#------------------------------------------------------------------------------
#$Date: 2016-08-07 11:38:32 +0300 (Sun, 07 Aug 2016) $
#$Revision: 185297 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/22/45/7224559.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_7224559
loop_
_publ_author_name
'Li, Quan-Quan'
'Zhang, Wen-Qian'
'Ren, Chun-Yan'
'Fan, Yan-Ping'
'Li, Jian-Li'
'Liu, Ping'
'Wang, Yao-Yu'
_publ_section_title
;
 Reaction-determined assemblies of 0D to 3D complexes: structural
 diversities and luminescence properties
;
_journal_issue                   19
_journal_name_full               CrystEngComm
_journal_page_first              3358
_journal_paper_doi               10.1039/C6CE00273K
_journal_volume                  18
_journal_year                    2016
_chemical_formula_sum            'C32 H8 Cd3 N4 O27'
_chemical_formula_weight         1217.62
_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
_audit_update_record
;
2015-12-25 deposited with the CCDC.
2016-03-09 downloaded from the CCDC.
;
_cell_angle_alpha                90.00
_cell_angle_beta                 99.9080(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   13.0719(6)
_cell_length_b                   22.5340(11)
_cell_length_c                   16.8938(8)
_cell_measurement_reflns_used    8885
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      26.365
_cell_measurement_theta_min      2.402
_cell_volume                     4902.1(4)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.989
_diffrn_measured_fraction_theta_max 0.989
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω 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  0.0353
_diffrn_reflns_av_sigmaI/netI    0.0435
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       28
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            26827
_diffrn_reflns_theta_full        26.37
_diffrn_reflns_theta_max         26.37
_diffrn_reflns_theta_min         1.52
_exptl_absorpt_coefficient_mu    1.376
_exptl_absorpt_correction_T_max  0.7161
_exptl_absorpt_correction_T_min  0.6829
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   sadabs
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.650
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       columnar
_exptl_crystal_F_000             2352
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.28
_exptl_crystal_size_min          0.26
_platon_squeeze_details
;
;
_refine_diff_density_max         1.257
_refine_diff_density_min         -0.570
_refine_diff_density_rms         0.126
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.008
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     595
_refine_ls_number_reflns         9923
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.008
_refine_ls_R_factor_all          0.0461
_refine_ls_R_factor_gt           0.0369
_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)+(0.0800P)²+0.1684P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1145
_refine_ls_wR_factor_ref         0.1204
_reflns_number_gt                8050
_reflns_number_total             9923
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c6ce00273k2.cif
_cod_data_source_block           5-sr
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 4268 2015-11-12 08:31:59Z antanas 

 Adding full bibliography for 7224556--7224565.cif.
;
_cod_original_sg_symbol_H-M      P2(1)/c
_cod_database_code               7224559
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
C1 C 0.7183(3) 0.10971(19) 0.0804(2) 0.0250(9) Uani 1 1 d .
C2 C 0.7871(3) 0.05569(17) 0.0899(2) 0.0215(8) Uani 1 1 d .
C3 C 0.7994(3) 0.02291(19) 0.0207(2) 0.0264(9) Uani 1 1 d .
H3 H 0.7665 0.0358 -0.0295 0.032 Uiso 1 1 calc R
C4 C 0.8591(3) -0.0274(2) 0.0265(3) 0.0274(9) Uani 1 1 d .
C5 C 0.9177(4) -0.0434(2) 0.1008(3) 0.0339(10) Uani 1 1 d .
H5 H 0.9638 -0.0751 0.1049 0.041 Uiso 1 1 calc R
C6 C 0.9053(4) -0.0107(2) 0.1681(3) 0.0316(10) Uani 1 1 d .
C7 C 0.8393(3) 0.03723(18) 0.1655(3) 0.0244(9) Uani 1 1 d .
C8 C -0.1786(3) 0.07259(18) 0.2372(2) 0.0221(8) Uani 1 1 d .
C9 C -0.2613(3) 0.06321(17) 0.2776(2) 0.0233(8) Uani 1 1 d .
C10 C -0.2801(3) 0.09855(18) 0.3408(2) 0.0246(9) Uani 1 1 d .
H10 H -0.3351 0.0900 0.3673 0.030 Uiso 1 1 calc R
C11 C -0.2163(3) 0.14647(19) 0.3638(2) 0.0267(9) Uani 1 1 d .
C12 C -0.1374(3) 0.15989(19) 0.3224(3) 0.0283(9) Uani 1 1 d .
