#------------------------------------------------------------------------------
#$Date: 2016-03-25 09:20:00 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179719 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/21/7002119.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_7002119
loop_
_publ_author_name
'Arnold, Polly L.'
'Casely, Ian J.'
'Turner, Zoë R.'
'Bellabarba, Ronan'
'Tooze, Robert B.'
_publ_section_title
;
 Magnesium and zinc complexes of functionalised, saturated
 N-heterocyclic carbene ligands: carbene lability and
 functionalisation, and lactide polymerisation catalysis
;
_journal_issue                   35
_journal_name_full               'Dalton Transactions'
_journal_page_first              7236
_journal_paper_doi               10.1039/b907034f
_journal_year                    2009
_chemical_formula_moiety         'C32 H74 N6 O2 Si4 Zn2, C6 H6'
_chemical_formula_sum            'C38 H80 N6 O2 Si4 Zn2'
_chemical_formula_weight         896.18
_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                112.0690(10)
_cell_angle_beta                 102.6990(10)
_cell_angle_gamma                96.5540(10)
_cell_formula_units_Z            1
_cell_length_a                   10.0409(2)
_cell_length_b                   11.4568(3)
_cell_length_c                   11.9216(3)
_cell_measurement_reflns_used    9861
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      30.5
_cell_measurement_theta_min      2.4
_cell_volume                     1210.14(5)
_computing_cell_refinement       'SAINT (Siemans, 1995)'
_computing_data_collection       'SMART (Siemans, 1993)'
_computing_data_reduction        'SAINT (Siemans, 1995)'
_computing_molecular_graphics    'ORTEP (Farrugia, 1997)'
_computing_publication_material  'enCIFer (Allen et al., 2004)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SIR-92 (Giacovazzo, 1994)'
_diffrn_ambient_temperature      150(2)
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.909
_diffrn_measurement_device_type  'Brucker SMART APEX CCD area detector'
_diffrn_measurement_method       '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  0.0251
_diffrn_reflns_av_sigmaI/netI    0.0267
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_number            19801
_diffrn_reflns_theta_full        27.50
_diffrn_reflns_theta_max         30.57
_diffrn_reflns_theta_min         1.92
_diffrn_standards_decay_%        0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    1.126
_exptl_absorpt_correction_T_max  0.82
_exptl_absorpt_correction_T_min  0.7163
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.230
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       shard
_exptl_crystal_F_000             482
_exptl_crystal_size_max          0.45
_exptl_crystal_size_mid          0.32
_exptl_crystal_size_min          0.18
_refine_diff_density_max         0.395
_refine_diff_density_min         -0.289
_refine_diff_density_rms         0.060
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.100
_refine_ls_hydrogen_treatment    riding
_refine_ls_matrix_type           full
_refine_ls_number_parameters     245
_refine_ls_number_reflns         6759
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.100
_refine_ls_R_factor_all          0.0302
_refine_ls_R_factor_gt           0.0282
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0324P)²+0.4032P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0710
_refine_ls_wR_factor_ref         0.0736
_reflns_number_gt                6435
_reflns_number_total             6759
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b907034f.txt
_cod_data_source_block           po8067
_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 
;
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7002119
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
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 1.04824(14) 0.28820(12) 0.79155(12) 0.0207(2) Uani 1 1 d . . .
C2 C 0.94864(18) 0.26902(14) 0.57288(13) 0.0298(3) Uani 1 1 d . . .
H2 H 0.8784 0.3133 0.6099 0.036 Uiso 1 1 calc R . .
C3 C 0.87364(19) 0.13226(15) 0.47666(14) 0.0343(3) Uani 1 1 d . . .
H3A H 0.9393 0.0894 0.4347 0.051 Uiso 1 1 calc R . .
H3B H 0.7953 0.1363 0.4136 0.051 Uiso 1 1 calc R . .
H3C H 0.8382 0.0834 0.5200 0.051 Uiso 1 1 calc R . .
C4 C 1.0083(3) 0.34342(18) 0.50619(17) 0.0507(5) Uani 1 1 d . . .
