#------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: svn://www.crystallography.net/cod/cif/2/00/71/2007103.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# 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_2007103
loop_
_publ_author_name
'Fenton, David E.'
'Adams, Harry'
'He, Qing-Yu'
_publ_section_title
;(Benzoato-O){tris[(2-benzimidazolyl-N³)methyl]amine-N}zinc(II)
 Tetrafluoroborate Methanol Solvate
;
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              286
_journal_page_last               287
_journal_paper_doi               10.1107/S0108270197015941
_journal_volume                  54
_journal_year                    1998
_chemical_formula_iupac          '[Zn (C24 H21 N7) (C7 H5 O2)] B F4 , C H4 O'
_chemical_formula_sum            'C32 H30 B F4 N7 O3 Zn'
_chemical_formula_weight         712.81
_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'
_audit_creation_method           SHELXL
_cell_angle_alpha                100.284(14)
_cell_angle_beta                 98.644(11)
_cell_angle_gamma                112.866(10)
_cell_formula_units_Z            2
_cell_length_a                   10.153(3)
_cell_length_b                   12.228(3)
_cell_length_c                   14.166(3)
_cell_measurement_reflns_used    250
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      20
_cell_measurement_theta_min      5
_cell_volume                     1547.0(7)
_computing_cell_refinement       'REFINE MADNES'
_computing_data_collection       'MADNES (Pflugrath & Messerschmidt, 1989)'
_computing_data_reduction        'ABSMAD (Karaulov, 1991)'
_computing_molecular_graphics    'SHELXTL/PC (Sheldrick, 1994)'
_computing_publication_material  SHELXL93
_computing_structure_refinement  'SHELXL93 (Sheldrick, 1993)'
_computing_structure_solution    'SHELXS86 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measurement_device
'Delft Instruments FAST area detector with rotating anode generator'
_diffrn_measurement_method       'Scanning procedure of Darr et al. (1993)'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'rotating anode'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0539
_diffrn_reflns_av_sigmaI/netI    0.0890
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -12
_diffrn_reflns_number            6656
_diffrn_reflns_theta_max         25.03
_diffrn_reflns_theta_min         1.87
_diffrn_standards_decay_%        0
_exptl_absorpt_coefficient_mu    0.865
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            blue
_exptl_crystal_density_diffrn    1.530
_exptl_crystal_density_method    none
_exptl_crystal_description       'oblong block'
_exptl_crystal_F_000             732
_exptl_crystal_size_max          0.60
_exptl_crystal_size_mid          0.40
_exptl_crystal_size_min          0.30
_refine_diff_density_max         1.096
_refine_diff_density_min         -0.867
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_all   0.986
_refine_ls_goodness_of_fit_obs   1.125
_refine_ls_matrix_type           full
_refine_ls_number_parameters     461
_refine_ls_number_reflns         4362
_refine_ls_number_restraints     58
_refine_ls_restrained_S_all      0.989
_refine_ls_restrained_S_obs      1.121