H12 H -0.0983 0.1941 0.3352 0.034 Uiso 1 1 calc R
C13 C -0.1152(3) 0.12266(19) 0.2614(2) 0.0244(9) Uani 1 1 d .
C14 C -0.0218(3) 0.1336(2) 0.2227(2) 0.0270(9) Uani 1 1 d .
C15 C 0.1383(3) 0.0670(2) 0.0445(3) 0.0280(9) Uani 1 1 d .
C16 C 0.7624(3) 0.3141(2) -0.0690(3) 0.0289(9) Uani 1 1 d .
C17 C 0.5702(3) 0.2878(2) 0.1567(2) 0.0275(9) Uani 1 1 d .
C18 C 0.4894(3) 0.30034(18) 0.2081(2) 0.0223(8) Uani 1 1 d .
C19 C 0.5144(3) 0.2916(2) 0.2900(2) 0.0274(9) Uani 1 1 d .
H19 H 0.5783 0.2751 0.3116 0.033 Uiso 1 1 calc R
C20 C 0.4457(3) 0.19292(18) -0.1591(2) 0.0242(9) Uani 1 1 d .
C21 C 0.3487(3) 0.17104(19) -0.1923(2) 0.0252(9) Uani 1 1 d .
H21 H 0.3015 0.1605 -0.1593 0.030 Uiso 1 1 calc R
C22 C 0.3227(3) 0.33498(18) 0.2253(2) 0.0238(8) Uani 1 1 d .
C23 C 0.3926(3) 0.32218(18) 0.1728(2) 0.0223(8) Uani 1 1 d .
C24 C 0.3648(3) 0.32483(19) 0.0835(2) 0.0233(8) Uani 1 1 d .
C25 C 0.4012(3) 0.1315(2) 0.5347(3) 0.0283(9) Uani 1 1 d .
C26 C 0.3726(4) 0.1303(2) 0.4531(2) 0.0304(10) Uani 1 1 d .
H26 H 0.3984 0.1009 0.4233 0.036 Uiso 1 1 calc R
C27 C 0.3048(3) 0.17279(19) 0.4147(2) 0.0246(9) Uani 1 1 d .
C28 C 0.2694(3) 0.28288(19) -0.0397(2) 0.0241(8) Uani 1 1 d .
H28 H 0.2239 0.2542 -0.0648 0.029 Uiso 1 1 calc R
C29 C 0.3008(3) 0.28096(18) 0.0427(2) 0.0224(8) Uani 1 1 d .
C30 C 0.2605(3) 0.23145(18) 0.0893(2) 0.0208(8) Uani 1 1 d .
C31 C 0.4807(3) 0.1980(2) -0.0701(3) 0.0301(10) Uani 1 1 d .
C32 C 0.2635(3) 0.1688(2) 0.3261(2) 0.0269(9) Uani 1 1 d .
Cd1 Cd 0.48088(2) 0.154030(14) 0.104540(17) 0.02385(10) Uani 1 1 d .
Cd2 Cd 0.16613(2) 0.146487(13) 0.171284(16) 0.01999(9) Uani 1 1 d .
Cd3 Cd 0.69401(2) 0.248146(13) 0.047196(17) 0.02279(9) Uani 1 1 d .
N1 N 0.9673(4) -0.0297(2) 0.2445(2) 0.0434(11) Uani 1 1 d .
N2 N -0.3352(3) 0.01545(17) 0.2514(2) 0.0328(9) Uani 1 1 d .
N3 N 0.4701(4) 0.0836(2) 0.5714(3) 0.0479(12) Uani 1 1 d .
N4 N 0.2175(3) 0.3589(2) 0.1949(2) 0.0392(10) Uani 1 1 d .
O1 O 0.7511(3) 0.15436(15) 0.0497(2) 0.0438(9) Uani 1 1 d .
O2 O 0.6346(2) 0.10485(15) 0.1057(2) 0.0413(8) Uani 1 1 d .
O3 O 0.9390(3) -0.01663(17) 0.3075(2) 0.0507(10) Uani 1 1 d .
O4 O 1.0473(4) -0.0591(2) 0.2416(3) 0.0743(15) Uani 1 1 d .
O5 O 0.0720(3) 0.10553(17) 0.0405(2) 0.0485(10) Uani 1 1 d .
O6 O 0.2094(2) 0.06079(15) 0.10478(19) 0.0373(8) Uani 1 1 d .
O7 O -0.0184(2) 0.18019(16) 0.1815(2) 0.0386(8) Uani 1 1 d .
