#------------------------------------------------------------------------------
#$Date: 2016-03-26 19:36:37 +0100 (Sat 26 de Mar de 2016) $
#$Revision: 180441 $
#$URL: svn://www.crystallography.net/cod/cif/7/21/10/7211018.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_7211018
loop_
_publ_author_name
'Zhang, Muwei'
'Chen, Ying-Pin'
'Zhou, Hong-Cai'
_publ_section_title
;
 Structural design of porous coordination networks from tetrahedral
 building units
;
_journal_issue                   45
_journal_name_full               CrystEngComm
_journal_page_first              9544
_journal_paper_doi               10.1039/c3ce41105b
_journal_volume                  15
_journal_year                    2013
_chemical_formula_moiety
'Zn4O2 Zn3O4 Zn2O (C28 H16 O8 Si)2 (C28 H17 O8 Si)2'
_chemical_formula_sum            'C112 H66 O39 Si4 Zn9'
_chemical_formula_weight         2736.34
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/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                 99.005(8)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   38.22(2)
_cell_length_b                   29.788(19)
_cell_length_c                   25.377(16)
_cell_measurement_reflns_used    9890
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      16.3619
_cell_measurement_theta_min      2.1948
_cell_volume                     28536(3)
_computing_cell_refinement       'SAINT+ ver. (Bruker, 2001)'
_computing_data_collection       'APEX2  (Bruker, 2008)'
_computing_data_reduction        'SAINT+ ver. (Bruker, 2001)'
_computing_molecular_graphics    'SHELXTL (Sheldrick, 2008)'
_computing_publication_material  'SHELXTL (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 0.990
_diffrn_measured_fraction_theta_max 0.990
_diffrn_measurement_device_type  'Bruker SMART APEX II 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  0.1245
_diffrn_reflns_av_sigmaI/netI    0.2692
_diffrn_reflns_limit_h_max       51
_diffrn_reflns_limit_h_min       -51
_diffrn_reflns_limit_k_max       39
_diffrn_reflns_limit_k_min       -39
_diffrn_reflns_limit_l_max       33
_diffrn_reflns_limit_l_min       -34
_diffrn_reflns_number            346308
_diffrn_reflns_theta_full        28.56
_diffrn_reflns_theta_max         28.56
_diffrn_reflns_theta_min         1.59
_exptl_absorpt_coefficient_mu    0.793
_exptl_absorpt_correction_T_max  0.8575
_exptl_absorpt_correction_T_min  0.7968
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS (Sheldrick, 2008)'
_exptl_crystal_colour            Colorless
_exptl_crystal_density_diffrn    0.637
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Blocky
_exptl_crystal_F_000             5504
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.20
_platon_squeeze_details
;
;
_refine_diff_density_max         1.125
_refine_diff_density_min         -0.924
_refine_diff_density_rms         0.065
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.001
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     613
_refine_ls_number_reflns         72070
_refine_ls_number_restraints     17
_refine_ls_restrained_S_all      1.002
_refine_ls_R_factor_all          0.2487
_refine_ls_R_factor_gt           0.0803
_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)+(0.0380P)²+0.5000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1782
_refine_ls_wR_factor_ref         0.1895
_reflns_number_gt                16081
_reflns_number_total             72070
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c3ce41105b.txt
_cod_data_source_block           p21c_sq
_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 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 1891 2012-01-12 08:04:46Z andrius 

The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'not measured' was changed to '?'
- the value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_original_cell_volume        28536(30)
_cod_original_sg_symbol_H-M      P2(1)/c
_cod_database_code               7211018
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -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
Zn1 Zn 0.450049(15) 0.445127(17) 0.75668(2) 0.06380(18) Uani 1 1 d .
Zn2 Zn 0.521194(15) 0.392759(18) 0.74051(2) 0.06872(19) Uani 1 1 d .
Zn3 Zn 0.841248(19) 0.60239(2) 0.91065(3) 0.1062(3) Uani 1 1 d .
Zn4 Zn 0.840079(18) 0.54059(2) 1.01952(3) 0.0970(2) Uani 1 1 d .
Zn5 Zn 0.446954(15) 0.393535(18) 0.64905(2) 0.06572(18) Uani 1 1 d .
Zn6 Zn 0.451211(16) 0.344799(18) 0.75959(2) 0.07070(19) Uani 1 1 d .
Zn7 Zn 0.140418(19) 0.14935(2) 0.46960(3) 0.1050(3) Uani 1 1 d .
Zn8 Zn 0.16750(2) 0.63330(3) 0.52557(4) 0.1259(3) Uani 1 1 d .
Zn9 Zn 0.91676(2) 0.40719(3) 0.47150(4) 0.1513(4) Uani 1 1 d .
Si1 Si 0.61742(4) 0.61419(4) 0.93473(5) 0.0618(4) Uani 1 1 d .
Si2 Si 0.21946(4) 0.37708(6) 0.67181(7) 0.0926(5) Uani 1 1 d .
Si3 Si 0.92190(5) 0.34521(7) 0.80892(8) 0.1257(7) Uani 1 1 d .
Si4 Si 0.39302(4) 0.67376(5) 0.54746(6) 0.0823(5) Uani 1 1 d .
O1S O 0.46989(7) 0.39325(8) 0.72514(12) 0.0649(9) Uani 1 1 d .
O1 O 0.54358(8) 0.44880(10) 0.76794(13) 0.0852(11) Uani 1 1 d .
O2 O 0.49495(9) 0.47607(10) 0.79489(12) 0.0747(5) Uani 1 1 d .
O2S O 0.86313(9) 0.59453(11) 0.99111(13) 0.0967(12) Uani 1 1 d .
O3 O 0.56094(8) 0.56734(10) 1.17310(12) 0.0744(5) Uani 1 1 d .
O3S O 0.82097(15) 0.61573(17) 0.8232(2) 0.1952(10) Uani 1 1 d .
O4 O 0.57339(10) 0.64205(11) 1.18124(14) 0.1014(12) Uani 1 1 d .
O4S O 0.88651(15) 0.64146(17) 0.9044(2) 0.1952(10) Uani 1 1 d .
O5 O 0.55406(9) 0.82256(10) 0.85736(12) 0.0810(10) Uani 1 1 d .
O5S O 0.84475(15) 0.48264(17) 1.0650(2) 0.1952(10) Uani 1 1 d .
O6 O 0.57592(9) 0.79977(10) 0.78536(13) 0.0829(6) Uani 1 1 d .
O7S O 0.45953(15) 0.39288(17) 0.5753(2) 0.1952(10) Uani 1 1 d .
O7 O 0.78904(8) 0.54920(12) 0.99709(13) 0.1017(12) Uani 1 1 d D
O8 O 0.79263(9) 0.58215(15) 0.91735(15) 0.1286(15) Uani 1 1 d D
O9 O 0.16061(10) 0.42927(13) 0.90357(14) 0.1045(7) Uani 1 1 d .
O10 O 0.17581(10) 0.35841(14) 0.92046(17) 0.1212(14) Uani 1 1 d .
O11 O 0.39511(8) 0.39165(10) 0.65034(15) 0.0936(11) Uani 1 1 d .
O12 O 0.39544(9) 0.42167(14) 0.72820(15) 0.1089(7) Uani 1 1 d .
O13 O 0.18285(14) 0.16585(14) 0.57392(19) 0.182(2) Uani 1 1 d D
O14 O 0.15133(11) 0.20561(12) 0.50609(15) 0.1204(14) Uani 1 1 d D
O15 O 0.11641(15) 0.54404(18) 0.5543(2) 0.160(2) Uani 1 1 d .
O16 O 0.16660(16) 0.56915(18) 0.5433(2) 0.157(2) Uani 1 1 d .
O17 O 0.85854(10) 0.54238(14) 0.89007(15) 0.1173(14) Uani 1 1 d .
O18 O 0.85253(11) 0.49905(13) 0.95957(17) 0.1218(8) Uani 1 1 d .
O19 O 0.85985(15) 0.35434(17) 0.54508(19) 0.171(2) Uani 1 1 d .
O20 O 0.90823(14) 0.3900(2) 0.5436(2) 0.174(2) Uani 1 1 d .
O21 O 0.90642(14) 0.14744(17) 0.9396(2) 0.1703(19) Uani 1 1 d .
O22 O 0.84950(14) 0.16720(17) 0.9177(2) 0.1722(7) Uani 1 1 d .
O23 O 1.09500(13) 0.34275(17) 0.9220(2) 0.1722(7) Uani 1 1 d D
O24 O 1.07512(12) 0.34423(16) 0.99331(18) 0.1722(7) Uani 1 1 d D
H24B H 1.0930 0.3595 1.0058 0.258 Uiso 1 1 calc R
O25 O 0.44584(9) 0.46426(11) 0.63936(13) 0.0852(6) Uani 1 1 d .
O26 O 0.43766(10) 0.49825(10) 0.71438(15) 0.1096(13) Uani 1 1 d .
O27 O 0.21668(11) 0.64116(15) 0.5324(2) 0.1497(8) Uani 1 1 d .
O28 O 0.21446(11) 0.71087(15) 0.5056(2) 0.1497(8) Uani 1 1 d .
O29 O 0.50865(13) 0.80774(15) 0.70133(19) 0.1480(7) Uani 1 1 d .
O30 O 0.46303(9) 0.85132(13) 0.70109(15) 0.1057(13) Uani 1 1 d .
O31 O 0.40429(11) 0.63204(14) 0.28288(17) 0.1480(7) Uani 1 1 d D
H31A H 0.4127 0.6346 0.2544 0.222 Uiso 1 1 calc R
O32 O 0.46130(12) 0.62733(14) 0.32286(18) 0.1480(7) Uani 1 1 d D
O6S O 0.96952(15) 0.41695(17) 0.4840(2) 0.1952(10) Uani 1 1 d .
C1 C 0.52728(15) 0.47527(17) 0.7957(2) 0.0747(5) Uani 1 1 d .
C2 C 0.55016(8) 0.51030(9) 0.82494(11) 0.0747(5) Uani 1 1 d G
C3 C 0.58685(8) 0.50644(9) 0.83397(12) 0.0747(5) Uani 1 1 d G
H3A H 0.5980 0.4825 0.8182 0.090 Uiso 1 1 calc R
C4 C 0.60724(6) 0.53758(10) 0.86606(12) 0.0747(5) Uani 1 1 d G
H4A H 0.6323 0.5349 0.8722 0.090 Uiso 1 1 calc R
C5 C 0.59093(8) 0.57258(9) 0.88912(11) 0.0747(5) Uani 1 1 d G
C6 C 0.55424(8) 0.57644(9) 0.88009(12) 0.0747(5) Uani 1 1 d G
H6A H 0.5431 0.6004 0.8959 0.090 Uiso 1 1 calc R
C7 C 0.53385(6) 0.54530(10) 0.84800(12) 0.0747(5) Uani 1 1 d G
H7A H 0.5088 0.5479 0.8418 0.090 Uiso 1 1 calc R
C11 C 0.57178(13) 0.60376(19) 1.1563(2) 0.0744(5) Uani 1 1 d .
C12 C 0.58613(8) 0.60494(11) 1.10455(10) 0.0744(5) Uani 1 1 d G
C13 C 0.57511(7) 0.57182(9) 1.06702(13) 0.0744(5) Uani 1 1 d G
H13A H 0.5609 0.5477 1.0758 0.089 Uiso 1 1 calc R
C14 C 0.58492(8) 0.57407(9) 1.01661(11) 0.0744(5) Uani 1 1 d G
H14A H 0.5774 0.5514 0.9910 0.089 Uiso 1 1 calc R
C15 C 0.60575(8) 0.60943(10) 1.00372(10) 0.0744(5) Uani 1 1 d G
C16 C 0.61678(8) 0.64255(9) 1.04125(13) 0.0744(5) Uani 1 1 d G
H16A H 0.6310 0.6667 1.0324 0.089 Uiso 1 1 calc R
C17 C 0.60696(8) 0.64030(9) 1.09167(11) 0.0744(5) Uani 1 1 d G
H17A H 0.6145 0.6629 1.1173 0.089 Uiso 1 1 calc R
C21 C 0.56913(15) 0.79651(17) 0.8323(2) 0.0829(6) Uani 1 1 d .