_refine_ls_R_factor_all          0.0723
_refine_ls_R_factor_obs          .0567
_refine_ls_shift/esd_max         0.000
_refine_ls_shift/esd_mean        0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w = 1/[σ²(Fo²)+(0.0873P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_all         0.1528
_refine_ls_wR_factor_obs         .1475
_reflns_number_observed          3261
_reflns_number_total             4363
_reflns_observed_criterion       I>2\s(I)
_cod_data_source_file            mu1311.cif
_cod_data_source_block           hurst
_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 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 

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 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 

The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value 'calc w =
1/[\s^2^(Fo^2^)+(0.0873P)^2^] where P=(Fo^2^+2Fc^2^)/3' was changed
to 'calc'. New tag '_refine_ls_weighting_details' was created. The
value of the new tag was set to 'w = 1/[\s^2^(Fo^2^)+(0.0873P)^2^]
where P=(Fo^2^+2Fc^2^)/3'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
;
_cod_original_cell_volume        1547.0(6)
_cod_database_code               2007103
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_thermal_displace_type
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_occupancy
_atom_site_disorder_group
_atom_site_type_symbol
Zn1 .09272(6) .18281(5) .31736(4) .0224(2) Uani d . 1 . Zn
O1 .3115(4) .2578(3) .3555(2) .0291(8) Uani d . 1 . O
O2 .3090(4) .0887(3) .3946(3) .0368(9) Uani d . 1 . O
N1 .0201(4) .0414(4) .1941(3) .0238(10) Uani d . 1 . N
N2 -.1489(5) -.1185(4) .0767(3) .0275(10) Uani d . 1 . N
H2A -.2381(5) -.1743(4) .0397(3) .080 Uiso d R 1 . H
N3 -.1837(4) .0859(4) .2873(3) .0239(10) Uani d . 1 . N
N4 -.1382(5) .3711(4) .2229(3) .0271(10) Uani d . 1 . N
H4A -.2244(5) .3771(4) .2119(3) .080 Uiso d R 1 . H
N5 .0302(4) .3075(4) .2751(3) .0229(10) Uani d . 1 . N
N6 -.1027(5) .0904(4) .5473(3) .0249(10) Uani d . 1 . N
H6A -.1837(5) .0448(4) .5653(3) .080 Uiso d R 1 . H
N7 .0433(4) .1668(4) .4509(3) .0217(10) Uani d . 1 . N
C1 .0922(5) -.0135(5) .1385(3) .0238(12) Uani d . 1 . C
C2 .2407(6) .0192(5) .1445(4) .0363(14) Uani d . 1 . C
H2B .3147(6) .0908(5) .1929(4) .080 Uiso d R 1 . H
C3 .2774(7) -.0563(6) .0784(4) .0410(15) Uani d . 1 . C
H3A .3793(7) -.0347(6) .0797(4) .080 Uiso d R 1 . H
C4 .1688(6) -.1622(5) .0091(4) .0367(14) Uani d . 1 . C
H4B .1981(6) -.2153(5) -.0324(4) .080 Uiso d R 1 . H
C5 .0219(6) -.1922(5) -.0002(4) .0318(13) Uani d . 1 . C
H5A -.0531(6) -.2625(5) -.0494(4) .080 Uiso d R 1 . H
C6 -.0135(6) -.1146(5) .0653(3) .0257(12) Uani d . 1 . C
C7 -.1221(6) -.0236(5) .1537(3) .0248(12) Uani d . 1 . C
C8 -.2415(5) .0066(5) .1860(4) .0281(12) Uani d . 1 . C
H8A -.2722(5) .0484(5) .1422(4) .080 Uiso d R 1 . H
H8B -.3255(5) -.0670(5) .1834(4) .080 Uiso d R 1 . H
C9 -.2189(5) .1928(5) .3002(4) .0292(12) Uani d . 1 . C
H9A -.2144(5) .2227(5) .3686(4) .080 Uiso d R 1 . H
H9B -.3167(5) .1694(5) .2623(4) .080 Uiso d R 1 . H
C10 -.1091(5) .2914(4) .2659(3) .0225(11) Uani d . 1 . C
C11 -.0092(6) .4438(5) .1989(4) .0306(13) Uani d . 1 . C
C12 .0188(7) .5343(6) .1471(4) .045(2) Uani d . 1 . C