H4A H 1.0597 0.4299 0.5684 0.076 Uiso 1 1 calc R . .
H4B H 0.9317 0.3507 0.4438 0.076 Uiso 1 1 calc R . .
H4C H 1.0718 0.2975 0.4635 0.076 Uiso 1 1 calc R . .
C5 C 1.19130(17) 0.23333(16) 0.65778(15) 0.0330(3) Uani 1 1 d . . .
H5A H 1.2505 0.3034 0.6498 0.040 Uiso 1 1 calc R . .
H5B H 1.1760 0.1521 0.5820 0.040 Uiso 1 1 calc R . .
C6 C 1.25675(17) 0.21813(17) 0.77783(15) 0.0344(3) Uani 1 1 d . . .
H6A H 1.2571 0.1267 0.7606 0.041 Uiso 1 1 calc R . .
H6B H 1.3536 0.2702 0.8191 0.041 Uiso 1 1 calc R . .
C7 C 0.77283(18) 0.60841(16) 0.78945(14) 0.0336(3) Uani 1 1 d . . .
H7A H 0.8586 0.6634 0.7952 0.050 Uiso 1 1 calc R . .
H7B H 0.6933 0.6479 0.7731 0.050 Uiso 1 1 calc R . .
H7C H 0.7573 0.5232 0.7203 0.050 Uiso 1 1 calc R . .
C8 C 0.78731(14) 0.59403(12) 0.91367(13) 0.0223(3) Uani 1 1 d . . .
C9 C 0.81586(14) 0.73064(12) 1.01916(13) 0.0226(3) Uani 1 1 d . . .
H9A H 0.9002 0.7836 1.0179 0.027 Uiso 1 1 calc R . .
H9B H 0.7360 0.7707 1.0013 0.027 Uiso 1 1 calc R . .
C10 C 0.65379(15) 0.51084(14) 0.90790(16) 0.0309(3) Uani 1 1 d . . .
H10A H 0.6402 0.4230 0.8437 0.046 Uiso 1 1 calc R . .
H10B H 0.5737 0.5476 0.8859 0.046 Uiso 1 1 calc R . .
H10C H 0.6617 0.5085 0.9904 0.046 Uiso 1 1 calc R . .
C11 C 0.82740(18) -0.00319(14) 0.71407(15) 0.0328(3) Uani 1 1 d . . .
H11A H 0.9091 0.0495 0.7105 0.049 Uiso 1 1 calc R . .
H11B H 0.7807 -0.0718 0.6300 0.049 Uiso 1 1 calc R . .
H11C H 0.8576 -0.0416 0.7736 0.049 Uiso 1 1 calc R . .
C12 C 0.62357(17) 0.15984(15) 0.64594(14) 0.0324(3) Uani 1 1 d . . .
H12A H 0.5382 0.1882 0.6612 0.049 Uiso 1 1 calc R . .
H12B H 0.6007 0.0895 0.5616 0.049 Uiso 1 1 calc R . .
H12C H 0.6909 0.2323 0.6515 0.049 Uiso 1 1 calc R . .
C13 C 0.55112(18) -0.01687(15) 0.76200(16) 0.0360(4) Uani 1 1 d . . .
H13A H 0.5829 -0.0540 0.8223 0.054 Uiso 1 1 calc R . .
H13B H 0.5151 -0.0859 0.6766 0.054 Uiso 1 1 calc R . .
H13C H 0.4768 0.0279 0.7839 0.054 Uiso 1 1 calc R . .
C14 C 0.83321(18) 0.39630(14) 1.18026(14) 0.0313(3) Uani 1 1 d . . .
H14A H 0.9312 0.4215 1.1838 0.047 Uiso 1 1 calc R . .
H14B H 0.8286 0.3927 1.2602 0.047 Uiso 1 1 calc R . .
H14C H 0.7820 0.4598 1.1663 0.047 Uiso 1 1 calc R . .
C15 C 0.8269(2) 0.11068(17) 1.09558(18) 0.0411(4) Uani 1 1 d . . .
H15A H 0.7837 0.0242 1.0288 0.062 Uiso 1 1 calc R . .