C22 C 0.58267(9) 0.75260(8) 0.85785(12) 0.0829(6) Uani 1 1 d G
C23 C 0.57808(9) 0.74411(9) 0.91019(12) 0.0829(6) Uani 1 1 d G
H23A H 0.5674 0.7661 0.9297 0.099 Uiso 1 1 calc R
C24 C 0.58908(9) 0.70343(10) 0.93405(10) 0.0829(6) Uani 1 1 d G
H24A H 0.5859 0.6976 0.9698 0.099 Uiso 1 1 calc R
C25 C 0.60468(9) 0.67124(8) 0.90556(12) 0.0829(6) Uani 1 1 d G
C26 C 0.60927(9) 0.67973(9) 0.85322(12) 0.0829(6) Uani 1 1 d G
H26A H 0.6199 0.6577 0.8337 0.099 Uiso 1 1 calc R
C27 C 0.59826(9) 0.72041(10) 0.82936(10) 0.0829(6) Uani 1 1 d G
H27A H 0.6014 0.7262 0.7936 0.099 Uiso 1 1 calc R
C31 C 0.77547(7) 0.56791(14) 0.95327(15) 0.0952(7) Uani 1 1 d D
C32 C 0.73697(6) 0.58120(10) 0.94623(13) 0.0952(7) Uani 1 1 d GD
C33 C 0.72194(9) 0.61203(11) 0.90817(12) 0.0952(7) Uani 1 1 d GD
H33A H 0.7361 0.6258 0.8851 0.114 Uiso 1 1 calc R
C34 C 0.68620(9) 0.62272(10) 0.90389(12) 0.0952(7) Uani 1 1 d GD
H34A H 0.6759 0.6438 0.8779 0.114 Uiso 1 1 calc R
C35 C 0.66551(6) 0.60260(11) 0.93767(14) 0.0952(7) Uani 1 1 d GD
C36 C 0.68054(9) 0.57178(11) 0.97572(13) 0.0952(7) Uani 1 1 d GD
H36A H 0.6664 0.5580 0.9988 0.114 Uiso 1 1 calc R
C37 C 0.71627(9) 0.56108(10) 0.98000(12) 0.0952(7) Uani 1 1 d GD
H37A H 0.7266 0.5400 1.0060 0.114 Uiso 1 1 calc R
C41 C 0.17326(16) 0.3921(3) 0.8911(3) 0.1045(7) Uani 1 1 d .
C42 C 0.18448(10) 0.38847(14) 0.84089(12) 0.1045(7) Uani 1 1 d G
C43 C 0.18057(9) 0.42501(10) 0.80641(16) 0.1045(7) Uani 1 1 d G
H43A H 0.1707 0.4522 0.8169 0.125 Uiso 1 1 calc R
C44 C 0.19113(10) 0.42174(11) 0.75656(14) 0.1045(7) Uani 1 1 d G
H44A H 0.1885 0.4467 0.7330 0.125 Uiso 1 1 calc R
C45 C 0.20561(10) 0.38192(14) 0.74121(12) 0.1045(7) Uani 1 1 d G
C46 C 0.20953(9) 0.34538(10) 0.77569(16) 0.1045(7) Uani 1 1 d G
H46A H 0.2194 0.3182 0.7652 0.125 Uiso 1 1 calc R
C47 C 0.19896(9) 0.34865(11) 0.82554(14) 0.1045(7) Uani 1 1 d G
H47A H 0.2016 0.3237 0.8491 0.125 Uiso 1 1 calc R
C51 C 0.37896(16) 0.4019(2) 0.6896(3) 0.1089(7) Uani 1 1 d .
C52 C 0.34187(7) 0.39522(13) 0.68545(16) 0.1089(7) Uani 1 1 d G
C53 C 0.32292(9) 0.37361(13) 0.64146(13) 0.1089(7) Uani 1 1 d G
H53A H 0.3348 0.3632 0.6136 0.131 Uiso 1 1 calc R
C54 C 0.28663(9) 0.36715(13) 0.63831(13) 0.1089(7) Uani 1 1 d G
H54A H 0.2737 0.3524 0.6082 0.131 Uiso 1 1 calc R
C55 C 0.26929(7) 0.38231(13) 0.67915(16) 0.1089(7) Uani 1 1 d G
C56 C 0.28824(9) 0.40393(13) 0.72314(13) 0.1089(7) Uani 1 1 d G
H56A H 0.2764 0.4143 0.7511 0.131 Uiso 1 1 calc R
C57 C 0.32453(9) 0.41038(12) 0.72629(13) 0.1089(7) Uani 1 1 d G
H57A H 0.3375 0.4252 0.7564 0.131 Uiso 1 1 calc R
C61 C 0.17079(17) 0.20216(11) 0.5514(2) 0.1248(9) Uani 1 1 d D
C62 C 0.18280(11) 0.24461(11) 0.58118(17) 0.1248(9) Uani 1 1 d GD
C63 C 0.20190(11) 0.24293(10) 0.63248(17) 0.1248(9) Uani 1 1 d G
H63A H 0.2075 0.2148 0.6492 0.150 Uiso 1 1 calc R
C64 C 0.21278(10) 0.28246(14) 0.65923(13) 0.1248(9) Uani 1 1 d G
H64A H 0.2258 0.2813 0.6943 0.150 Uiso 1 1 calc R
C65 C 0.20456(10) 0.32367(11) 0.63469(16) 0.1248(9) Uani 1 1 d G
C66 C 0.18547(11) 0.32535(11) 0.58340(16) 0.1248(9) Uani 1 1 d G
H66A H 0.1799 0.3535 0.5666 0.150 Uiso 1 1 calc R
C67 C 0.17459(10) 0.28582(15) 0.55664(12) 0.1248(9) Uani 1 1 d G
H67A H 0.1615 0.2870 0.5216 0.150 Uiso 1 1 calc R
C71 C 0.1473(3) 0.5378(4) 0.5600(5) 0.170(4) Uani 1 1 d .
C72 C 0.1647(2) 0.49839(19) 0.57991(17) 0.109(2) Uani 1 1 d G
C73 C 0.20141(19) 0.49440(18) 0.58838(19) 0.132(3) Uani 1 1 d G
H73A H 0.2156 0.5173 0.5764 0.158 Uiso 1 1 calc R
C74 C 0.21740(10) 0.4569(2) 0.6144(2) 0.114(2) Uani 1 1 d G
H74A H 0.2425 0.4542 0.6202 0.137 Uiso 1 1 calc R
C75 C 0.1967(2) 0.42339(16) 0.63202(17) 0.099(2) Uani 1 1 d G
C76 C 0.16001(19) 0.4274(2) 0.6236(2) 0.149(3) Uani 1 1 d G
H76A H 0.1459 0.4045 0.6356 0.179 Uiso 1 1 calc R
C77 C 0.14403(10) 0.4649(3) 0.5975(2) 0.137(3) Uani 1 1 d G
H77A H 0.1190 0.4676 0.5917 0.165 Uiso 1 1 calc R
C81 C 0.85669(18) 0.5052(3) 0.9141(3) 0.1218(8) Uani 1 1 d .
C82 C 0.87081(10) 0.46454(13) 0.88675(17) 0.1218(8) Uani 1 1 d G
C83 C 0.88093(10) 0.46894(11) 0.83673(17) 0.1218(8) Uani 1 1 d G
H83A H 0.8793 0.4973 0.8194 0.146 Uiso 1 1 calc R
C84 C 0.89347(10) 0.43188(16) 0.81213(12) 0.1218(8) Uani 1 1 d G
H84A H 0.9004 0.4349 0.7779 0.146 Uiso 1 1 calc R
C85 C 0.89589(10) 0.39041(12) 0.83754(17) 0.1218(8) Uani 1 1 d G
C86 C 0.88576(10) 0.38600(11) 0.88757(17) 0.1218(8) Uani 1 1 d G
H86A H 0.8874 0.3577 0.9049 0.146 Uiso 1 1 calc R
C87 C 0.87322(10) 0.42306(16) 0.91217(12) 0.1218(8) Uani 1 1 d G
H87A H 0.8663 0.4201 0.9464 0.146 Uiso 1 1 calc R
C91 C 0.8894(3) 0.3688(4) 0.5694(4) 0.1722(7) Uani 1 1 d .
C92 C 0.89765(16) 0.36058(18) 0.62451(16) 0.1722(7) Uani 1 1 d G
C93 C 0.92772(13) 0.37992(15) 0.6536(2) 0.1722(7) Uani 1 1 d G
H93A H 0.9433 0.3971 0.6359 0.207 Uiso 1 1 calc R
C94 C 0.93497(11) 0.37419(16) 0.7086(2) 0.1722(7) Uani 1 1 d G
H94A H 0.9555 0.3874 0.7284 0.207 Uiso 1 1 calc R
C95 C 0.91213(16) 0.34912(18) 0.73449(16) 0.1722(7) Uani 1 1 d G
C96 C 0.88206(13) 0.32977(15) 0.7054(2) 0.1722(7) Uani 1 1 d G
H96A H 0.8665 0.3126 0.7231 0.207 Uiso 1 1 calc R
C97 C 0.87481(11) 0.33550(16) 0.6504(2) 0.1722(7) Uani 1 1 d G
H97A H 0.8543 0.3223 0.6306 0.207 Uiso 1 1 calc R
C101 C 0.8822(3) 0.1722(2) 0.9151(3) 0.1722(7) Uani 1 1 d D
C102 C 0.88942(17) 0.21230(15) 0.88207(19) 0.1722(7) Uani 1 1 d GD
C103 C 0.86318(10) 0.2429(2) 0.8621(2) 0.1722(7) Uani 1 1 d G
H10A H 0.8391 0.2368 0.8649 0.207 Uiso 1 1 calc R
C104 C 0.87212(14) 0.28226(17) 0.83805(19) 0.1722(7) Uani 1 1 d G
H10B H 0.8542 0.3031 0.8244 0.207 Uiso 1 1 calc R
C105 C 0.90730(17) 0.29109(15) 0.83394(19) 0.1722(7) Uani 1 1 d G
C106 C 0.93354(10) 0.2605(2) 0.8539(2) 0.1722(7) Uani 1 1 d G
H10C H 0.9576 0.2666 0.8511 0.207 Uiso 1 1 calc R
C107 C 0.92460(14) 0.22114(17) 0.87796(19) 0.1722(7) Uani 1 1 d G
H10D H 0.9425 0.2003 0.8916 0.207 Uiso 1 1 calc R
C111 C 1.06740(12) 0.3514(3) 0.94282(18) 0.1722(7) Uani 1 1 d D
C112 C 1.03576(11) 0.34960(17) 0.8990(2) 0.1722(7) Uani 1 1 d GD
C113 C 1.00701(17) 0.36608(16) 0.92049(16) 0.1722(7) Uani 1 1 d G
H11A H 1.0102 0.3768 0.9562 0.207 Uiso 1 1 calc R
C114 C 0.97356(13) 0.36689(16) 0.8897(2) 0.1722(7) Uani 1 1 d G
H11B H 0.9539 0.3782 0.9044 0.207 Uiso 1 1 calc R
C115 C 0.96887(10) 0.35123(17) 0.8375(2) 0.1722(7) Uani 1 1 d G
C116 C 0.99762(16) 0.33475(16) 0.81604(16) 0.1722(7) Uani 1 1 d G
H11C H 0.9944 0.3240 0.7803 0.207 Uiso 1 1 calc R
C117 C 1.03107(12) 0.33394(15) 0.8468(2) 0.1722(7) Uani 1 1 d G
H11D H 1.0507 0.3227 0.8322 0.207 Uiso 1 1 calc R
C121 C 0.43887(15) 0.49637(18) 0.6622(2) 0.0852(6) Uani 1 1 d .
C122 C 0.42742(9) 0.53988(8) 0.63584(13) 0.0852(6) Uani 1 1 d G
C123 C 0.42419(9) 0.54179(9) 0.58056(13) 0.0852(6) Uani 1 1 d G
H12A H 0.4286 0.5158 0.5610 0.102 Uiso 1 1 calc R
C124 C 0.41457(9) 0.58179(11) 0.55397(10) 0.0852(6) Uani 1 1 d G
H12B H 0.4124 0.5831 0.5162 0.102 Uiso 1 1 calc R
C125 C 0.40819(9) 0.61987(8) 0.58266(13) 0.0852(6) Uani 1 1 d G
C126 C 0.41142(9) 0.61796(9) 0.63794(13) 0.0852(6) Uani 1 1 d G
H12C H 0.4071 0.6440 0.6575 0.102 Uiso 1 1 calc R
C127 C 0.42103(9) 0.57796(11) 0.66453(10) 0.0852(6) Uani 1 1 d G
H12D H 0.4232 0.5767 0.7023 0.102 Uiso 1 1 calc R
C131 C 0.2300(2) 0.6751(3) 0.5205(3) 0.1497(8) Uani 1 1 d .