H12A -.0541(7) .5617(6) .1246(4) .080 Uiso d R 1 . H
C13 .1590(8) .5814(6) .1306(5) .065(2) Uani d . 1 . C
H13A .1843(8) .6433(6) .0948(5) .080 Uiso d R 1 . H
C14 .2670(7) .5425(7) .1652(5) .061(2) Uani d . 1 . C
H14A .3624(7) .5776(7) .1516(5) .080 Uiso d R 1 . H
C15 .2371(6) .4549(5) .2176(4) .0375(14) Uani d . 1 . C
H15A .3098(6) .4283(5) .2422(4) .080 Uiso d R 1 . H
C16 .0957(6) .4055(5) .2331(4) .0272(12) Uani d . 1 . C
C17 -.2122(5) .0206(5) .3639(4) .0274(12) Uani d . 1 . C
H17A -.2162(5) -.0598(5) .3415(4) .080 Uiso d R 1 . H
H17B -.3048(5) .0116(5) .3782(4) .080 Uiso d R 1 . H
C18 -.0890(5) .0925(4) .4543(4) .0217(12) Uani d . 1 . C
C19 .0314(6) .1726(4) .6102(4) .0235(12) Uani d . 1 . C
C20 .0782(6) .2128(5) .7132(4) .0324(13) Uani d . 1 . C
H20A .0140(6) .1801(5) .7545(4) .080 Uiso d R 1 . H
C21 .2212(6) .2994(5) .7531(4) .0358(14) Uani d . 1 . C
H21A .2566(6) .3311(5) .8236(4) .080 Uiso d R 1 . H
C22 .3156(6) .3440(5) .6933(4) .0340(14) Uani d . 1 . C
H22A .4158(6) .4019(5) .7238(4) .080 Uiso d R 1 . H
C23 .2684(6) .3060(5) .5907(4) .0277(12) Uani d . 1 . C
H23A .3332(6) .3384(5) .5497(4) .080 Uiso d R 1 . H
C24 .1237(5) .2190(4) .5497(3) .0213(11) Uani d . 1 . C
C25 .3738(5) .1983(5) .3953(4) .0260(12) Uani d . 1 . C
C26 .5342(5) .2701(5) .4444(4) .0263(12) Uani d . 1 . C
C27 .6185(6) .3796(5) .4246(4) .0334(13) Uani d . 1 . C
H27A .5748(6) .4089(5) .3759(4) .080 Uiso d R 1 . H
C28 .7650(6) .4445(5) .4726(5) .044(2) Uani d . 1 . C
H28A .8229(6) .5204(5) .4587(5) .080 Uiso d R 1 . H
C29 .8294(6) .4046(6) .5415(4) .043(2) Uani d . 1 . C
H29A .9317(6) .4514(6) .5744(4) .080 Uiso d R 1 . H
C30 .7475(6) .2970(6) .5633(4) .040(2) Uani d . 1 . C
H30A .7929(6) .2706(6) .6135(4) .080 Uiso d R 1 . H
C31 .5994(6) .2274(5) .5135(4) .0324(13) Uani d . 1 . C
H31A .5432(6) .1501(5) .5259(4) .080 Uiso d R 1 . H
B1 .5278(7) .2914(7) .0646(5) .053(2) Uani d D 1 . B
F1A .3923(15) .2894(18) .0784(12) .078(5) Uani d PDU .48(2) 1 F
F2A .5133(14) .2461(16) -.0330(9) .084(4) Uani d PDU .48(2) 1 F
F3A .6354(16) .4076(11) .0986(14) .109(8) Uani d PDU .48(2) 1 F
F4A .5581(10) .2067(13) .1112(13) .083(6) Uani d PDU .48(2) 1 F
F1B .4049(15) .3114(15) .0336(16) .113(8) Uani d PDU .52(2) 2 F
F2B .5063(13) .1797(13) .0074(13) .104(6) Uani d PDU .52(2) 2 F
F3B .6591(14) .3769(15) .0535(16) .127(8) Uani d PDU .52(2) 2 F
F4B .5548(8) .2934(16) .1621(6) .067(4) Uani d PDU .52(2) 2 F
O1S .5332(12) .0357(10) .6810(7) .196(4) Uiso d . 1 . O
H1S .5925(12) .0146(10) .6592(7) .080 Uiso d R 1 . H
C1S .6154(17) .1588(15) .7502(11) .194(6) Uiso d . 1 . C
H1S1 .585(11) .159(4) .811(4) .291 Uiso calc R 1 . H
H1S2 .596(12) .218(2) .722(4) .291 Uiso calc R 1 . H
H1S3 .719(2) .180(5) .763(8) .291 Uiso calc R 1 . H
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
B B 0.0013 0.0007 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
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'
Zn Zn 0.2839 1.4301 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_publ_flag
O1 Zn1 N5 107.8(2) y
O1 Zn1 N1 109.0(2) y
N5 Zn1 N1 105.0(2) y
O1 Zn1 N7 101.40(14) y
N5 Zn1 N7 107.8(2) y
N1 Zn1 N7 124.9(2) y
O1 Zn1 N3 174.00(13) y
N5 Zn1 N3 75.17(15) y
N1 Zn1 N3 74.68(15) y
N7 Zn1 N3 72.63(14) y
O1 Zn1 O2 47.77(12) ?
