . ?
O11 Zn3 N6 C4 81.2(14) . . . . ?
N10 Zn3 N6 C4 -43.4(15) 4_677 . . . ?
O7 Zn3 N6 C4 -169.4(13) . . . . ?
O11 Zn3 N6 N5 -90.4(9) . . . . ?
N10 Zn3 N6 N5 145.0(9) 4_677 . . . ?
O7 Zn3 N6 N5 19.1(10) . . . . ?
O15 Zn7 N7 C5 111.3(12) 2_775 . . . ?
O14 Zn7 N7 C5 -156.3(12) . . . . ?
O8 Zn7 N7 C5 -14(2) . . . . ?
O5 Zn7 N7 C5 -63.5(12) . . . . ?
O6 Zn7 N7 C5 19.4(12) 3_565 . . . ?
O15 Zn7 N7 C6 -65.2(10) 2_775 . . . ?
O14 Zn7 N7 C6 27.2(10) . . . . ?
O8 Zn7 N7 C6 169.7(10) . . . . ?
O5 Zn7 N7 C6 120.1(10) . . . . ?
O6 Zn7 N7 C6 -157.1(10) 3_565 . . . ?
C5 N8 N9 C6 1.7(12) . . . . ?
Zn9 N8 N9 C6 -177.8(7) 4_676 . . . ?
C5 N8 N9 Zn8 -170.8(8) . . . 4_676 ?
Zn9 N8 N9 Zn8 9.7(10) 4_676 . . 4_676 ?
O12 Zn5 N12 C9 159.9(9) . . . 3_565 ?
O8 Zn5 N12 C9 38.3(10) . . . 3_565 ?
N2 Zn5 N12 C9 -69.7(10) 4_677 . . 3_565 ?
O12 Zn5 N12 C9 -20.6(11) . . . . ?
O8 Zn5 N12 C9 -142.1(9) . . . . ?
N2 Zn5 N12 C9 109.8(10) 4_677 . . . ?
O13 Zn6 N13 C10 19.1(13) . . . 3_675 ?
O8 Zn6 N13 C10 140.8(10) . . . 3_675 ?
N3 Zn6 N13 C10 -104.8(11) 4_677 . . 3_675 ?
O13 Zn6 N13 C10 -167.6(8) . . . . ?
O8 Zn6 N13 C10 -45.8(10) . . . . ?
N3 Zn6 N13 C10 68.5(10) 4_677 . . . ?
O14 Zn8 N14 C11 165.1(8) . . . 2_665 ?
O9 Zn8 N14 C11 43.4(10) . . . 2_665 ?
N9 Zn8 N14 C11 -69.4(10) 4_676 . . 2_665 ?
O14 Zn8 N14 C11 -17.9(12) . . . . ?
O9 Zn8 N14 C11 -139.6(10) . . . . ?
N9 Zn8 N14 C11 107.7(11) 4_676 . . . ?
O15 Zn9 N15 C12 -162.3(9) . . . . ?
O9 Zn9 N15 C12 -41.5(11) . . . . ?
N8 Zn9 N15 C12 67.5(11) 4_676 . . . ?
O15 Zn9 N15 C12 24.1(12) . . . 2_675 ?
O9 Zn9 N15 C12 144.9(10) . . . 2_675 ?
N8 Zn9 N15 C12 -106.0(11) 4_676 . . 2_675 ?
N3 N2 C1 N1 -2.3(17) . . . . ?
Zn5 N2 C1 N1 -178.7(10) 4_677 . . . ?
C2 N1 C1 N2 5.4(16) . . . . ?
Zn1 N1 C1 N2 -179.9(9) . . . . ?
N2 N3 C2 N1 5.7(15) . . . . ?
Zn6 N3 C2 N1 -167.5(10) 4_677 . . . ?
C1 N1 C2 N3 -6.8(15) . . . . ?
Zn1 N1 C2 N3 178.7(9) . . . . ?
N6 N5 C3 N4 6.2(16) . . . . ?
Zn2 N5 C3 N4 -173.3(10) . . . . ?