C132 C 0.27020(8) 0.67830(17) 0.52834(19) 0.1497(8) Uani 1 1 d G
C133 C 0.28870(12) 0.64056(13) 0.54947(19) 0.1497(8) Uani 1 1 d G
H13B H 0.2762 0.6152 0.5595 0.180 Uiso 1 1 calc R
C134 C 0.32548(12) 0.63997(13) 0.55595(18) 0.1497(8) Uani 1 1 d G
H13C H 0.3381 0.6142 0.5704 0.180 Uiso 1 1 calc R
C135 C 0.34378(8) 0.67710(17) 0.54129(19) 0.1497(8) Uani 1 1 d G
C136 C 0.32528(12) 0.71483(13) 0.52015(19) 0.1497(8) Uani 1 1 d G
H13D H 0.3378 0.7402 0.5101 0.180 Uiso 1 1 calc R
C137 C 0.28849(12) 0.71543(13) 0.51367(18) 0.1497(8) Uani 1 1 d G
H13E H 0.2758 0.7412 0.4992 0.180 Uiso 1 1 calc R
C141 C 0.4762(2) 0.8171(3) 0.6873(3) 0.1480(7) Uani 1 1 d .
C142 C 0.45716(13) 0.78373(14) 0.64991(16) 0.1480(7) Uani 1 1 d G
C143 C 0.42123(13) 0.79064(12) 0.63265(18) 0.1480(7) Uani 1 1 d G
H14B H 0.4102 0.8175 0.6419 0.178 Uiso 1 1 calc R
C144 C 0.40137(9) 0.75823(17) 0.60188(18) 0.1480(7) Uani 1 1 d G
H14C H 0.3768 0.7630 0.5901 0.178 Uiso 1 1 calc R
C145 C 0.41745(13) 0.71892(14) 0.58837(16) 0.1480(7) Uani 1 1 d G
C146 C 0.45338(13) 0.71201(12) 0.60564(18) 0.1480(7) Uani 1 1 d G
H14D H 0.4644 0.6851 0.5964 0.178 Uiso 1 1 calc R
C147 C 0.47324(9) 0.74442(17) 0.63641(18) 0.1480(7) Uani 1 1 d G
H14E H 0.4978 0.7397 0.6482 0.178 Uiso 1 1 calc R
C151 C 0.42910(13) 0.6383(2) 0.32294(14) 0.1480(7) Uani 1 1 d D
C152 C 0.42412(15) 0.64664(14) 0.37996(15) 0.1480(7) Uani 1 1 d GD
C153 C 0.45122(10) 0.65188(14) 0.4229(2) 0.1480(7) Uani 1 1 d G
H15A H 0.4752 0.6476 0.4182 0.178 Uiso 1 1 calc R
C154 C 0.44328(12) 0.66334(14) 0.47281(17) 0.1480(7) Uani 1 1 d G
H15B H 0.4618 0.6669 0.5022 0.178 Uiso 1 1 calc R
C155 C 0.40824(15) 0.66955(14) 0.47975(15) 0.1480(7) Uani 1 1 d G
C156 C 0.38115(10) 0.66431(13) 0.4368(2) 0.1480(7) Uani 1 1 d G
H15C H 0.3572 0.6686 0.4415 0.178 Uiso 1 1 calc R
C157 C 0.38908(12) 0.65286(14) 0.38689(17) 0.1480(7) Uani 1 1 d G
H15D H 0.3706 0.6493 0.3575 0.178 Uiso 1 1 calc R
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'
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
O26 Zn1 O3 126.99(15) . 3_667
O26 Zn1 O1S 119.98(15) . .
O3 Zn1 O1S 112.45(13) 3_667 .
O26 Zn1 O2 90.51(15) . .
O3 Zn1 O2 86.37(13) 3_667 .
O1S Zn1 O2 101.53(13) . .
O26 Zn1 O12 86.59(16) . .
O3 Zn1 O12 84.86(14) 3_667 .
O1S Zn1 O12 91.33(14) . .
O2 Zn1 O12 166.48(13) . .
O26 Zn1 Zn6 146.63(11) . .
O3 Zn1 Zn6 77.85(9) 3_667 .
O1S Zn1 Zn6 37.98(8) . .
O2 Zn1 Zn6 115.41(9) . .
O12 Zn1 Zn6 72.66(11) . .
O26 Zn1 Zn5 86.82(12) . .
O3 Zn1 Zn5 136.87(10) 3_667 .
O1S Zn1 Zn5 38.13(9) . .
O2 Zn1 Zn5 123.30(9) . .
O12 Zn1 Zn5 69.75(10) . .
Zn6 Zn1 Zn5 61.81(3) . .
O32 Zn2 O1S 107.84(16) 3_666 .
O32 Zn2 O30 109.30(19) 3_666 2_646
O1S Zn2 O30 109.89(14) . 2_646
O32 Zn2 O1 111.84(16) 3_666 .
O1S Zn2 O1 115.98(12) . .
O30 Zn2 O1 101.77(16) 2_646 .
O32 Zn2 Zn6 113.74(13) 3_666 .
O1S Zn2 Zn6 34.33(8) . .
O30 Zn2 Zn6 76.35(11) 2_646 .
O1 Zn2 Zn6 132.13(10) . .
O8 Zn3 O17 95.89(18) . .
O8 Zn3 O2S 96.82(15) . .
O17 Zn3 O2S 93.25(15) . .
O8 Zn3 O4S 164.23(19) . .
O17 Zn3 O4S 99.5(2) . .
O2S Zn3 O4S 85.88(18) . .
O8 Zn3 O13 79.59(19) . 2_656
O17 Zn3 O13 173.34(16) . 2_656
O2S Zn3 O13 92.15(15) . 2_656
O4S Zn3 O13 84.8(2) . 2_656
O8 Zn3 O3S 87.48(18) . .
O17 Zn3 O3S 88.71(18) . .
O2S Zn3 O3S 175.07(17) . .
O4S Zn3 O3S 89.3(2) . .
O13 Zn3 O3S 86.22(18) 2_656 .
O7 Zn4 O2S 105.19(14) . .
O7 Zn4 O5S 105.43(19) . .
O2S Zn4 O5S 149.20(19) . .
O7 Zn4 O18 101.37(16) . .
O2S Zn4 O18 92.86(16) . .
O5S Zn4 O18 84.36(19) . .
O7 Zn4 O9 93.20(14) . 3_667
O2S Zn4 O9 93.42(14) . 3_667
O5S Zn4 O9 81.63(19) . 3_667
O18 Zn4 O9 162.02(15) . 3_667
O11 Zn5 O1S 105.81(14) . .
O11 Zn5 O7S 113.6(2) . .
O1S Zn5 O7S 140.52(19) . .
O11 Zn5 O5 88.10(13) . 2_646
O1S Zn5 O5 94.01(11) . 2_646
O7S Zn5 O5 85.58(17) . 2_646
O11 Zn5 O25 91.60(13) . .
O1S Zn5 O25 96.57(11) . .
O7S Zn5 O25 84.54(17) . .
O5 Zn5 O25 169.07(12) 2_646 .
O11 Zn5 Zn1 84.30(10) . .
O1S Zn5 Zn1 37.14(8) . .
O7S Zn5 Zn1 147.20(16) . .
O5 Zn5 Zn1 123.78(9) 2_646 .
O25 Zn5 Zn1 67.01(9) . .
O11 Zn5 Zn6 83.37(11) . .
O1S Zn5 Zn6 34.77(8) . .
O7S Zn5 Zn6 147.50(15) . .
O5 Zn5 Zn6 66.75(9) 2_646 .
O25 Zn5 Zn6 124.06(9) . .
Zn1 Zn5 Zn6 57.05(5) . .
O1S Zn6 O4 118.10(13) . 3_667
O1S Zn6 O6 117.42(14) . 2_646
O4 Zn6 O6 108.35(15) 3_667 2_646
O1S Zn6 O29 109.42(17) . 2_646
O4 Zn6 O29 98.85(18) 3_667 2_646
O6 Zn6 O29 101.82(18) 2_646 2_646
O1S Zn6 Zn1 39.49(8) . .
O4 Zn6 Zn1 79.02(10) 3_667 .
O6 Zn6 Zn1 131.94(10) 2_646 .
O29 Zn6 Zn1 124.45(15) 2_646 .
O1S Zn6 Zn2 35.45(9) . .
O4 Zn6 Zn2 123.93(11) 3_667 .
O6 Zn6 Zn2 127.67(10) 2_646 .
O29 Zn6 Zn2 73.98(14) 2_646 .
Zn1 Zn6 Zn2 63.29(3) . .
O1S Zn6 Zn5 37.07(9) . .
O4 Zn6 Zn5 129.57(11) 3_667 .
O6 Zn6 Zn5 81.20(11) 2_646 .
O29 Zn6 Zn5 128.35(13) 2_646 .
Zn1 Zn6 Zn5 61.14(3) . .
Zn2 Zn6 Zn5 65.02(2) . .
O14 Zn7 O2S 120.99(16) . 2_646
O14 Zn7 O23 107.13(19) . 4_465
O2S Zn7 O23 106.97(18) 2_646 4_465
O14 Zn7 O10 106.53(17) . 4_565
O2S Zn7 O10 109.57(17) 2_646 4_565
O23 Zn7 O10 104.5(2) 4_465 4_565
O27 Zn8 O22 108.2(2) . 2_656
O27 Zn8 O19 116.3(2) . 3_666
O22 Zn8 O19 112.7(2) 2_656 3_666
O27 Zn8 O16 98.8(2) . .
O22 Zn8 O16 108.3(2) 2_656 .
O19 Zn8 O16 111.5(2) 3_666 .
O21 Zn9 O15 115.1(2) 4_565 3_666
O21 Zn9 O20 97.1(2) 4_565 .
O15 Zn9 O20 107.9(2) 3_666 .
O21 Zn9 O6S 109.9(2) 4_565 .
O15 Zn9 O6S 121.5(2) 3_666 .
O20 Zn9 O6S 101.4(2) . .
C35 Si1 C15 109.02(16) . .
C35 Si1 C5 109.62(16) . .
C15 Si1 C5 109.90(16) . .
C35 Si1 C25 112.07(17) . .
C15 Si1 C25 110.44(15) . .
C5 Si1 C25 105.74(16) . .
C75 Si2 C55 111.9(3) . .
C75 Si2 C65 106.1(2) . .
C55 Si2 C65 109.79(19) . .
C75 Si2 C45 105.7(2) . .
C55 Si2 C45 108.73(18) . .
C65 Si2 C45 114.52(19) . .
C115 Si3 C105 106.2(3) . .
C115 Si3 C95 114.9(3) . .
C105 Si3 C95 112.2(3) . .
C115 Si3 C85 108.7(3) . .
C105 Si3 C85 106.5(3) . .
C95 Si3 C85 108.1(2) . .
C145 Si4 C135 114.8(2) . .
C145 Si4 C125 105.1(2) . .
C135 Si4 C125 108.5(2) . .
C145 Si4 C155 110.7(2) . .
C135 Si4 C155 112.0(2) . .
C125 Si4 C155 104.90(19) . .
Zn6 O1S Zn2 110.22(14) . .
Zn6 O1S Zn1 102.53(13) . .
Zn2 O1S Zn1 111.71(13) . .
Zn6 O1S Zn5 108.16(13) . .
Zn2 O1S Zn5 118.22(14) . .
Zn1 O1S Zn5 104.73(13) . .
C1 O1 Zn2 119.9(3) . .
C1 O2 Zn1 139.5(3) . .
Zn7 O2S Zn4 114.79(18) 2_656 .
Zn7 O2S Zn3 111.07(16) 2_656 .
Zn4 O2S Zn3 107.88(16) . .
C11 O3 Zn1 127.6(3) . 3_667
C11 O4 Zn6 124.3(3) . 3_667
C21 O5 Zn5 127.3(3) . 2_656
C21 O6 Zn6 115.8(3) . 2_656
C31 O7 Zn4 124.0(2) . .
C31 O8 Zn3 139.0(3) . .
C41 O9 Zn4 130.5(4) . 3_667
C41 O10 Zn7 118.1(4) . 4_566
C51 O11 Zn5 127.3(4) . .
C51 O12 Zn1 138.7(4) . .
C61 O13 Zn3 133.4(5) . 2_646
C61 O14 Zn7 114.6(3) . .
C71 O15 Zn9 137.4(8) . 3_666
C71 O16 Zn8 143.5(7) . .
C81 O17 Zn3 127.3(5) . .
C81 O18 Zn4 133.8(5) . .
C91 O19 Zn8 133.2(6) . 3_666
C91 O20 Zn9 145.8(7) . .
C101 O21 Zn9 145.5(5) . 4_566
C101 O22 Zn8 122.9(4) . 2_646
C111 O23 Zn7 115.4(4) . 4_666
C111 O24 H24B 109.5 . .