O8 O 0.0490(2) 0.09645(16) 0.2347(2) 0.0379(8) Uani 1 1 d .
O9 O -0.3036(3) -0.02942(15) 0.2219(2) 0.0485(9) Uani 1 1 d .
O10 O -0.4263(3) 0.02362(16) 0.2583(2) 0.0478(9) Uani 1 1 d .
O11 O 0.7156(3) 0.33645(15) -0.0179(2) 0.0408(8) Uani 1 1 d .
O12 O 0.7914(3) 0.26202(15) -0.0660(2) 0.0416(9) Uani 1 1 d .
O13 O 0.5835(3) 0.23406(16) 0.1376(2) 0.0431(9) Uani 1 1 d .
O14 O 0.6192(3) 0.32780(18) 0.1335(3) 0.0596(11) Uani 1 1 d .
O15 O 0.2014(3) 0.3821(2) 0.1292(2) 0.0652(13) Uani 1 1 d .
O16 O 0.1524(3) 0.35388(19) 0.2369(3) 0.0573(11) Uani 1 1 d .
O17 O 0.4347(3) 0.16735(18) -0.02655(19) 0.0467(9) Uani 1 1 d .
O18 O 0.5536(3) 0.2330(2) -0.0470(2) 0.0603(12) Uani 1 1 d .
O19 O 0.3210(2) 0.19253(14) 0.12226(18) 0.0311(7) Uani 1 1 d .
O20 O 0.1658(2) 0.23099(16) 0.0925(2) 0.0385(8) Uani 1 1 d .
O21 O 0.4632(4) 0.0672(2) 0.6385(2) 0.0732(14) Uani 1 1 d .
O22 O 0.5286(4) 0.0619(2) 0.5317(3) 0.0707(13) Uani 1 1 d .
O23 O 0.1976(3) 0.20498(15) 0.29463(18) 0.0372(8) Uani 1 1 d .
O24 O 0.2954(2) 0.12664(15) 0.28603(17) 0.0321(7) Uani 1 1 d .
O1W O 0.4107(3) 0.06131(16) 0.0823(3) 0.0549(11) Uani 1 1 d .
O2W O 0.4881(3) 0.13930(18) 0.2406(2) 0.0453(9) Uani 1 1 d .
O3W O 0.8354(3) 0.2662(2) 0.1503(3) 0.0612(12) 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'
Cd Cd -0.8075 1.2024 '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
O1 C1 O2 127.0(4) . .
O1 C1 C2 117.2(4) . .
O2 C1 C2 115.8(4) . .
C7 C2 C3 119.4(4) . .
C7 C2 C1 121.7(3) . .
C3 C2 C1 119.0(4) . .
C4 C3 C2 121.2(4) . .
C4 C3 H3 119.4 . .
C2 C3 H3 119.4 . .
C3 C4 C5 119.6(4) . .
C3 C4 C15 121.8(4) . 3_655
C5 C4 C15 118.6(4) . 3_655
C6 C5 C4 118.3(4) . .
C6 C5 H5 120.9 . .
C4 C5 H5 120.9 . .
C7 C6 C5 123.4(4) . .
C7 C6 N1 120.4(4) . .
C5 C6 N1 116.2(4) . .
C6 C7 C2 117.7(4) . .
C6 C7 C8 125.0(4) . 1_655
C2 C7 C8 117.3(4) . 1_655
C9 C8 C13 116.4(3) . .
C9 C8 C7 123.9(4) . 1_455
C13 C8 C7 119.4(4) . 1_455
C10 C9 C8 123.1(4) . .
C10 C9 N2 117.4(4) . .
C8 C9 N2 119.5(4) . .
C11 C10 C9 119.2(4) . .
C11 C10 H10 120.4 . .
C9 C10 H10 120.4 . .
C12 C11 C10 120.0(4) . .
C12 C11 C16 120.3(4) . 4_466
C10 C11 C16 119.6(4) . 4_466
C11 C12 C13 120.7(4) . .
C11 C12 H12 119.6 . .
C13 C12 H12 119.6 . .
C12 C13 C8 120.4(4) . .
C12 C13 C14 120.7(4) . .
C8 C13 C14 118.9(3) . .
O8 C14 O7 123.8(4) . .
O8 C14 C13 117.3(4) . .
O7 C14 C13 118.9(4) . .
O8 C14 Cd2 56.1(2) . .
O7 C14 Cd2 67.8(2) . .
C13 C14 Cd2 171.8(3) . .