H15B H 0.8073 0.1163 1.1742 0.062 Uiso 1 1 calc R . .
H15C H 0.9283 0.1271 1.1085 0.062 Uiso 1 1 calc R . .
C16 C 0.56387(17) 0.20942(16) 1.04613(16) 0.0338(3) Uani 1 1 d . . .
H16A H 0.5167 0.2609 1.0073 0.051 Uiso 1 1 calc R . .
H16B H 0.5578 0.2365 1.1329 0.051 Uiso 1 1 calc R . .
H16C H 0.5187 0.1179 0.9973 0.051 Uiso 1 1 calc R . .
C100 C 0.55507(19) 0.39445(17) 0.44633(17) 0.0397(4) Uani 1 1 d . . .
H100 H 0.5933 0.3219 0.4096 0.048 Uiso 1 1 calc R . .
C101 C 0.5957(2) 0.50736(19) 0.43514(19) 0.0439(4) Uani 1 1 d . . .
H101 H 0.6616 0.5125 0.3901 0.053 Uiso 1 1 calc R . .
C102 C 0.5411(2) 0.61307(17) 0.48900(18) 0.0429(4) Uani 1 1 d . . .
H102 H 0.5700 0.6910 0.4815 0.051 Uiso 1 1 calc R . .
N1 N 1.16326(12) 0.26696(11) 0.85486(11) 0.0230(2) Uani 1 1 d . . .
N2 N 1.05739(13) 0.26597(11) 0.67545(11) 0.0249(2) Uani 1 1 d . . .
N3 N 0.77831(12) 0.22905(10) 0.90972(10) 0.0204(2) Uani 1 1 d . . .
O1 O 0.90412(10) 0.53974(8) 0.93916(9) 0.02007(18) Uani 1 1 d . . .
Si1 Si 0.70220(4) 0.10127(3) 0.76807(3) 0.02260(8) Uani 1 1 d . . .
Si2 Si 0.75309(4) 0.23425(3) 1.04797(3) 0.02113(8) Uani 1 1 d . . .
Zn1 Zn 0.921841(15) 0.361230(13) 0.909075(13) 0.01798(5) 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'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Si Si 0.0817 0.0704 '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_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
N1 C1 N2 108.25(12) . . ?
N1 C1 Zn1 111.14(9) . . ?
N2 C1 Zn1 140.28(11) . . ?
N2 C2 C4 111.70(14) . . ?
N2 C2 C3 110.82(12) . . ?
C4 C2 C3 109.45(13) . . ?
N2 C2 H2 108.3 . . ?
C4 C2 H2 108.3 . . ?
C3 C2 H2 108.3 . . ?
C2 C3 H3A 109.5 . . ?
C2 C3 H3B 109.5 . . ?
H3A C3 H3B 109.5 . . ?
C2 C3 H3C 109.5 . . ?
H3A C3 H3C 109.5 . . ?
H3B C3 H3C 109.5 . . ?
C2 C4 H4A 109.5 . . ?
C2 C4 H4B 109.5 . . ?
H4A C4 H4B 109.5 . . ?
C2 C4 H4C 109.5 . . ?
H4A C4 H4C 109.5 . . ?
H4B C4 H4C 109.5 . . ?
N2 C5 C6 102.81(12) . . ?
N2 C5 H5A 111.2 . . ?
C6 C5 H5A 111.2 . . ?
N2 C5 H5B 111.2 . . ?
C6 C5 H5B 111.2 . . ?
H5A C5 H5B 109.1 . . ?
N1 C6 C5 101.95(12) . . ?
N1 C6 H6A 111.4 . . ?
C5 C6 H6A 111.4 . . ?
N1 C6 H6B 111.4 . . ?
C5 C6 H6B 111.4 . . ?
H6A C6 H6B 109.2 . . ?
C8 C7 H7A 109.5 . . ?
C8 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
C8 C7 H7C 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
O1 C8 C10 110.81(11) . . ?
O1 C8 C7 109.67(12) . . ?
C10 C8 C7 110.47(12) . . ?
O1 C8 C9 107.95(10) . . ?