C121 O25 Zn5 139.2(4) . .
C121 O26 Zn1 118.3(3) . .
C131 O27 Zn8 122.9(5) . .
C141 O29 Zn6 130.7(5) . 2_656
C141 O30 Zn2 131.2(5) . 2_656
C151 O31 H31A 109.5 . .
C151 O32 Zn2 122.8(3) . 3_666
O2 C1 O1 125.1(5) . .
O2 C1 C2 120.4(5) . .
O1 C1 C2 114.1(5) . .
C3 C2 C7 120.0 . .
C3 C2 C1 121.7(3) . .
C7 C2 C1 118.0(3) . .
C4 C3 C2 120.0 . .
C4 C3 H3A 120.0 . .
C2 C3 H3A 120.0 . .
C5 C4 C3 120.0 . .
C5 C4 H4A 120.0 . .
C3 C4 H4A 120.0 . .
C4 C5 C6 120.0 . .
C4 C5 Si1 121.33(19) . .
C6 C5 Si1 118.63(19) . .
C5 C6 C7 120.0 . .
C5 C6 H6A 120.0 . .
C7 C6 H6A 120.0 . .
C6 C7 C2 120.0 . .
C6 C7 H7A 120.0 . .
C2 C7 H7A 120.0 . .
O3 C11 O4 125.6(5) . .
O3 C11 C12 120.1(5) . .
O4 C11 C12 114.2(4) . .
C13 C12 C17 120.0 . .
C13 C12 C11 118.0(3) . .
C17 C12 C11 121.7(3) . .
C12 C13 C14 120.0 . .
C12 C13 H13A 120.0 . .
C14 C13 H13A 120.0 . .
C15 C14 C13 120.0 . .
C15 C14 H14A 120.0 . .
C13 C14 H14A 120.0 . .
C16 C15 C14 120.0 . .
C16 C15 Si1 119.62(19) . .
C14 C15 Si1 120.32(19) . .
C15 C16 C17 120.0 . .
C15 C16 H16A 120.0 . .
C17 C16 H16A 120.0 . .
C16 C17 C12 120.0 . .
C16 C17 H17A 120.0 . .
C12 C17 H17A 120.0 . .
O5 C21 O6 129.3(5) . .
O5 C21 C22 119.4(5) . .
O6 C21 C22 111.3(5) . .
C23 C22 C27 120.0 . .
C23 C22 C21 118.7(3) . .
C27 C22 C21 121.3(3) . .
C24 C23 C22 120.0 . .
C24 C23 H23A 120.0 . .
C22 C23 H23A 120.0 . .
C23 C24 C25 120.0 . .
C23 C24 H24A 120.0 . .
C25 C24 H24A 120.0 . .
C26 C25 C24 120.0 . .
C26 C25 Si1 118.38(18) . .
C24 C25 Si1 121.51(19) . .
C27 C26 C25 120.0 . .
C27 C26 H26A 120.0 . .
C25 C26 H26A 120.0 . .
C26 C27 C22 120.0 . .
C26 C27 H27A 120.0 . .
C22 C27 H27A 120.0 . .
O8 C31 O7 125.6(3) . .
O8 C31 C32 115.4(3) . .
O7 C31 C32 118.2(3) . .
C33 C32 C37 120.0 . .
C33 C32 C31 123.1(3) . .
C37 C32 C31 116.9(3) . .
C32 C33 C34 120.0 . .
C32 C33 H33A 120.0 . .
C34 C33 H33A 120.0 . .
C35 C34 C33 120.0 . .
C35 C34 H34A 120.0 . .
C33 C34 H34A 120.0 . .
C36 C35 C34 120.0 . .
C36 C35 Si1 116.7(2) . .
C34 C35 Si1 123.3(2) . .
C35 C36 C37 120.0 . .
C35 C36 H36A 120.0 . .
C37 C36 H36A 120.0 . .
C36 C37 C32 120.0 . .
C36 C37 H37A 120.0 . .
C32 C37 H37A 120.0 . .
O10 C41 O9 123.5(7) . .
O10 C41 C42 118.1(6) . .
O9 C41 C42 118.4(6) . .
C43 C42 C47 120.0 . .
C43 C42 C41 119.3(4) . .
C47 C42 C41 120.7(4) . .
C44 C43 C42 120.0 . .
C44 C43 H43A 120.0 . .
C42 C43 H43A 120.0 . .
C43 C44 C45 120.0 . .
C43 C44 H44A 120.0 . .
C45 C44 H44A 120.0 . .
C46 C45 C44 120.0 . .
C46 C45 Si2 120.0(2) . .
C44 C45 Si2 120.0(2) . .
C47 C46 C45 120.0 . .
C47 C46 H46A 120.0 . .
C45 C46 H46A 120.0 . .
C46 C47 C42 120.0 . .
C46 C47 H47A 120.0 . .
C42 C47 H47A 120.0 . .
O12 C51 O11 118.8(6) . .
O12 C51 C52 120.4(6) . .
O11 C51 C52 120.3(6) . .
C53 C52 C57 120.0 . .
C53 C52 C51 120.8(4) . .
C57 C52 C51 119.2(4) . .
C52 C53 C54 120.0 . .
C52 C53 H53A 120.0 . .
C54 C53 H53A 120.0 . .
C55 C54 C53 120.0 . .
C55 C54 H54A 120.0 . .
C53 C54 H54A 120.0 . .
C54 C55 C56 120.0 . .
C54 C55 Si2 119.3(2) . .
C56 C55 Si2 120.5(2) . .
C55 C56 C57 120.0 . .
C55 C56 H56A 120.0 . .
C57 C56 H56A 120.0 . .
C56 C57 C52 120.0 . .
C56 C57 H57A 120.0 . .
C52 C57 H57A 120.0 . .
O14 C61 O13 126.3(3) . .
O14 C61 C62 118.3(4) . .
O13 C61 C62 115.3(4) . .
C63 C62 C67 120.0 . .
C63 C62 C61 120.9(3) . .
C67 C62 C61 119.1(3) . .
C62 C63 C64 120.0 . .
C62 C63 H63A 120.0 . .
C64 C63 H63A 120.0 . .
C65 C64 C63 120.0 . .
C65 C64 H64A 120.0 . .
C63 C64 H64A 120.0 . .
C64 C65 C66 120.0 . .
C64 C65 Si2 119.4(3) . .
C66 C65 Si2 120.6(3) . .
C65 C66 C67 120.0 . .
C65 C66 H66A 120.0 . .
C67 C66 H66A 120.0 . .
C66 C67 C62 120.0 . .
C66 C67 H67A 120.0 . .
C62 C67 H67A 120.0 . .
O15 C71 O16 116.9(12) . .
O15 C71 C72 125.9(11) . .
O16 C71 C72 117.1(8) . .
C73 C72 C77 120.0 . .
C73 C72 C71 122.5(7) . .
C77 C72 C71 117.0(7) . .
C74 C73 C72 120.0 . .
C74 C73 H73A 120.0 . .
C72 C73 H73A 120.0 . .
C73 C74 C75 120.0 . .
C73 C74 H74A 120.0 . .
C75 C74 H74A 120.0 . .
C76 C75 C74 120.0 . .
C76 C75 Si2 121.8(5) . .
C74 C75 Si2 118.0(5) . .
C75 C76 C77 120.0 . .
C75 C76 H76A 120.0 . .
C77 C76 H76A 120.0 . .
C76 C77 C72 120.0 . .
C76 C77 H77A 120.0 . .
C72 C77 H77A 120.0 . .
O18 C81 O17 128.2(7) . .
O18 C81 C82 114.9(7) . .
O17 C81 C82 114.8(6) . .
C83 C82 C87 120.0 . .
C83 C82 C81 120.4(5) . .
C87 C82 C81 119.6(5) . .
C84 C83 C82 120.0 . .
C84 C83 H83A 120.0 . .
C82 C83 H83A 120.0 . .
C85 C84 C83 120.0 . .
C85 C84 H84A 120.0 . .
C83 C84 H84A 120.0 . .
C84 C85 C86 120.0 . .
C84 C85 Si3 117.2(3) . .
C86 C85 Si3 121.6(3) . .
C87 C86 C85 120.0 . .
C87 C86 H86A 120.0 . .
C85 C86 H86A 120.0 . .
C86 C87 C82 120.0 . .
C86 C87 H87A 120.0 . .
C82 C87 H87A 120.0 . .
O20 C91 O19 117.8(10) . .
O20 C91 C92 124.3(10) . .
O19 C91 C92 117.9(10) . .
C93 C92 C97 120.0 . .
C93 C92 C91 119.6(7) . .
C97 C92 C91 120.3(7) . .
C92 C93 C94 120.0 . .
C92 C93 H93A 120.0 . .
C94 C93 H93A 120.0 . .
C95 C94 C93 120.0 . .
C95 C94 H94A 120.0 . .
C93 C94 H94A 120.0 . .
C94 C95 C96 120.0 . .
C94 C95 Si3 118.1(4) . .
C96 C95 Si3 121.8(4) . .
C97 C96 C95 120.0 . .
C97 C96 H96A 120.0 . .
C95 C96 H96A 120.0 . .
C96 C97 C92 120.0 . .
C96 C97 H97A 120.0 . .
C92 C97 H97A 120.0 . .
O21 C101 O22 123.7(5) . .
O21 C101 C102 123.4(8) . .
O22 C101 C102 112.8(7) . .
C103 C102 C107 120.0 . .
C103 C102 C101 122.5(6) . .
C107 C102 C101 117.0(6) . .
C104 C103 C102 120.0 . .
C104 C103 H10A 120.0 . .
C102 C103 H10A 120.0 . .
C103 C104 C105 120.0 . .
C103 C104 H10B 120.0 . .
C105 C104 H10B 120.0 . .
C104 C105 C106 120.0 . .
C104 C105 Si3 122.5(4) . .
C106 C105 Si3 117.2(4) . .
C107 C106 C105 120.0 . .
C107 C106 H10C 120.0 . .
C105 C106 H10C 120.0 . .
C106 C107 C102 120.0 . .
C106 C107 H10D 120.0 . .
C102 C107 H10D 120.0 . .
O23 C111 O24 107.6(4) . .
O23 C111 C112 107.9(4) . .
O24 C111 C112 139.4(6) . .
C113 C112 C117 120.0 . .
C113 C112 C111 106.9(5) . .
C117 C112 C111 133.0(5) . .
C112 C113 C114 120.0 . .
C112 C113 H11A 120.0 . .
C114 C113 H11A 120.0 . .
C115 C114 C113 120.0 . .
C115 C114 H11B 120.0 . .
C113 C114 H11B 120.0 . .
C116 C115 C114 120.0 . .
C116 C115 Si3 126.5(4) . .
C114 C115 Si3 112.4(4) . .
C115 C116 C117 120.0 . .
C115 C116 H11C 120.0 . .
C117 C116 H11C 120.0 . .
C116 C117 C112 120.0 . .
C116 C117 H11D 120.0 . .
C112 C117 H11D 120.0 . .
O25 C121 O26 124.9(5) . .
O25 C121 C122 124.2(5) . .
O26 C121 C122 110.8(4) . .
C123 C122 C127 120.0 . .
C123 C122 C121 117.5(3) . .
C127 C122 C121 122.5(3) . .
C124 C123 C122 120.0 . .
C124 C123 H12A 120.0 . .
C122 C123 H12A 120.0 . .
C123 C124 C125 120.0 . .
C123 C124 H12B 120.0 . .
C125 C124 H12B 120.0 . .
C126 C125 C124 120.0 . .
C126 C125 Si4 119.1(2) . .
C124 C125 Si4 120.9(2) . .
C125 C126 C127 120.0 . .
C125 C126 H12C 120.0 . .
C127 C126 H12C 120.0 . .
C126 C127 C122 120.0 . .
C126 C127 H12D 120.0 . .
C122 C127 H12D 120.0 . .
O27 C131 O28 126.9(8) . .
O27 C131 C132 118.8(7) . .
O28 C131 C132 114.1(7) . .
C133 C132 C137 120.0 . .
C133 C132 C131 116.3(5) . .
C137 C132 C131 123.7(5) . .
C132 C133 C134 120.0 . .
C132 C133 H13B 120.0 . .
C134 C133 H13B 120.0 . .
C135 C134 C133 120.0 . .
C135 C134 H13C 120.0 . .
C133 C134 H13C 120.0 . .
C134 C135 C136 120.0 . .
C134 C135 Si4 118.5(3) . .
C136 C135 Si4 121.4(3) . .
C135 C136 C137 120.0 . .
C135 C136 H13D 120.0 . .
C137 C136 H13D 120.0 . .