O5 C15 O6 122.7(4) . .
O5 C15 C4 119.6(4) . 3_655
O6 C15 C4 117.6(4) . 3_655
O12 C16 O11 122.7(4) . .
O12 C16 C11 119.9(4) . 4_665
O11 C16 C11 117.4(4) . 4_665
O12 C16 Cd3 65.7(2) . .
O11 C16 Cd3 57.5(2) . .
C11 C16 Cd3 171.5(3) 4_665 .
O14 C17 O13 121.6(4) . .
O14 C17 C18 120.7(4) . .
O13 C17 C18 117.7(4) . .
C19 C18 C23 121.3(4) . .
C19 C18 C17 118.9(4) . .
C23 C18 C17 119.7(3) . .
C18 C19 C20 121.2(4) . 4_566
C18 C19 H19 119.4 . .
C20 C19 H19 119.4 4_566 .
C21 C20 C19 118.9(4) . 4_565
C21 C20 C31 122.2(4) . .
C19 C20 C31 118.9(4) 4_565 .
C22 C21 C20 119.4(4) 4_565 .
C22 C21 H21 120.3 4_565 .
C20 C21 H21 120.3 . .
C21 C22 C23 122.7(4) 4_566 .
C21 C22 N4 115.9(4) 4_566 .
C23 C22 N4 121.3(4) . .
C18 C23 C22 116.3(3) . .
C18 C23 C24 119.5(4) . .
C22 C23 C24 123.9(4) . .
C29 C24 C25 115.9(4) . 4_565
C29 C24 C23 119.4(4) . .
C25 C24 C23 124.7(4) 4_565 .
C26 C25 C24 122.7(4) . 4_566
C26 C25 N3 116.9(4) . .
C24 C25 N3 120.4(4) 4_566 .
C25 C26 C27 120.0(4) . .
C25 C26 H26 120.0 . .
C27 C26 H26 120.0 . .
C26 C27 C28 118.9(4) . 4_566
C26 C27 C32 121.0(4) . .
C28 C27 C32 120.0(4) 4_566 .
C29 C28 C27 120.8(4) . 4_565
C29 C28 H28 119.6 . .
C27 C28 H28 119.6 4_565 .
C28 C29 C24 121.5(4) . .
C28 C29 C30 118.5(4) . .
C24 C29 C30 119.9(3) . .
O19 C30 O20 122.1(4) . .
O19 C30 C29 120.1(4) . .
O20 C30 C29 117.7(3) . .
O17 C31 O18 126.3(4) . .
O17 C31 C20 117.2(4) . .
O18 C31 C20 116.6(4) . .
O23 C32 O24 121.9(4) . .
O23 C32 C27 119.4(4) . .
O24 C32 C27 118.6(4) . .
O23 C32 Cd2 62.5(2) . .
O24 C32 Cd2 60.0(2) . .
C27 C32 Cd2 170.2(3) . .
O17 Cd1 O13 100.81(14) . .
O17 Cd1 O1W 85.80(15) . .
O13 Cd1 O1W 166.92(14) . .
O17 Cd1 O2 99.33(14) . .
O13 Cd1 O2 84.36(13) . .
O1W Cd1 O2 83.44(13) . .
O17 Cd1 O2W 166.71(13) . .
O13 Cd1 O2W 86.99(14) . .
O1W Cd1 O2W 88.79(15) . .
O2 Cd1 O2W 92.08(13) . .
O17 Cd1 O19 88.95(13) . .
O13 Cd1 O19 100.28(12) . .
O1W Cd1 O19 91.04(12) . .
O2 Cd1 O19 169.65(11) . .
O2W Cd1 O19 79.02(11) . .
O8 Cd2 O20 136.93(12) . .
O8 Cd2 O6 93.09(12) . .
O20 Cd2 O6 112.10(13) . .
O8 Cd2 O24 87.98(11) . .
O20 Cd2 O24 123.42(12) . .
O6 Cd2 O24 92.26(11) . .
O8 Cd2 O23 83.99(12) . .
O20 Cd2 O23 91.72(12) . .
O6 Cd2 O23 146.36(11) . .
O24 Cd2 O23 54.21(11) . .
O8 Cd2 O5 88.01(13) . .
O20 Cd2 O5 81.07(13) . .
O6 Cd2 O5 53.11(11) . .
O24 Cd2 O5 144.83(11) . .
O23 Cd2 O5 159.17(11) . .
O8 Cd2 O19 168.95(11) . .
O20 Cd2 O19 53.17(10) . .