C10 C8 C9 110.57(12) . . ?
C7 C8 C9 107.27(11) . . ?
N1 C9 C8 113.73(11) 2_767 . ?
N1 C9 H9A 108.8 2_767 . ?
C8 C9 H9A 108.8 . . ?
N1 C9 H9B 108.8 2_767 . ?
C8 C9 H9B 108.8 . . ?
H9A C9 H9B 107.7 . . ?
C8 C10 H10A 109.5 . . ?
C8 C10 H10B 109.5 . . ?
H10A C10 H10B 109.5 . . ?
C8 C10 H10C 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 109.5 . . ?
Si1 C11 H11A 109.5 . . ?
Si1 C11 H11B 109.5 . . ?
H11A C11 H11B 109.5 . . ?
Si1 C11 H11C 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
Si1 C12 H12A 109.5 . . ?
Si1 C12 H12B 109.5 . . ?
H12A C12 H12B 109.5 . . ?
Si1 C12 H12C 109.5 . . ?
H12A C12 H12C 109.5 . . ?
H12B C12 H12C 109.5 . . ?
Si1 C13 H13A 109.5 . . ?
Si1 C13 H13B 109.5 . . ?
H13A C13 H13B 109.5 . . ?
Si1 C13 H13C 109.5 . . ?
H13A C13 H13C 109.5 . . ?
H13B C13 H13C 109.5 . . ?
Si2 C14 H14A 109.5 . . ?
Si2 C14 H14B 109.5 . . ?
H14A C14 H14B 109.5 . . ?
Si2 C14 H14C 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
Si2 C15 H15A 109.5 . . ?
Si2 C15 H15B 109.5 . . ?
H15A C15 H15B 109.5 . . ?
Si2 C15 H15C 109.5 . . ?
H15A C15 H15C 109.5 . . ?
H15B C15 H15C 109.5 . . ?
Si2 C16 H16A 109.5 . . ?
Si2 C16 H16B 109.5 . . ?
H16A C16 H16B 109.5 . . ?
Si2 C16 H16C 109.5 . . ?
H16A C16 H16C 109.5 . . ?
H16B C16 H16C 109.5 . . ?
C101 C100 C102 119.72(18) . 2_666 ?
C101 C100 H100 120.1 . . ?
C102 C100 H100 120.1 2_666 . ?
C100 C101 C102 120.34(18) . . ?
C100 C101 H101 119.8 . . ?
C102 C101 H101 119.8 . . ?
C100 C102 C101 119.95(16) 2_666 . ?
C100 C102 H102 120.0 2_666 . ?
C101 C102 H102 120.0 . . ?
C1 N1 C9 123.84(11) . 2_767 ?
C1 N1 C6 113.45(12) . . ?
C9 N1 C6 121.86(12) 2_767 . ?
C1 N2 C2 125.82(13) . . ?
C1 N2 C5 112.46(12) . . ?
C2 N2 C5 121.70(12) . . ?
Si2 N3 Si1 123.20(7) . . ?
Si2 N3 Zn1 120.71(6) . . ?
Si1 N3 Zn1 115.45(6) . . ?
C8 O1 Zn1 132.44(8) . . ?
C8 O1 Zn1 122.75(7) . 2_767 ?
Zn1 O1 Zn1 99.40(4) . 2_767 ?
N3 Si1 C12 109.95(6) . . ?
N3 Si1 C11 112.54(7) . . ?
C12 Si1 C11 110.89(8) . . ?
N3 Si1 C13 116.24(7) . . ?
C12 Si1 C13 103.56(8) . . ?
C11 Si1 C13 103.17(8) . . ?
N3 Si2 C14 111.53(6) . . ?
N3 Si2 C15 112.88(7) . . ?
C14 Si2 C15 107.90(8) . . ?
N3 Si2 C16 113.87(7) . . ?
C14 Si2 C16 103.43(7) . . ?
C15 Si2 C16 106.61(9) . . ?
N3 Zn1 O1 124.76(4) . . ?
N3 Zn1 O1 121.82(4) . 2_767 ?