C136 C137 C132 120.0 . .
C136 C137 H13E 120.0 . .
C132 C137 H13E 120.0 . .
O30 C141 O29 122.5(7) . .
O30 C141 C142 124.3(8) . .
O29 C141 C142 113.1(7) . .
C143 C142 C147 120.0 . .
C143 C142 C141 117.6(5) . .
C147 C142 C141 122.1(5) . .
C144 C143 C142 120.0 . .
C144 C143 H14B 120.0 . .
C142 C143 H14B 120.0 . .
C143 C144 C145 120.0 . .
C143 C144 H14C 120.0 . .
C145 C144 H14C 120.0 . .
C144 C145 C146 120.0 . .
C144 C145 Si4 123.0(3) . .
C146 C145 Si4 117.0(3) . .
C147 C146 C145 120.0 . .
C147 C146 H14D 120.0 . .
C145 C146 H14D 120.0 . .
C146 C147 C142 120.0 . .
C146 C147 H14E 120.0 . .
C142 C147 H14E 120.0 . .
O32 C151 O31 123.6(4) . .
O32 C151 C152 108.1(4) . .
O31 C151 C152 126.3(5) . .
C153 C152 C157 120.0 . .
C153 C152 C151 125.5(4) . .
C157 C152 C151 114.3(4) . .
C154 C153 C152 120.0 . .
C154 C153 H15A 120.0 . .
C152 C153 H15A 120.0 . .
C153 C154 C155 120.0 . .
C153 C154 H15B 120.0 . .
C155 C154 H15B 120.0 . .
C156 C155 C154 120.0 . .
C156 C155 Si4 114.8(3) . .
C154 C155 Si4 124.1(3) . .
C157 C156 C155 120.0 . .
C157 C156 H15C 120.0 . .
C155 C156 H15C 120.0 . .
C156 C157 C152 120.0 . .
C156 C157 H15D 120.0 . .
C152 C157 H15D 120.0 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Zn1 O26 1.929(3) .
Zn1 O3 1.930(3) 3_667
Zn1 O1S 1.948(3) .
Zn1 O2 2.053(3) .
Zn1 O12 2.212(4) .
Zn1 Zn6 2.990(2) .
Zn1 Zn5 3.1201(17) .
Zn2 O32 1.931(4) 3_666
Zn2 O1S 1.938(3) .
Zn2 O30 1.950(4) 2_646
Zn2 O1 1.954(3) .
Zn2 Zn6 3.1361(15) .
Zn3 O8 1.986(4) .
Zn3 O17 2.003(4) .
Zn3 O2S 2.095(4) .
Zn3 O4S 2.111(5) .
Zn3 O13 2.165(5) 2_656
Zn3 O3S 2.268(5) .
Zn4 O7 1.961(3) .
Zn4 O2S 2.019(4) .
Zn4 O5S 2.069(5) .
Zn4 O18 2.073(4) .
Zn4 O9 2.152(4) 3_667
Zn5 O11 1.988(3) .
Zn5 O1S 1.992(3) .
Zn5 O7S 2.003(5) .
Zn5 O5 2.120(3) 2_646
Zn5 O25 2.121(3) .
Zn5 Zn6 3.1402(18) .
Zn6 O1S 1.885(3) .
Zn6 O4 1.933(4) 3_667
Zn6 O6 1.951(3) 2_646
Zn6 O29 2.020(5) 2_646
Zn7 O14 1.929(4) .
Zn7 O2S 1.929(3) 2_646
Zn7 O23 1.967(5) 4_465
Zn7 O10 1.992(4) 4_565
Zn8 O27 1.875(4) .
Zn8 O22 1.951(6) 2_656
Zn8 O19 1.964(5) 3_666
Zn8 O16 1.965(5) .
Zn9 O21 1.833(5) 4_565
Zn9 O15 1.971(5) 3_666
Zn9 O20 1.976(6) .
Zn9 O6S 2.013(6) .
Si1 C35 1.860(3) .
Si1 C15 1.879(3) .
Si1 C5 1.880(3) .
Si1 C25 1.887(3) .
Si2 C75 1.845(5) .
Si2 C55 1.891(3) .
Si2 C65 1.891(3) .
Si2 C45 1.922(3) .
Si3 C115 1.837(4) .
Si3 C105 1.850(4) .
Si3 C95 1.871(4) .
Si3 C85 1.885(4) .
Si4 C145 1.859(3) .
Si4 C135 1.866(3) .
Si4 C125 1.884(3) .
Si4 C155 1.903(4) .
O1 C1 1.282(5) .
O2 C1 1.233(5) .
O2S Zn7 1.929(3) 2_656
O3 C11 1.260(5) .
O3 Zn1 1.930(3) 3_667
O4 C11 1.302(5) .
O4 Zn6 1.933(4) 3_667
O5 C21 1.205(5) .
O5 Zn5 2.120(3) 2_656
O6 C21 1.263(6) .
O6 Zn6 1.951(3) 2_656
O7 C31 1.2789(19) .
O8 C31 1.2760(19) .
O9 C41 1.267(6) .
O9 Zn4 2.152(4) 3_667
O10 C41 1.245(6) .
O10 Zn7 1.992(4) 4_566
O11 C51 1.287(6) .
O12 C51 1.230(6) .
O13 C61 1.275(2) .
O13 Zn3 2.165(5) 2_646
O14 C61 1.273(2) .
O15 C71 1.181(8) .
O15 Zn9 1.971(5) 3_666
O16 C71 1.302(10) .
O17 C81 1.271(7) .
O18 C81 1.203(7) .
O19 C91 1.274(9) .
O19 Zn8 1.964(5) 3_666
O20 C91 1.222(9) .
O21 C101 1.267(8) .
O21 Zn9 1.833(5) 4_566
O22 C101 1.271(8) .
O22 Zn8 1.951(6) 2_646
O23 C111 1.277(2) .
O23 Zn7 1.967(5) 4_666
O24 C111 1.287(2) .
O24 H24B 0.8400 .
O25 C121 1.170(5) .
O26 C121 1.334(6) .
O27 C131 1.192(7) .
O28 C131 1.248(7) .
O29 C141 1.267(8) .
O29 Zn6 2.020(5) 2_656
O30 C141 1.212(7) .
O30 Zn2 1.951(4) 2_656
O31 C151 1.290(2) .
O31 H31A 0.8400 .
O32 C151 1.273(2) .
O32 Zn2 1.931(4) 3_666
C1 C2 1.484(5) .
C2 C3 1.3900 .
C2 C7 1.3900 .
C3 C4 1.3900 .
C3 H3A 0.9500 .
C4 C5 1.3900 .
C4 H4A 0.9500 .
C5 C6 1.3900 .
C6 C7 1.3900 .
C6 H6A 0.9500 .
C7 H7A 0.9500 .
C11 C12 1.500(5) .
C12 C13 1.3900 .
C12 C17 1.3900 .
C13 C14 1.3900 .
C13 H13A 0.9500 .
C14 C15 1.3900 .
C14 H14A 0.9500 .
C15 C16 1.3900 .
C16 C17 1.3900 .
C16 H16A 0.9500 .
C17 H17A 0.9500 .
C21 C22 1.514(5) .
C22 C23 1.3900 .
C22 C27 1.3900 .
C23 C24 1.3900 .
C23 H23A 0.9500 .
C24 C25 1.3900 .
C24 H24A 0.9500 .
C25 C26 1.3900 .
C26 C27 1.3900 .
C26 H26A 0.9500 .
C27 H27A 0.9500 .
C31 C32 1.5072 .
C32 C33 1.3900 .
C32 C37 1.3900 .
C33 C34 1.3900 .
C33 H33A 0.9500 .
C34 C35 1.3900 .
C34 H34A 0.9500 .
C35 C36 1.3900 .
C36 C37 1.3900 .
C36 H36A 0.9500 .
C37 H37A 0.9500 .
C41 C42 1.411(7) .
C42 C43 1.3900 .
C42 C47 1.3900 .
C43 C44 1.3900 .
C43 H43A 0.9500 .
C44 C45 1.3900 .
C44 H44A 0.9500 .
C45 C46 1.3900 .
C46 C47 1.3900 .
C46 H46A 0.9500 .
C47 H47A 0.9500 .
C51 C52 1.419(6) .
C52 C53 1.3900 .
C52 C57 1.3900 .
C53 C54 1.3900 .
C53 H53A 0.9500 .
C54 C55 1.3900 .
C54 H54A 0.9500 .
C55 C56 1.3900 .
C56 C57 1.3900 .
C56 H56A 0.9500 .
C57 H57A 0.9500 .
C61 C62 1.5069 .
C62 C63 1.3900 .
C62 C67 1.3900 .
C63 C64 1.3900 .
C63 H63A 0.9500 .
C64 C65 1.3900 .
C64 H64A 0.9500 .
C65 C66 1.3900 .
C66 C67 1.3900 .
C66 H66A 0.9500 .
C67 H67A 0.9500 .
C71 C72 1.403(12) .
C72 C73 1.3900 .
C72 C77 1.3900 .
C73 C74 1.3900 .
C73 H73A 0.9500 .
C74 C75 1.3900 .
C74 H74A 0.9500 .
C75 C76 1.3900 .
C76 C77 1.3900 .
C76 H76A 0.9500 .
C77 H77A 0.9500 .
C81 C82 1.536(8) .
C82 C83 1.3900 .
C82 C87 1.3900 .
C83 C84 1.3900 .
C83 H83A 0.9500 .
C84 C85 1.3900 .
C84 H84A 0.9500 .
C85 C86 1.3900 .
C86 C87 1.3900 .
C86 H86A 0.9500 .
C87 H87A 0.9500 .
C91 C92 1.405(11) .
C92 C93 1.3900 .
C92 C97 1.3900 .
C93 C94 1.3900 .
C93 H93A 0.9500 .
C94 C95 1.3900 .
C94 H94A 0.9500 .
C95 C96 1.3900 .
C96 C97 1.3900 .
C96 H96A 0.9500 .
C97 H97A 0.9500 .
C101 C102 1.5094(12) .
C102 C103 1.3900 .
C102 C107 1.3900 .
C103 C104 1.3900 .
C103 H10A 0.9500 .
C104 C105 1.3900 .
C104 H10B 0.9500 .
C105 C106 1.3900 .
C106 C107 1.3900 .
C106 H10C 0.9500 .
C107 H10D 0.9500 .
C111 C112 1.5096 .
C112 C113 1.3900 .
C112 C117 1.3900 .
C113 C114 1.3900 .
C113 H11A 0.9500 .
C114 C115 1.3900 .
C114 H11B 0.9500 .
C115 C116 1.3900 .
C116 C117 1.3900 .
C116 H11C 0.9500 .
C117 H11D 0.9500 .
C121 C122 1.492(6) .
C122 C123 1.3900 .
C122 C127 1.3900 .
C123 C124 1.3900 .
C123 H12A 0.9500 .
C124 C125 1.3900 .
C124 H12B 0.9500 .
C125 C126 1.3900 .
C126 C127 1.3900 .
C126 H12C 0.9500 .
C127 H12D 0.9500 .
C131 C132 1.522(8) .
C132 C133 1.3900 .
C132 C137 1.3900 .
C133 C134 1.3900 .
C133 H13B 0.9500 .
C134 C135 1.3900 .
C134 H13C 0.9500 .
C135 C136 1.3900 .
C136 C137 1.3900 .
C136 H13D 0.9500 .
C137 H13E 0.9500 .
C141 C142 1.484(8) .
C142 C143 1.3900 .
C142 C147 1.3900 .
C143 C144 1.3900 .
C143 H14B 0.9500 .
C144 C145 1.3900 .
C144 H14C 0.9500 .
C145 C146 1.3900 .
C146 C147 1.3900 .
C146 H14D 0.9500 .
C147 H14E 0.9500 .
C151 C152 1.5095 .
C152 C153 1.3900 .
C152 C157 1.3900 .
C153 C154 1.3900 .
C153 H15A 0.9500 .
C154 C155 1.3900 .
C154 H15B 0.9500 .
C155 C156 1.3900 .
C156 C157 1.3900 .
C156 H15C 0.9500 .
C157 H15D 0.9500 .
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_4
O26 Zn1 Zn5 O11 -82.38(16) . .
O3 Zn1 Zn5 O11 62.91(17) 3_667 .
O1S Zn1 Zn5 O11 125.82(16) . .
O2 Zn1 Zn5 O11 -170.90(15) . .
O12 Zn1 Zn5 O11 5.15(15) . .
Zn6 Zn1 Zn5 O11 85.78(10) . .
O26 Zn1 Zn5 O1S 151.80(17) . .
O3 Zn1 Zn5 O1S -62.91(19) 3_667 .