N5 Zn1 O2 155.56(14) ?
N1 Zn1 O2 87.35(13) ?
N7 Zn1 O2 80.47(13) ?
N3 Zn1 O2 129.01(11) ?
C25 O1 Zn1 117.7(3) ?
C25 O2 Zn1 69.5(3) ?
C7 N1 C1 106.0(4) ?
C7 N1 Zn1 120.8(3) ?
C1 N1 Zn1 133.1(3) ?
C7 N2 C6 107.6(4) ?
C17 N3 C8 114.5(4) ?
C17 N3 C9 113.8(4) ?
C8 N3 C9 113.2(4) ?
C17 N3 Zn1 104.2(3) ?
C8 N3 Zn1 106.7(3) ?
C9 N3 Zn1 102.9(3) ?
C10 N4 C11 107.2(4) ?
C10 N5 C16 105.3(4) ?
C10 N5 Zn1 120.0(3) ?
C16 N5 Zn1 133.6(3) ?
C18 N6 C19 107.0(4) ?
C18 N7 C24 105.5(4) ?
C18 N7 Zn1 120.3(3) ?
C24 N7 Zn1 134.2(3) ?
C2 C1 C6 120.1(5) ?
C2 C1 N1 131.3(5) ?
C6 C1 N1 108.6(4) ?
C1 C2 C3 117.4(5) ?
C2 C3 C4 121.4(5) ?
C5 C4 C3 121.6(5) ?
C4 C5 C6 116.4(5) ?
C1 C6 N2 105.7(5) ?
C1 C6 C5 123.0(5) ?
N2 C6 C5 131.3(5) ?
N1 C7 N2 112.1(4) ?
N1 C7 C8 124.5(4) ?
N2 C7 C8 123.4(4) ?
N3 C8 C7 109.1(4) ?
N3 C9 C10 108.6(4) ?
N5 C10 N4 112.6(4) ?
N5 C10 C9 122.4(4) ?
N4 C10 C9 125.0(4) ?
C16 C11 C12 122.6(5) ?
C16 C11 N4 106.2(4) ?
C12 C11 N4 131.2(5) ?
C13 C12 C11 115.3(6) ?
C12 C13 C14 122.5(6) ?
C15 C14 C13 120.9(6) ?
C14 C15 C16 117.0(5) ?
C11 C16 C15 121.8(5) ?
C11 C16 N5 108.6(4) ?
C15 C16 N5 129.4(5) ?
N3 C17 C18 108.1(4) ?
N7 C18 N6 113.1(4) ?
N7 C18 C17 123.0(4) ?
N6 C18 C17 124.0(4) ?
N6 C19 C24 106.0(4) ?
N6 C19 C20 132.1(5) ?
C24 C19 C20 121.9(5) ?
C21 C20 C19 117.2(5) ?
C20 C21 C22 121.4(5) ?
C23 C22 C21 121.5(5) ?
C24 C23 C22 117.5(5) ?
C23 C24 C19 120.5(4) ?