O1 Zn1 O1 80.60(4) . 2_767 ?
N3 Zn1 C1 114.71(5) . . ?
O1 Zn1 C1 114.45(4) . . ?
O1 Zn1 C1 90.85(4) 2_767 . ?
N3 Zn1 Zn1 135.96(3) . 2_767 ?
O1 Zn1 Zn1 41.28(3) . 2_767 ?
O1 Zn1 Zn1 39.33(3) 2_767 2_767 ?
C1 Zn1 Zn1 106.01(3) . 2_767 ?
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 N1 1.3348(18) . ?
C1 N2 1.3361(17) . ?
C1 Zn1 2.1017(13) . ?
C2 N2 1.4637(19) . ?
C2 C4 1.523(2) . ?
C2 C3 1.529(2) . ?
C2 H2 1.0000 . ?
C3 H3A 0.9800 . ?
C3 H3B 0.9800 . ?
C3 H3C 0.9800 . ?
C4 H4A 0.9800 . ?
C4 H4B 0.9800 . ?
C4 H4C 0.9800 . ?
C5 N2 1.474(2) . ?
C5 C6 1.520(2) . ?
C5 H5A 0.9900 . ?
C5 H5B 0.9900 . ?
C6 N1 1.4664(18) . ?
C6 H6A 0.9900 . ?
C6 H6B 0.9900 . ?
C7 C8 1.528(2) . ?
C7 H7A 0.9800 . ?
C7 H7B 0.9800 . ?
C7 H7C 0.9800 . ?
C8 O1 1.4165(16) . ?
C8 C10 1.526(2) . ?
C8 C9 1.5406(18) . ?
C9 N1 1.4593(18) 2_767 ?
C9 H9A 0.9900 . ?
C9 H9B 0.9900 . ?
C10 H10A 0.9800 . ?
C10 H10B 0.9800 . ?
C10 H10C 0.9800 . ?
C11 Si1 1.8835(16) . ?
C11 H11A 0.9800 . ?
C11 H11B 0.9800 . ?
C11 H11C 0.9800 . ?
C12 Si1 1.8823(16) . ?
C12 H12A 0.9800 . ?
C12 H12B 0.9800 . ?
C12 H12C 0.9800 . ?
C13 Si1 1.8836(16) . ?
C13 H13A 0.9800 . ?
C13 H13B 0.9800 . ?
C13 H13C 0.9800 . ?
C14 Si2 1.8661(15) . ?
C14 H14A 0.9800 . ?
C14 H14B 0.9800 . ?
C14 H14C 0.9800 . ?
C15 Si2 1.8802(17) . ?
C15 H15A 0.9800 . ?
C15 H15B 0.9800 . ?
C15 H15C 0.9800 . ?
C16 Si2 1.8828(16) . ?
C16 H16A 0.9800 . ?
C16 H16B 0.9800 . ?
C16 H16C 0.9800 . ?
C100 C101 1.375(3) . ?
C100 C102 1.376(3) 2_666 ?
C100 H100 0.9500 . ?
C101 C102 1.379(3) . ?
C101 H101 0.9500 . ?
C102 C100 1.376(3) 2_666 ?
C102 H102 0.9500 . ?
N1 C9 1.4593(18) 2_767 ?
N3 Si2 1.7021(12) . ?
N3 Si1 1.7025(11) . ?
N3 Zn1 1.9712(11) . ?
O1 Zn1 1.9756(9) . ?
O1 Zn1 2.0565(9) 2_767 ?
Zn1 O1 2.0565(9) 2_767 ?
Zn1 Zn1 3.0755(3) 2_767 ?
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
N2 C5 C6 N1 -9.84(15) . . . . ?
O1 C8 C9 N1 -60.02(14) . . . 2_767 ?
C10 C8 C9 N1 61.34(15) . . . 2_767 ?
C7 C8 C9 N1 -178.14(12) . . . 2_767 ?
C102 C100 C101 C102 0.4(3) 2_666 . . . ?
C100 C101 C102 C100 -0.4(3) . . . 2_666 ?
N2 C1 N1 C9 -173.79(12) . . . 2_767 ?