O2 Zn1 Zn5 O1S 63.28(17) . .
O12 Zn1 Zn5 O1S -120.67(17) . .
Zn6 Zn1 Zn5 O1S -40.04(13) . .
O26 Zn1 Zn5 O7S 43.7(3) . .
O3 Zn1 Zn5 O7S -171.0(3) 3_667 .
O1S Zn1 Zn5 O7S -108.1(3) . .
O2 Zn1 Zn5 O7S -44.8(3) . .
O12 Zn1 Zn5 O7S 131.2(3) . .
Zn6 Zn1 Zn5 O7S -148.2(3) . .
O26 Zn1 Zn5 O5 -166.25(16) . 2_646
O3 Zn1 Zn5 O5 -20.96(18) 3_667 2_646
O1S Zn1 Zn5 O5 41.95(17) . 2_646
O2 Zn1 Zn5 O5 105.23(15) . 2_646
O12 Zn1 Zn5 O5 -78.72(16) . 2_646
Zn6 Zn1 Zn5 O5 1.91(11) . 2_646
O26 Zn1 Zn5 O25 11.80(15) . .
O3 Zn1 Zn5 O25 157.09(17) 3_667 .
O1S Zn1 Zn5 O25 -140.00(16) . .
O2 Zn1 Zn5 O25 -76.72(14) . .
O12 Zn1 Zn5 O25 99.33(15) . .
Zn6 Zn1 Zn5 O25 179.96(10) . .
O26 Zn1 Zn5 Zn6 -168.16(12) . .
O3 Zn1 Zn5 Zn6 -22.87(14) 3_667 .
O1S Zn1 Zn5 Zn6 40.04(13) . .
O2 Zn1 Zn5 Zn6 103.32(11) . .
O12 Zn1 Zn5 Zn6 -80.63(11) . .
O26 Zn1 Zn6 O1S 62.1(3) . .
O3 Zn1 Zn6 O1S -155.57(17) 3_667 .
O2 Zn1 Zn6 O1S -75.59(18) . .
O12 Zn1 Zn6 O1S 116.08(18) . .
Zn5 Zn1 Zn6 O1S 40.20(14) . .
O26 Zn1 Zn6 O4 -126.1(3) . 3_667
O3 Zn1 Zn6 O4 16.24(14) 3_667 3_667
O1S Zn1 Zn6 O4 171.82(18) . 3_667
O2 Zn1 Zn6 O4 96.23(16) . 3_667
O12 Zn1 Zn6 O4 -72.11(16) . 3_667
Zn5 Zn1 Zn6 O4 -147.98(12) . 3_667
O26 Zn1 Zn6 O6 -21.2(3) . 2_646
O3 Zn1 Zn6 O6 121.13(17) 3_667 2_646
O1S Zn1 Zn6 O6 -83.3(2) . 2_646
O2 Zn1 Zn6 O6 -158.89(17) . 2_646
O12 Zn1 Zn6 O6 32.78(17) . 2_646
Zn5 Zn1 Zn6 O6 -43.10(14) . 2_646
O26 Zn1 Zn6 O29 140.6(3) . 2_646
O3 Zn1 Zn6 O29 -77.02(19) 3_667 2_646
O1S Zn1 Zn6 O29 78.6(2) . 2_646
O2 Zn1 Zn6 O29 2.96(19) . 2_646
O12 Zn1 Zn6 O29 -165.37(19) . 2_646
Zn5 Zn1 Zn6 O29 118.75(16) . 2_646
O26 Zn1 Zn6 Zn2 96.6(2) . .
O3 Zn1 Zn6 Zn2 -120.99(9) 3_667 .
O1S Zn1 Zn6 Zn2 34.58(14) . .
O2 Zn1 Zn6 Zn2 -41.01(11) . .
O12 Zn1 Zn6 Zn2 150.66(10) . .
Zn5 Zn1 Zn6 Zn2 74.78(2) . .
O26 Zn1 Zn6 Zn5 21.9(2) . .
O3 Zn1 Zn6 Zn5 164.23(10) 3_667 .
O1S Zn1 Zn6 Zn5 -40.20(14) . .
O2 Zn1 Zn6 Zn5 -115.79(11) . .
O12 Zn1 Zn6 Zn5 75.88(10) . .
O32 Zn2 Zn6 O1S -87.1(2) 3_666 .
O30 Zn2 Zn6 O1S 167.54(18) 2_646 .
O1 Zn2 Zn6 O1S 73.9(2) . .
O32 Zn2 Zn6 O4 -179.0(2) 3_666 3_667
O1S Zn2 Zn6 O4 -91.9(2) . 3_667
O30 Zn2 Zn6 O4 75.61(18) 2_646 3_667
O1 Zn2 Zn6 O4 -18.02(19) . 3_667
O32 Zn2 Zn6 O6 -1.8(2) 3_666 2_646
O1S Zn2 Zn6 O6 85.35(19) . 2_646
O30 Zn2 Zn6 O6 -107.11(18) 2_646 2_646
O1 Zn2 Zn6 O6 159.26(18) . 2_646
O32 Zn2 Zn6 O29 91.0(2) 3_666 2_646
O1S Zn2 Zn6 O29 178.1(2) . 2_646
O30 Zn2 Zn6 O29 -14.38(18) 2_646 2_646
O1 Zn2 Zn6 O29 -108.0(2) . 2_646
O32 Zn2 Zn6 Zn1 -125.59(16) 3_666 .
O1S Zn2 Zn6 Zn1 -38.49(14) . .
O30 Zn2 Zn6 Zn1 129.06(12) 2_646 .
O1 Zn2 Zn6 Zn1 35.43(14) . .
O32 Zn2 Zn6 Zn5 -56.79(16) 3_666 .
O1S Zn2 Zn6 Zn5 30.31(14) . .
O30 Zn2 Zn6 Zn5 -162.15(12) 2_646 .
O1 Zn2 Zn6 Zn5 104.22(14) . .
O11 Zn5 Zn6 O1S -130.41(16) . .
O7S Zn5 Zn6 O1S 105.0(3) . .
O5 Zn5 Zn6 O1S 138.80(17) 2_646 .
O25 Zn5 Zn6 O1S -42.97(17) . .
Zn1 Zn5 Zn6 O1S -42.93(13) . .
O11 Zn5 Zn6 O4 -45.02(17) . 3_667
O1S Zn5 Zn6 O4 85.39(19) . 3_667
O7S Zn5 Zn6 O4 -169.7(3) . 3_667
O5 Zn5 Zn6 O4 -135.80(17) 2_646 3_667
O25 Zn5 Zn6 O4 42.43(18) . 3_667
Zn1 Zn5 Zn6 O4 42.47(14) . 3_667
O11 Zn5 Zn6 O6 61.56(14) . 2_646
O1S Zn5 Zn6 O6 -168.02(17) . 2_646
O7S Zn5 Zn6 O6 -63.1(3) . 2_646
O5 Zn5 Zn6 O6 -29.22(13) 2_646 2_646
O25 Zn5 Zn6 O6 149.01(15) . 2_646
Zn1 Zn5 Zn6 O6 149.05(11) . 2_646
O11 Zn5 Zn6 O29 159.7(2) . 2_646
O1S Zn5 Zn6 O29 -69.9(2) . 2_646
O7S Zn5 Zn6 O29 35.1(4) . 2_646
O5 Zn5 Zn6 O29 68.9(2) 2_646 2_646
O25 Zn5 Zn6 O29 -112.8(2) . 2_646
Zn1 Zn5 Zn6 O29 -112.80(19) . 2_646
O11 Zn5 Zn6 Zn1 -87.49(9) . .
O1S Zn5 Zn6 Zn1 42.93(13) . .
O7S Zn5 Zn6 Zn1 147.9(3) . .
O5 Zn5 Zn6 Zn1 -178.27(10) 2_646 .
O25 Zn5 Zn6 Zn1 -0.04(11) . .
O11 Zn5 Zn6 Zn2 -159.47(9) . .
O1S Zn5 Zn6 Zn2 -29.05(13) . .
O7S Zn5 Zn6 Zn2 75.9(3) . .
O5 Zn5 Zn6 Zn2 109.75(10) 2_646 .
O25 Zn5 Zn6 Zn2 -72.02(11) . .
Zn1 Zn5 Zn6 Zn2 -71.98(2) . .
O4 Zn6 O1S Zn2 109.95(17) 3_667 .
O6 Zn6 O1S Zn2 -117.27(16) 2_646 .
O29 Zn6 O1S Zn2 -2.0(2) 2_646 .
Zn1 Zn6 O1S Zn2 119.1(2) . .
Zn5 Zn6 O1S Zn2 -130.63(19) . .
O4 Zn6 O1S Zn1 -9.1(2) 3_667 .
O6 Zn6 O1S Zn1 123.67(15) 2_646 .
O29 Zn6 O1S Zn1 -121.02(18) 2_646 .
Zn2 Zn6 O1S Zn1 -119.1(2) . .
Zn5 Zn6 O1S Zn1 110.31(18) . .
O4 Zn6 O1S Zn5 -119.42(16) 3_667 .
O6 Zn6 O1S Zn5 13.36(18) 2_646 .
O29 Zn6 O1S Zn5 128.67(18) 2_646 .
Zn1 Zn6 O1S Zn5 -110.31(18) . .
Zn2 Zn6 O1S Zn5 130.63(19) . .
O32 Zn2 O1S Zn6 106.18(19) 3_666 .
O30 Zn2 O1S Zn6 -12.88(19) 2_646 .
O1 Zn2 O1S Zn6 -127.56(15) . .
O32 Zn2 O1S Zn1 -140.53(18) 3_666 .
O30 Zn2 O1S Zn1 100.42(18) 2_646 .
O1 Zn2 O1S Zn1 -14.3(2) . .
Zn6 Zn2 O1S Zn1 113.3(2) . .
O32 Zn2 O1S Zn5 -18.9(2) 3_666 .
O30 Zn2 O1S Zn5 -137.96(16) 2_646 .
O1 Zn2 O1S Zn5 107.36(16) . .
Zn6 Zn2 O1S Zn5 -125.1(2) . .
O26 Zn1 O1S Zn6 -145.88(16) . .
O3 Zn1 O1S Zn6 25.94(18) 3_667 .
O2 Zn1 O1S Zn6 116.76(14) . .
O12 Zn1 O1S Zn6 -59.05(16) . .
Zn5 Zn1 O1S Zn6 -112.87(18) . .
O26 Zn1 O1S Zn2 96.11(19) . .
O3 Zn1 O1S Zn2 -92.07(16) 3_667 .
O2 Zn1 O1S Zn2 -1.25(17) . .
O12 Zn1 O1S Zn2 -177.06(16) . .
Zn6 Zn1 O1S Zn2 -118.0(2) . .
Zn5 Zn1 O1S Zn2 129.1(2) . .
O26 Zn1 O1S Zn5 -33.0(2) . .
O3 Zn1 O1S Zn5 138.81(13) 3_667 .
O2 Zn1 O1S Zn5 -130.37(13) . .
O12 Zn1 O1S Zn5 53.82(14) . .
Zn6 Zn1 O1S Zn5 112.87(18) . .
O11 Zn5 O1S Zn6 51.81(15) . .
O7S Zn5 O1S Zn6 -125.3(2) . .
O5 Zn5 O1S Zn6 -37.35(14) 2_646 .
O25 Zn5 O1S Zn6 145.36(14) . .
Zn1 Zn5 O1S Zn6 108.80(18) . .
O11 Zn5 O1S Zn2 177.90(14) . .
O7S Zn5 O1S Zn2 0.8(3) . .
O5 Zn5 O1S Zn2 88.73(15) 2_646 .
O25 Zn5 O1S Zn2 -88.56(15) . .
Zn1 Zn5 O1S Zn2 -125.1(2) . .
Zn6 Zn5 O1S Zn2 126.1(2) . .
O11 Zn5 O1S Zn1 -56.99(15) . .
O7S Zn5 O1S Zn1 125.9(2) . .
O5 Zn5 O1S Zn1 -146.15(13) 2_646 .
O25 Zn5 O1S Zn1 36.56(14) . .
Zn6 Zn5 O1S Zn1 -108.80(18) . .
O32 Zn2 O1 C1 154.2(4) 3_666 .
O1S Zn2 O1 C1 30.0(4) . .
O30 Zn2 O1 C1 -89.3(4) 2_646 .
Zn6 Zn2 O1 C1 -7.1(4) . .
O26 Zn1 O2 C1 -105.8(5) . .
O3 Zn1 O2 C1 127.2(5) 3_667 .
O1S Zn1 O2 C1 15.0(6) . .