C23 C24 N7 131.0(4) ?
C19 C24 N7 108.5(4) ?
O2 C25 O1 123.9(5) ?
O2 C25 C26 120.6(5) ?
O1 C25 C26 115.5(4) ?
C27 C26 C31 119.1(5) ?
C27 C26 C25 121.8(5) ?
C31 C26 C25 119.1(5) ?
C28 C27 C26 120.2(5) ?
C29 C28 C27 121.1(6) ?
C28 C29 C30 119.7(5) ?
C29 C30 C31 120.4(5) ?
C26 C31 C30 119.5(5) ?
F2A B1 F3A 111.1(11) ?
F4B B1 F2B 110.2(10) ?
F4B B1 F1B 113.0(11) ?
F2B B1 F1B 107.9(11) ?
F4B B1 F3B 104.6(9) ?
F2B B1 F3B 106.0(12) ?
F1B B1 F3B 114.8(10) ?
F2A B1 F1A 108.9(10) ?
F3A B1 F1A 109.9(11) ?
F2A B1 F4A 104.7(10) ?
F3A B1 F4A 113.1(10) ?
F1A B1 F4A 109.0(9) ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Zn1 O1 . 1.987(3) y
Zn1 N5 . 2.013(4) y
Zn1 N1 . 2.031(4) y
Zn1 N7 . 2.052(4) y
Zn1 N3 . 2.518(4) y
Zn1 O2 . 3.005(4) y
O1 C25 . 1.282(6) y
O2 C25 . 1.239(6) ?
N1 C7 . 1.320(6) ?
N1 C1 . 1.405(6) ?
N2 C7 . 1.350(6) ?
N2 C6 . 1.392(7) ?
N3 C17 . 1.457(6) ?
N3 C8 . 1.467(6) ?
N3 C9 . 1.471(6) ?
N4 C10 . 1.338(6) ?
N4 C11 . 1.399(6) ?
N5 C10 . 1.332(6) ?
N5 C16 . 1.410(6) ?
N6 C18 . 1.348(6) ?
N6 C19 . 1.382(6) ?
N7 C18 . 1.311(6) ?
N7 C24 . 1.402(6) ?
C1 C2 . 1.387(7) ?
C1 C6 . 1.390(7) ?
C2 C3 . 1.389(8) ?
C3 C4 . 1.403(8) ?
C4 C5 . 1.369(8) ?
C5 C6 . 1.393(7) ?
C7 C8 . 1.506(7) ?
C9 C10 . 1.504(7) ?
C11 C16 . 1.380(7) ?
C11 C12 . 1.397(7) ?
C12 C13 . 1.387(9) ?
C13 C14 . 1.412(9) ?
C14 C15 . 1.375(8) ?
C15 C16 . 1.393(7) ?
C17 C18 . 1.497(7) ?
C19 C24 . 1.392(7) ?
C19 C20 . 1.397(7) ?
C20 C21 . 1.376(8) ?
C21 C22 . 1.391(8) ?
C22 C23 . 1.390(7) ?
C23 C24 . 1.391(7) ?
C25 C26 . 1.496(7) ?
C26 C27 . 1.385(7) ?
C26 C31 . 1.387(7) ?
C27 C28 . 1.375(8) ?
C28 C29 . 1.357(8) ?
C29 C30 . 1.375(8) ?
C30 C31 . 1.398(8) ?
B1 F2A . 1.358(13) ?
B1 F3A . 1.355(13) ?
B1 F4B . 1.361(10) ?
B1 F2B . 1.375(13) ?
B1 F1B . 1.387(14) ?
B1 F3B . 1.391(13) ?
B1 F1A . 1.411(13) ?
B1 F4A . 1.425(10) ?
O1S C1S . 1.47(2) ?