Zn1 C1 N1 C9 11.44(15) . . . 2_767 ?
N2 C1 N1 C6 -4.15(16) . . . . ?
Zn1 C1 N1 C6 -178.92(10) . . . . ?
C5 C6 N1 C1 9.16(17) . . . . ?
C5 C6 N1 C9 179.03(12) . . . 2_767 ?
N1 C1 N2 C2 175.29(12) . . . . ?
Zn1 C1 N2 C2 -12.4(2) . . . . ?
N1 C1 N2 C5 -3.18(16) . . . . ?
Zn1 C1 N2 C5 169.17(12) . . . . ?
C4 C2 N2 C1 134.37(15) . . . . ?
C3 C2 N2 C1 -103.31(16) . . . . ?
C4 C2 N2 C5 -47.30(19) . . . . ?
C3 C2 N2 C5 75.02(18) . . . . ?
C6 C5 N2 C1 8.59(16) . . . . ?
C6 C5 N2 C2 -169.94(13) . . . . ?
C10 C8 O1 Zn1 25.31(16) . . . . ?
C7 C8 O1 Zn1 -96.91(13) . . . . ?
C9 C8 O1 Zn1 146.52(9) . . . . ?
C10 C8 O1 Zn1 -123.03(10) . . . 2_767 ?
C7 C8 O1 Zn1 114.75(11) . . . 2_767 ?
C9 C8 O1 Zn1 -1.82(14) . . . 2_767 ?
Si2 N3 Si1 C12 132.86(9) . . . . ?
Zn1 N3 Si1 C12 -56.24(9) . . . . ?
Si2 N3 Si1 C11 -102.99(9) . . . . ?
Zn1 N3 Si1 C11 67.91(9) . . . . ?
Si2 N3 Si1 C13 15.67(12) . . . . ?
Zn1 N3 Si1 C13 -173.44(7) . . . . ?
Si1 N3 Si2 C14 -172.58(8) . . . . ?
Zn1 N3 Si2 C14 16.98(10) . . . . ?
Si1 N3 Si2 C15 65.74(11) . . . . ?
Zn1 N3 Si2 C15 -104.69(9) . . . . ?
Si1 N3 Si2 C16 -55.99(10) . . . . ?
Zn1 N3 Si2 C16 133.58(8) . . . . ?
Si2 N3 Zn1 O1 -75.18(8) . . . . ?
Si1 N3 Zn1 O1 113.68(6) . . . . ?
Si2 N3 Zn1 O1 26.16(9) . . . 2_767 ?
Si1 N3 Zn1 O1 -144.98(6) . . . 2_767 ?
Si2 N3 Zn1 C1 133.92(7) . . . . ?
Si1 N3 Zn1 C1 -37.22(8) . . . . ?
Si2 N3 Zn1 Zn1 -21.93(10) . . . 2_767 ?
Si1 N3 Zn1 Zn1 166.93(3) . . . 2_767 ?
C8 O1 Zn1 N3 -31.03(13) . . . . ?
Zn1 O1 Zn1 N3 122.39(5) 2_767 . . . ?
C8 O1 Zn1 O1 -153.42(13) . . . 2_767 ?
Zn1 O1 Zn1 O1 0.0 2_767 . . 2_767 ?
C8 O1 Zn1 C1 119.94(11) . . . . ?
Zn1 O1 Zn1 C1 -86.64(5) 2_767 . . . ?
C8 O1 Zn1 Zn1 -153.42(13) . . . 2_767 ?
N1 C1 Zn1 N3 -91.71(10) . . . . ?
N2 C1 Zn1 N3 96.08(15) . . . . ?
N1 C1 Zn1 O1 114.32(9) . . . . ?
N2 C1 Zn1 O1 -57.89(16) . . . . ?
N1 C1 Zn1 O1 34.26(9) . . . 2_767 ?
N2 C1 Zn1 O1 -137.95(15) . . . 2_767 ?
N1 C1 Zn1 Zn1 71.07(9) . . . 2_767 ?
N2 C1 Zn1 Zn1 -101.13(15) . . . 2_767 ?