O12 Zn1 O2 C1 176.8(6) . .
Zn6 Zn1 O2 C1 52.5(6) . .
Zn5 Zn1 O2 C1 -19.3(6) . .
O7 Zn4 O2S Zn7 75.61(19) . 2_656
O5S Zn4 O2S Zn7 -98.0(4) . 2_656
O18 Zn4 O2S Zn7 178.21(18) . 2_656
O9 Zn4 O2S Zn7 -18.65(18) 3_667 2_656
O7 Zn4 O2S Zn3 -48.80(18) . .
O5S Zn4 O2S Zn3 137.6(3) . .
O18 Zn4 O2S Zn3 53.80(17) . .
O9 Zn4 O2S Zn3 -143.05(16) 3_667 .
O8 Zn3 O2S Zn7 -91.7(2) . 2_656
O17 Zn3 O2S Zn7 171.96(19) . 2_656
O4S Zn3 O2S Zn7 72.7(2) . 2_656
O13 Zn3 O2S Zn7 -11.9(2) 2_656 2_656
O3S Zn3 O2S Zn7 59(2) . 2_656
O8 Zn3 O2S Zn4 34.90(19) . .
O17 Zn3 O2S Zn4 -61.43(19) . .
O4S Zn3 O2S Zn4 -160.7(2) . .
O13 Zn3 O2S Zn4 114.7(2) 2_656 .
O3S Zn3 O2S Zn4 -174.7(19) . .
O2S Zn4 O7 C31 34.0(4) . .
O5S Zn4 O7 C31 -149.4(4) . .
O18 Zn4 O7 C31 -62.2(4) . .
O9 Zn4 O7 C31 128.4(4) 3_667 .
O17 Zn3 O8 C31 93.5(6) . .
O2S Zn3 O8 C31 -0.5(6) . .
O4S Zn3 O8 C31 -99.5(8) . .
O13 Zn3 O8 C31 -91.5(6) 2_656 .
O3S Zn3 O8 C31 -178.1(6) . .
O1S Zn5 O11 C51 19.3(5) . .
O7S Zn5 O11 C51 -162.7(5) . .
O5 Zn5 O11 C51 112.9(5) 2_646 .
O25 Zn5 O11 C51 -78.0(5) . .
Zn1 Zn5 O11 C51 -11.3(5) . .
Zn6 Zn5 O11 C51 46.1(5) . .
O26 Zn1 O12 C51 85.1(7) . .
O3 Zn1 O12 C51 -147.2(7) 3_667 .
O1S Zn1 O12 C51 -34.8(7) . .
O2 Zn1 O12 C51 163.0(6) . .
Zn6 Zn1 O12 C51 -68.4(7) . .
Zn5 Zn1 O12 C51 -2.7(6) . .
O2S Zn7 O14 C61 30.6(6) 2_646 .
O23 Zn7 O14 C61 153.3(5) 4_465 .
O10 Zn7 O14 C61 -95.3(5) 4_565 .
O27 Zn8 O16 C71 158.7(12) . .
O22 Zn8 O16 C71 46.1(12) 2_656 .
O19 Zn8 O16 C71 -78.4(12) 3_666 .
O8 Zn3 O17 C81 -51.7(6) . .
O2S Zn3 O17 C81 45.5(6) . .
O4S Zn3 O17 C81 131.9(6) . .
O13 Zn3 O17 C81 -98.6(17) 2_656 .
O3S Zn3 O17 C81 -139.0(6) . .
O7 Zn4 O18 C81 76.9(7) . .
O2S Zn4 O18 C81 -29.2(7) . .
O5S Zn4 O18 C81 -178.4(7) . .
O9 Zn4 O18 C81 -139.5(6) 3_667 .
O21 Zn9 O20 C91 -40.0(13) 4_565 .
O15 Zn9 O20 C91 79.4(13) 3_666 .
O6S Zn9 O20 C91 -151.9(13) . .
O11 Zn5 O25 C121 61.6(6) . .
O1S Zn5 O25 C121 -44.5(6) . .
O7S Zn5 O25 C121 175.2(6) . .
O5 Zn5 O25 C121 149.9(7) 2_646 .
Zn1 Zn5 O25 C121 -21.5(6) . .
Zn6 Zn5 O25 C121 -21.5(6) . .
O3 Zn1 O26 C121 -162.3(4) 3_667 .
O1S Zn1 O26 C121 8.2(5) . .
O2 Zn1 O26 C121 111.8(4) . .
O12 Zn1 O26 C121 -81.4(4) . .
Zn6 Zn1 O26 C121 -30.7(5) . .
Zn5 Zn1 O26 C121 -11.5(4) . .
O22 Zn8 O27 C131 -74.1(7) 2_656 .
O19 Zn8 O27 C131 53.9(7) 3_666 .
O16 Zn8 O27 C131 173.2(7) . .
Zn1 O2 C1 O1 -1.9(9) . .
Zn1 O2 C1 C2 169.9(3) . .
Zn2 O1 C1 O2 -22.1(7) . .
Zn2 O1 C1 C2 165.6(3) . .
O2 C1 C2 C3 169.4(4) . .
O1 C1 C2 C3 -18.0(6) . .
O2 C1 C2 C7 -4.3(6) . .
O1 C1 C2 C7 168.4(3) . .
C7 C2 C3 C4 0.0 . .
C1 C2 C3 C4 -173.5(4) . .
C2 C3 C4 C5 0.0 . .
C3 C4 C5 C6 0.0 . .
C3 C4 C5 Si1 177.8(2) . .
C35 Si1 C5 C4 4.3(2) . .
C15 Si1 C5 C4 -115.54(19) . .
C25 Si1 C5 C4 125.26(19) . .
C35 Si1 C5 C6 -177.92(18) . .
C15 Si1 C5 C6 62.3(2) . .
C25 Si1 C5 C6 -56.9(2) . .
C4 C5 C6 C7 0.0 . .
Si1 C5 C6 C7 -177.8(2) . .
C5 C6 C7 C2 0.0 . .
C3 C2 C7 C6 0.0 . .
C1 C2 C7 C6 173.8(3) . .
Zn1 O3 C11 O4 -9.4(8) 3_667 .
Zn1 O3 C11 C12 167.3(3) 3_667 .
Zn6 O4 C11 O3 -16.4(7) 3_667 .
Zn6 O4 C11 C12 166.7(3) 3_667 .
O3 C11 C12 C13 24.5(5) . .
O4 C11 C12 C13 -158.5(3) . .
O3 C11 C12 C17 -162.0(3) . .
O4 C11 C12 C17 15.0(5) . .
C17 C12 C13 C14 0.0 . .
C11 C12 C13 C14 173.7(3) . .
C12 C13 C14 C15 0.0 . .
C13 C14 C15 C16 0.0 . .
C13 C14 C15 Si1 -177.2(2) . .
C35 Si1 C15 C16 72.4(2) . .
C5 Si1 C15 C16 -167.42(17) . .
C25 Si1 C15 C16 -51.1(2) . .
C35 Si1 C15 C14 -110.38(19) . .
C5 Si1 C15 C14 9.8(2) . .
C25 Si1 C15 C14 126.07(19) . .
C14 C15 C16 C17 0.0 . .
Si1 C15 C16 C17 177.2(2) . .
C15 C16 C17 C12 0.0 . .
C13 C12 C17 C16 0.0 . .
C11 C12 C17 C16 -173.4(3) . .
Zn5 O5 C21 O6 -30.6(9) 2_656 .
Zn5 O5 C21 C22 149.6(3) 2_656 .
Zn6 O6 C21 O5 -17.1(8) 2_656 .
Zn6 O6 C21 C22 162.7(3) 2_656 .
O5 C21 C22 C23 -1.6(7) . .
O6 C21 C22 C23 178.5(3) . .
O5 C21 C22 C27 176.0(4) . .
O6 C21 C22 C27 -3.8(6) . .
C27 C22 C23 C24 0.0 . .
C21 C22 C23 C24 177.7(4) . .
C22 C23 C24 C25 0.0 . .
C23 C24 C25 C26 0.0 . .
C23 C24 C25 Si1 -176.1(3) . .
C35 Si1 C25 C26 62.4(2) . .
C15 Si1 C25 C26 -175.87(17) . .
C5 Si1 C25 C26 -57.0(2) . .
C35 Si1 C25 C24 -121.5(2) . .
C15 Si1 C25 C24 0.3(2) . .
C5 Si1 C25 C24 119.2(2) . .
C24 C25 C26 C27 0.0 . .
Si1 C25 C26 C27 176.2(2) . .
C25 C26 C27 C22 0.0 . .
C23 C22 C27 C26 0.0 . .
C21 C22 C27 C26 -177.6(4) . .
Zn3 O8 C31 O7 -23.3(9) . .
Zn3 O8 C31 C32 146.7(4) . .
Zn4 O7 C31 O8 2.5(7) . .
Zn4 O7 C31 C32 -167.23(19) . .
O8 C31 C32 C33 -9.0(4) . .
O7 C31 C32 C33 161.7(4) . .
O8 C31 C32 C37 171.0(4) . .
O7 C31 C32 C37 -18.3(4) . .
C37 C32 C33 C34 0.0 . .
C31 C32 C33 C34 180.0 . .
C32 C33 C34 C35 0.0 . .
C33 C34 C35 C36 0.0 . .
C33 C34 C35 Si1 -179.4(2) . .
C15 Si1 C35 C36 32.7(2) . .
C5 Si1 C35 C36 -87.7(2) . .
C25 Si1 C35 C36 155.25(17) . .
C15 Si1 C35 C34 -147.92(19) . .
C5 Si1 C35 C34 91.7(2) . .
C25 Si1 C35 C34 -25.3(2) . .
C34 C35 C36 C37 0.0 . .
Si1 C35 C36 C37 179.4(2) . .
C35 C36 C37 C32 0.0 . .
C33 C32 C37 C36 0.0 . .
C31 C32 C37 C36 180.0 . .
Zn7 O10 C41 O9 29.8(9) 4_566 .
Zn7 O10 C41 C42 -149.0(4) 4_566 .
Zn4 O9 C41 O10 29.1(9) 3_667 .
Zn4 O9 C41 C42 -152.1(4) 3_667 .
O10 C41 C42 C43 177.3(4) . .
O9 C41 C42 C43 -1.5(7) . .
O10 C41 C42 C47 -1.9(7) . .
O9 C41 C42 C47 179.2(4) . .
C47 C42 C43 C44 0.0 . .
C41 C42 C43 C44 -179.3(4) . .
C42 C43 C44 C45 0.0 . .
C43 C44 C45 C46 0.0 . .
C43 C44 C45 Si2 178.9(3) . .
C75 Si2 C45 C46 161.3(3) . .
C55 Si2 C45 C46 -78.3(2) . .
C65 Si2 C45 C46 44.9(3) . .
C75 Si2 C45 C44 -17.6(3) . .
C55 Si2 C45 C44 102.7(2) . .
C65 Si2 C45 C44 -134.1(2) . .
C44 C45 C46 C47 0.0 . .
Si2 C45 C46 C47 -178.9(3) . .
C45 C46 C47 C42 0.0 . .
C43 C42 C47 C46 0.0 . .
C41 C42 C47 C46 179.3(4) . .
Zn1 O12 C51 O11 -4.0(11) . .
Zn1 O12 C51 C52 -176.5(3) . .
Zn5 O11 C51 O12 12.6(9) . .
Zn5 O11 C51 C52 -174.8(3) . .
O12 C51 C52 C53 178.8(5) . .
O11 C51 C52 C53 6.4(8) . .
O12 C51 C52 C57 -1.6(8) . .
O11 C51 C52 C57 -174.0(4) . .
C57 C52 C53 C54 0.0 . .
C51 C52 C53 C54 179.6(5) . .
C52 C53 C54 C55 0.0 . .
C53 C54 C55 C56 0.0 . .
C53 C54 C55 Si2 175.5(3) . .
C75 Si2 C55 C54 -82.2(3) . .
C65 Si2 C55 C54 35.3(3) . .
C45 Si2 C55 C54 161.3(2) . .
C75 Si2 C55 C56 93.2(3) . .
C65 Si2 C55 C56 -149.2(2) . .
C45 Si2 C55 C56 -23.2(3) . .
C54 C55 C56 C57 0.0 . .
Si2 C55 C56 C57 -175.4(3) . .
C55 C56 C57 C52 0.0 . .
C53 C52 C57 C56 0.0 . .
C51 C52 C57 C56 -179.6(5) . .
Zn7 O14 C61 O13 -0.7(11) . .
Zn7 O14 C61 C62 175.8(4) . .
Zn3 O13 C61 O14 -49.8(12) 2_646 .