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
N5 Zn1 O1 C25 172.4(3)
N1 Zn1 O1 C25 -74.2(4)
N7 Zn1 O1 C25 59.3(4)
N3 Zn1 O1 C25 53.3(15)
O2 Zn1 O1 C25 -6.4(3)
O1 Zn1 O2 C25 6.3(3)
N5 Zn1 O2 C25 3.7(5)
N1 Zn1 O2 C25 125.2(3)
N7 Zn1 O2 C25 -108.7(3)
N3 Zn1 O2 C25 -167.0(3)
O1 Zn1 N1 C7 -179.9(3)
N5 Zn1 N1 C7 -64.6(4)
N7 Zn1 N1 C7 60.3(4)
N3 Zn1 N1 C7 5.0(3)
O2 Zn1 N1 C7 136.8(4)
O1 Zn1 N1 C1 4.3(5)
N5 Zn1 N1 C1 119.6(4)
N7 Zn1 N1 C1 -115.5(4)
N3 Zn1 N1 C1 -170.8(4)
O2 Zn1 N1 C1 -39.0(4)
O1 Zn1 N3 C17 -22.5(15)
N5 Zn1 N3 C17 -143.0(3)
N1 Zn1 N3 C17 106.5(3)
N7 Zn1 N3 C17 -28.6(3)
O2 Zn1 N3 C17 33.0(3)
O1 Zn1 N3 C8 -144.0(13)
N5 Zn1 N3 C8 95.4(3)
N1 Zn1 N3 C8 -15.0(3)
N7 Zn1 N3 C8 -150.1(3)
O2 Zn1 N3 C8 -88.6(3)
O1 Zn1 N3 C9 96.6(14)
N5 Zn1 N3 C9 -24.0(3)
N1 Zn1 N3 C9 -134.4(3)
N7 Zn1 N3 C9 90.5(3)
O2 Zn1 N3 C9 152.0(3)
O1 Zn1 N5 C10 -165.8(3)
N1 Zn1 N5 C10 78.1(4)
N7 Zn1 N5 C10 -57.0(4)
N3 Zn1 N5 C10 8.8(3)
O2 Zn1 N5 C10 -163.7(3)
O1 Zn1 N5 C16 28.3(5)
N1 Zn1 N5 C16 -87.8(4)
N7 Zn1 N5 C16 137.1(4)
N3 Zn1 N5 C16 -157.1(5)
O2 Zn1 N5 C16 30.4(6)
O1 Zn1 N7 C18 -162.0(4)
N5 Zn1 N7 C18 84.9(4)
N1 Zn1 N7 C18 -38.8(4)
N3 Zn1 N7 C18 17.4(4)
O2 Zn1 N7 C18 -118.8(4)
O1 Zn1 N7 C24 16.8(5)
N5 Zn1 N7 C24 -96.3(5)
N1 Zn1 N7 C24 140.0(4)
N3 Zn1 N7 C24 -163.8(5)
O2 Zn1 N7 C24 60.0(4)
C7 N1 C1 C2 176.6(5)
Zn1 N1 C1 C2 -7.1(8)
C7 N1 C1 C6 -1.2(5)
Zn1 N1 C1 C6 175.0(3)
C6 C1 C2 C3 -3.2(8)
N1 C1 C2 C3 179.2(5)
C1 C2 C3 C4 -0.8(8)
C2 C3 C4 C5 3.7(9)
C3 C4 C5 C6 -2.4(8)
C2 C1 C6 N2 -177.2(4)
N1 C1 C6 N2 0.9(5)
C2 C1 C6 C5 4.6(8)
N1 C1 C6 C5 -177.3(4)
C7 N2 C6 C1 -0.3(5)
C7 N2 C6 C5 177.8(5)
C4 C5 C6 C1 -1.7(7)
C4 C5 C6 N2 -179.4(5)
C1 N1 C7 N2 1.1(5)
Zn1 N1 C7 N2 -175.7(3)
C1 N1 C7 C8 -176.4(4)
Zn1 N1 C7 C8 6.8(6)
C6 N2 C7 N1 -0.5(5)
C6 N2 C7 C8 177.0(4)
C17 N3 C8 C7 -94.0(5)