C4 N4 C3 N5 -8.1(15) . . . . ?
Zn4 N4 C3 N5 -172.9(9) . . . . ?
N5 N6 C4 N4 -3.8(16) . . . . ?
Zn3 N6 C4 N4 -175.8(9) . . . . ?
C3 N4 C4 N6 7.1(15) . . . . ?
Zn4 N4 C4 N6 173.0(9) . . . . ?
C6 N7 C5 N8 -1.1(14) . . . . ?
Zn7 N7 C5 N8 -178.1(9) . . . . ?
N9 N8 C5 N7 -0.4(14) . . . . ?
Zn9 N8 C5 N7 178.9(9) 4_676 . . . ?
N8 N9 C6 N7 -2.5(13) . . . . ?
Zn8 N9 C6 N7 167.6(9) 4_676 . . . ?
C5 N7 C6 N9 2.3(14) . . . . ?
Zn7 N7 C6 N9 179.6(8) . . . . ?
Zn1 O1 C7 N10 172.4(9) . . . . ?
Zn1 O1 C7 N10 -9(2) . . . 2_665 ?
C7 N10 C7 O1 -179.3(6) 3_565 . . . ?
Zn3 N10 C7 O1 2.5(15) 4_677 . . . ?
C7 N10 C7 N10 2(2) 3_565 . . 2_665 ?
Zn3 N10 C7 N10 -175.9(7) 4_677 . . 2_665 ?
Zn1 O2 C8 N11 6.6(19) . . . 3_575 ?
Zn1 O2 C8 N11 -175.0(8) . . . . ?
C8 N11 C8 O2 178.5(7) 2_775 . . . ?
Zn2 N11 C8 O2 -3.0(14) 4_677 . . . ?
C8 N11 C8 N11 -3(2) 2_775 . . 3_575 ?
Zn2 N11 C8 N11 175.4(7) 4_677 . . 3_575 ?
Zn4 O3 C9 N12 -174.4(10) . . . 2_665 ?
Zn4 O3 C9 N12 11(2) . . . . ?
C9 N12 C9 O3 -179.1(7) 3_565 . . . ?
Zn5 N12 C9 O3 1.3(16) . . . . ?
C9 N12 C9 N12 6(2) 3_565 . . 2_665 ?
Zn5 N12 C9 N12 -173.4(6) . . . 2_665 ?
Zn4 O4 C10 N13 -3(2) 3_565 . . 2_765 ?
Zn4 O4 C10 N13 173.7(10) 3_565 . . . ?
C10 N13 C10 O4 -179.1(7) 3_675 . . . ?
Zn6 N13 C10 O4 6.9(15) . . . . ?
C10 N13 C10 N13 -3(3) 3_675 . . 2_765 ?
Zn6 N13 C10 N13 -176.9(8) . . . 2_765 ?
Zn7 O5 C11 N14 -173.4(10) . . . 3_565 ?
Zn7 O5 C11 N14 9(2) . . . . ?
C11 N14 C11 O5 -179.6(8) 2_665 . . . ?
Zn8 N14 C11 O5 3.4(18) . . . . ?
C11 N14 C11 N14 3(2) 2_665 . . 3_565 ?
Zn8 N14 C11 N14 -174.3(6) . . . 3_565 ?
Zn7 O6 C12 N15 177.0(11) 2_665 . . . ?
Zn7 O6 C12 N15 1(3) 2_665 . . 3_465 ?
C12 N15 C12 O6 -177.7(8) 2_675 . . . ?
Zn9 N15 C12 O6 8.6(18) . . . . ?
C12 N15 C12 N15 -2(3) 2_675 . . 3_465 ?
Zn9 N15 C12 N15 -175.5(7) . . . 3_465 ?

_diffrn_measured_fraction_theta_max 0.997
_diffrn_reflns_theta_full        25.00
_diffrn_measured_fraction_theta_full 0.997
_refine_diff_density_max         4.538
_refine_diff_density_min         -0.900
_refine_diff_density_rms         0.255
_database_code_depnum_ccdc_archive 'CCDC 958192'