Zn3 O13 C61 C62 133.6(4) 2_646 .
O14 C61 C62 C63 175.3(5) . .
O13 C61 C62 C63 -7.9(9) . .
O14 C61 C62 C67 -4.8(8) . .
O13 C61 C62 C67 172.1(5) . .
C67 C62 C63 C64 0.0 . .
C61 C62 C63 C64 179.9(5) . .
C62 C63 C64 C65 0.0 . .
C63 C64 C65 C66 0.0 . .
C63 C64 C65 Si2 179.8(3) . .
C75 Si2 C65 C64 -169.6(3) . .
C55 Si2 C65 C64 69.2(3) . .
C45 Si2 C65 C64 -53.4(3) . .
C75 Si2 C65 C66 10.2(3) . .
C55 Si2 C65 C66 -111.0(2) . .
C45 Si2 C65 C66 126.4(2) . .
C64 C65 C66 C67 0.0 . .
Si2 C65 C66 C67 -179.8(3) . .
C65 C66 C67 C62 0.0 . .
C63 C62 C67 C66 0.0 . .
C61 C62 C67 C66 -179.9(5) . .
Zn9 O15 C71 O16 -4.4(17) 3_666 .
Zn9 O15 C71 C72 -180.0(5) 3_666 .
Zn8 O16 C71 O15 21.6(19) . .
Zn8 O16 C71 C72 -162.4(6) . .
O15 C71 C72 C73 -176.3(8) . .
O16 C71 C72 C73 8.2(12) . .
O15 C71 C72 C77 -4.2(13) . .
O16 C71 C72 C77 -179.8(7) . .
C77 C72 C73 C74 0.0 . .
C71 C72 C73 C74 171.8(6) . .
C72 C73 C74 C75 0.0 . .
C73 C74 C75 C76 0.0 . .
C73 C74 C75 Si2 -174.4(3) . .
C55 Si2 C75 C76 -177.1(2) . .
C65 Si2 C75 C76 63.2(3) . .
C45 Si2 C75 C76 -58.8(3) . .
C55 Si2 C75 C74 -2.8(3) . .
C65 Si2 C75 C74 -122.5(2) . .
C45 Si2 C75 C74 115.4(3) . .
C74 C75 C76 C77 0.0 . .
Si2 C75 C76 C77 174.2(3) . .
C75 C76 C77 C72 0.0 . .
C73 C72 C77 C76 0.0 . .
C71 C72 C77 C76 -172.2(6) . .
Zn4 O18 C81 O17 9.0(12) . .
Zn4 O18 C81 C82 172.0(3) . .
Zn3 O17 C81 O18 -19.8(11) . .
Zn3 O17 C81 C82 177.2(3) . .
O18 C81 C82 C83 -171.9(5) . .
O17 C81 C82 C83 -6.6(7) . .
O18 C81 C82 C87 8.5(8) . .
O17 C81 C82 C87 173.8(4) . .
C87 C82 C83 C84 0.0 . .
C81 C82 C83 C84 -179.6(4) . .
C82 C83 C84 C85 0.0 . .
C83 C84 C85 C86 0.0 . .
C83 C84 C85 Si3 -167.3(3) . .
C115 Si3 C85 C84 85.9(3) . .
C105 Si3 C85 C84 -160.1(2) . .
C95 Si3 C85 C84 -39.3(3) . .
C115 Si3 C85 C86 -81.2(3) . .
C105 Si3 C85 C86 32.8(3) . .
C95 Si3 C85 C86 153.6(3) . .
C84 C85 C86 C87 0.0 . .
Si3 C85 C86 C87 166.7(3) . .
C85 C86 C87 C82 0.0 . .
C83 C82 C87 C86 0.0 . .
C81 C82 C87 C86 179.6(4) . .
Zn9 O20 C91 O19 -13(2) . .
Zn9 O20 C91 C92 169.1(5) . .
Zn8 O19 C91 O20 -12.2(16) 3_666 .
Zn8 O19 C91 C92 166.0(5) 3_666 .
O20 C91 C92 C93 4.9(14) . .
O19 C91 C92 C93 -173.1(7) . .
O20 C91 C92 C97 -179.0(8) . .
O19 C91 C92 C97 3.0(12) . .
C97 C92 C93 C94 0.0 . .
C91 C92 C93 C94 176.1(7) . .
C92 C93 C94 C95 0.0 . .
C93 C94 C95 C96 0.0 . .
C93 C94 C95 Si3 -176.7(4) . .
C115 Si3 C95 C94 -27.4(4) . .
C105 Si3 C95 C94 -148.7(3) . .
C85 Si3 C95 C94 94.1(3) . .
C115 Si3 C95 C96 156.0(3) . .
C105 Si3 C95 C96 34.7(4) . .
C85 Si3 C95 C96 -82.5(3) . .
C94 C95 C96 C97 0.0 . .
Si3 C95 C96 C97 176.5(4) . .
C95 C96 C97 C92 0.0 . .
C93 C92 C97 C96 0.0 . .
C91 C92 C97 C96 -176.1(7) . .
Zn9 O21 C101 O22 22.0(18) 4_566 .
Zn9 O21 C101 C102 -161.5(6) 4_566 .
Zn8 O22 C101 O21 18.4(13) 2_646 .
Zn8 O22 C101 C102 -158.3(4) 2_646 .
O21 C101 C102 C103 -170.1(7) . .
O22 C101 C102 C103 6.7(10) . .
O21 C101 C102 C107 1.7(11) . .
O22 C101 C102 C107 178.5(5) . .
C107 C102 C103 C104 0.0 . .
C101 C102 C103 C104 171.5(6) . .
C102 C103 C104 C105 0.0 . .
C103 C104 C105 C106 0.0 . .
C103 C104 C105 Si3 -173.5(4) . .
C115 Si3 C105 C104 155.5(3) . .
C95 Si3 C105 C104 -78.3(3) . .
C85 Si3 C105 C104 39.8(3) . .
C115 Si3 C105 C106 -18.2(4) . .
C95 Si3 C105 C106 108.0(3) . .
C85 Si3 C105 C106 -133.9(3) . .
C104 C105 C106 C107 0.0 . .
Si3 C105 C106 C107 173.8(4) . .
C105 C106 C107 C102 0.0 . .
C103 C102 C107 C106 0.0 . .
C101 C102 C107 C106 -172.0(6) . .
Zn7 O23 C111 O24 -27.5(8) 4_666 .
Zn7 O23 C111 C112 172.5(4) 4_666 .
O23 C111 C112 C113 -170.5(5) . .
O24 C111 C112 C113 39.5(11) . .
O23 C111 C112 C117 12.4(9) . .
O24 C111 C112 C117 -137.5(8) . .
C117 C112 C113 C114 0.0 . .
C111 C112 C113 C114 -177.5(5) . .
C112 C113 C114 C115 0.0 . .
C113 C114 C115 C116 0.0 . .
C113 C114 C115 Si3 168.9(3) . .
C105 Si3 C115 C116 87.1(4) . .
C95 Si3 C115 C116 -37.5(4) . .
C85 Si3 C115 C116 -158.7(3) . .
C105 Si3 C115 C114 -80.9(3) . .
C95 Si3 C115 C114 154.5(3) . .
C85 Si3 C115 C114 33.3(3) . .
C114 C115 C116 C117 0.0 . .
Si3 C115 C116 C117 -167.2(4) . .
C115 C116 C117 C112 0.0 . .
C113 C112 C117 C116 0.0 . .
C111 C112 C117 C116 176.8(6) . .
Zn5 O25 C121 O26 20.4(10) . .
Zn5 O25 C121 C122 -154.6(4) . .
Zn1 O26 C121 O25 2.6(8) . .
Zn1 O26 C121 C122 178.2(3) . .
O25 C121 C122 C123 1.4(7) . .
O26 C121 C122 C123 -174.3(3) . .
O25 C121 C122 C127 -176.8(4) . .
O26 C121 C122 C127 7.6(6) . .
C127 C122 C123 C124 0.0 . .
C121 C122 C123 C124 -178.2(4) . .
C122 C123 C124 C125 0.0 . .
C123 C124 C125 C126 0.0 . .
C123 C124 C125 Si4 -177.1(2) . .
C145 Si4 C125 C126 42.9(2) . .
C135 Si4 C125 C126 -80.4(2) . .
C155 Si4 C125 C126 159.7(2) . .
C145 Si4 C125 C124 -140.0(2) . .
C135 Si4 C125 C124 96.7(2) . .
C155 Si4 C125 C124 -23.2(3) . .
C124 C125 C126 C127 0.0 . .
Si4 C125 C126 C127 177.1(2) . .
C125 C126 C127 C122 0.0 . .
C123 C122 C127 C126 0.0 . .
C121 C122 C127 C126 178.1(4) . .
Zn8 O27 C131 O28 5.0(13) . .
Zn8 O27 C131 C132 179.1(4) . .
O27 C131 C132 C133 -0.4(9) . .
O28 C131 C132 C133 174.5(5) . .
O27 C131 C132 C137 177.0(6) . .
O28 C131 C132 C137 -8.2(9) . .
C137 C132 C133 C134 0.0 . .
C131 C132 C133 C134 177.4(5) . .
C132 C133 C134 C135 0.0 . .
C133 C134 C135 C136 0.0 . .
C133 C134 C135 Si4 -177.0(3) . .
C145 Si4 C135 C134 -124.8(3) . .
C125 Si4 C135 C134 -7.6(3) . .
C155 Si4 C135 C134 107.7(3) . .
C145 Si4 C135 C136 58.3(3) . .
C125 Si4 C135 C136 175.5(2) . .
C155 Si4 C135 C136 -69.2(3) . .
C134 C135 C136 C137 0.0 . .
Si4 C135 C136 C137 176.9(3) . .
C135 C136 C137 C132 0.0 . .
C133 C132 C137 C136 0.0 . .
C131 C132 C137 C136 -177.3(5) . .
Zn2 O30 C141 O29 -19.2(13) 2_656 .
Zn2 O30 C141 C142 165.2(4) 2_656 .
Zn6 O29 C141 O30 -7.6(13) 2_656 .
Zn6 O29 C141 C142 168.4(4) 2_656 .
O30 C141 C142 C143 -4.9(10) . .
O29 C141 C142 C143 179.2(5) . .
O30 C141 C142 C147 -178.4(6) . .
O29 C141 C142 C147 5.7(9) . .
C147 C142 C143 C144 0.0 . .
C141 C142 C143 C144 -173.6(5) . .
C142 C143 C144 C145 0.0 . .
C143 C144 C145 C146 0.0 . .
C143 C144 C145 Si4 180.0(3) . .
C135 Si4 C145 C144 -16.0(3) . .
C125 Si4 C145 C144 -135.1(2) . .
C155 Si4 C145 C144 112.1(3) . .
C135 Si4 C145 C146 164.0(2) . .
C125 Si4 C145 C146 44.8(3) . .
C155 Si4 C145 C146 -68.0(3) . .
C144 C145 C146 C147 0.0 . .
Si4 C145 C146 C147 -180.0(3) . .
C145 C146 C147 C142 0.0 . .
C143 C142 C147 C146 0.0 . .
C141 C142 C147 C146 173.3(5) . .
Zn2 O32 C151 O31 8.6(10) 3_666 .
Zn2 O32 C151 C152 173.2(3) 3_666 .
O32 C151 C152 C153 13.8(7) . .
O31 C151 C152 C153 177.8(5) . .
O32 C151 C152 C157 -171.5(4) . .
O31 C151 C152 C157 -7.5(8) . .
C157 C152 C153 C154 0.0 . .
C151 C152 C153 C154 174.4(5) . .
C152 C153 C154 C155 0.0 . .
C153 C154 C155 C156 0.0 . .
C153 C154 C155 Si4 167.4(3) . .
C145 Si4 C155 C156 -136.7(3) . .
C135 Si4 C155 C156 -7.1(3) . .
C125 Si4 C155 C156 110.3(2) . .
C145 Si4 C155 C154 55.3(3) . .
C135 Si4 C155 C154 -175.1(3) . .
C125 Si4 C155 C154 -57.6(3) . .
C154 C155 C156 C157 0.0 . .
Si4 C155 C156 C157 -168.5(3) . .
C155 C156 C157 C152 0.0 . .
C153 C152 C157 C156 0.0 . .
C151 C152 C157 C156 -175.0(4) . .
loop_
_platon_squeeze_void_nr
_platon_squeeze_void_average_x
_platon_squeeze_void_average_y
_platon_squeeze_void_average_z
_platon_squeeze_void_volume
_platon_squeeze_void_count_electrons
_platon_squeeze_void_content
1 -0.005 -0.008 -0.003 20067 7384 ' '