C9 N3 C8 C7 133.2(4)
Zn1 N3 C8 C7 20.8(4)
N1 C7 C8 N3 -21.0(7)
N2 C7 C8 N3 161.8(4)
C17 N3 C9 C10 145.0(4)
C8 N3 C9 C10 -81.9(5)
Zn1 N3 C9 C10 32.8(4)
C16 N5 C10 N4 -0.8(5)
Zn1 N5 C10 N4 -170.3(3)
C16 N5 C10 C9 178.8(4)
Zn1 N5 C10 C9 9.4(6)
C11 N4 C10 N5 1.9(6)
C11 N4 C10 C9 -177.7(4)
N3 C9 C10 N5 -32.8(6)
N3 C9 C10 N4 146.8(5)
C10 N4 C11 C16 -2.2(5)
C10 N4 C11 C12 174.7(6)
C16 C11 C12 C13 1.2(9)
N4 C11 C12 C13 -175.3(6)
C11 C12 C13 C14 -1.1(11)
C12 C13 C14 C15 0.0(12)
C13 C14 C15 C16 1.1(10)
C12 C11 C16 C15 -0.2(8)
N4 C11 C16 C15 177.0(5)
C12 C11 C16 N5 -175.5(5)
N4 C11 C16 N5 1.7(6)
C14 C15 C16 C11 -1.0(9)
C14 C15 C16 N5 173.3(6)
C10 N5 C16 C11 -0.6(5)
Zn1 N5 C16 C11 166.7(3)
C10 N5 C16 C15 -175.5(5)
Zn1 N5 C16 C15 -8.1(8)
C8 N3 C17 C18 149.7(4)
C9 N3 C17 C18 -77.8(5)
Zn1 N3 C17 C18 33.6(4)
C24 N7 C18 N6 -0.5(5)
Zn1 N7 C18 N6 178.6(3)
C24 N7 C18 C17 177.9(5)
Zn1 N7 C18 C17 -3.0(6)
C19 N6 C18 N7 1.5(5)
C19 N6 C18 C17 -176.9(5)
N3 C17 C18 N7 -25.6(7)
N3 C17 C18 N6 152.6(4)
C18 N6 C19 C24 -1.8(5)
C18 N6 C19 C20 176.0(5)
N6 C19 C20 C21 -178.5(5)
C24 C19 C20 C21 -1.0(8)
C19 C20 C21 C22 -0.7(8)
C20 C21 C22 C23 2.1(9)
C21 C22 C23 C24 -1.6(8)
C22 C23 C24 C19 -0.1(7)
C22 C23 C24 N7 177.3(5)
N6 C19 C24 C23 179.5(4)
C20 C19 C24 C23 1.4(8)
N6 C19 C24 N7 1.5(5)
C20 C19 C24 N7 -176.5(5)
C18 N7 C24 C23 -178.4(5)
Zn1 N7 C24 C23 2.7(8)
C18 N7 C24 C19 -0.7(5)
Zn1 N7 C24 C19 -179.6(3)
Zn1 O2 C25 O1 -8.7(4)
Zn1 O2 C25 C26 171.2(5)
Zn1 O1 C25 O2 14.1(6)
Zn1 O1 C25 C26 -165.8(3)
O2 C25 C26 C27 162.3(5)
O1 C25 C26 C27 -17.8(7)
O2 C25 C26 C31 -19.3(7)
O1 C25 C26 C31 160.6(5)
C31 C26 C27 C28 0.3(8)
C25 C26 C27 C28 178.7(5)
C26 C27 C28 C29 -1.4(9)
C27 C28 C29 C30 0.6(9)
C28 C29 C30 C31 1.2(9)
C27 C26 C31 C30 1.5(8)
C25 C26 C31 C30 -176.9(5)
C29 C30 C31 C26 -2.3(8)