O6 Cd2 O19 84.78(11) . .
O24 Cd2 O19 81.29(10) . .
O23 Cd2 O19 91.77(11) . .
O5 Cd2 O19 99.25(12) . .
O8 Cd2 O7 53.58(11) . .
O20 Cd2 O7 83.51(11) . .
O6 Cd2 O7 125.59(11) . .
O24 Cd2 O7 122.96(10) . .
O23 Cd2 O7 78.74(11) . .
O5 Cd2 O7 81.03(11) . .
O19 Cd2 O7 135.56(11) . .
O8 Cd2 C32 83.29(12) . .
O20 Cd2 C32 110.50(13) . .
O6 Cd2 C32 119.61(13) . .
O24 Cd2 C32 27.62(12) . .
O23 Cd2 C32 26.75(12) . .
O5 Cd2 C32 168.43(13) . .
O19 Cd2 C32 88.33(11) . .
O7 Cd2 C32 99.71(12) . .
O8 Cd2 C14 26.43(13) . .
O20 Cd2 C14 110.67(13) . .
O6 Cd2 C14 111.36(12) . .
O24 Cd2 C14 105.61(12) . .
O23 Cd2 C14 79.43(12) . .
O5 Cd2 C14 84.85(12) . .
O19 Cd2 C14 161.76(12) . .
O7 Cd2 C14 27.18(12) . .
C32 Cd2 C14 90.66(12) . .
O18 Cd3 O1 95.73(17) . .
O18 Cd3 O13 85.37(14) . .
O1 Cd3 O13 95.89(13) . .
O18 Cd3 O11 86.86(15) . .
O1 Cd3 O11 138.86(12) . .
O13 Cd3 O11 125.21(13) . .
O18 Cd3 O3W 176.92(16) . .
O1 Cd3 O3W 86.14(16) . .
O13 Cd3 O3W 92.01(15) . .
O11 Cd3 O3W 93.34(15) . .
O18 Cd3 O12 86.45(14) . .
O1 Cd3 O12 85.43(12) . .
O13 Cd3 O12 171.80(13) . .
O11 Cd3 O12 53.67(11) . .
O3W Cd3 O12 96.15(15) . .
O18 Cd3 O14 99.30(17) . .
O1 Cd3 O14 142.68(13) . .
O13 Cd3 O14 51.98(12) . .
O11 Cd3 O14 76.21(12) . .
O3W Cd3 O14 77.78(16) . .
O12 Cd3 O14 129.28(12) . .
O18 Cd3 C16 84.35(14) . .
O1 Cd3 C16 112.17(13) . .
O13 Cd3 C16 150.89(14) . .
O11 Cd3 C16 27.05(13) . .
O3W Cd3 C16 97.23(15) . .
O12 Cd3 C16 26.75(12) . .
O14 Cd3 C16 103.19(13) . .
O3 N1 O4 123.1(4) . .
O3 N1 C6 119.5(4) . .
O4 N1 C6 117.5(4) . .
O9 N2 O10 124.0(4) . .
O9 N2 C9 118.5(4) . .
O10 N2 C9 117.4(4) . .
O22 N3 O21 123.7(5) . .
O22 N3 C25 117.6(4) . .
O21 N3 C25 118.7(5) . .
O16 N4 O15 123.5(4) . .
O16 N4 C22 118.0(4) . .
O15 N4 C22 118.5(4) . .
C1 O1 Cd3 129.4(3) . .
C1 O2 Cd1 140.8(3) . .
C15 O5 Cd2 88.7(3) . .
C15 O6 Cd2 95.2(3) . .
C14 O7 Cd2 85.0(3) . .
C14 O8 Cd2 97.5(3) . .
C16 O11 Cd3 95.5(3) . .
C16 O12 Cd3 87.5(3) . .
C17 O13 Cd1 136.1(3) . .
C17 O13 Cd3 99.5(3) . .
Cd1 O13 Cd3 111.10(13) . .
C17 O14 Cd3 86.5(3) . .
C31 O17 Cd1 126.3(3) . .
C31 O18 Cd3 143.8(4) . .
C30 O19 Cd1 135.9(3) . .
C30 O19 Cd2 87.3(2) . .
Cd1 O19 Cd2 132.34(13) . .
C30 O20 Cd2 97.3(3) . .
C32 O23 Cd2 90.8(3) . .
C32 O24 Cd2 92.4(3) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 O1 1.241(5) .
C1 O2 1.247(5) .
C1 C2 1.506(6) .
C2 C7 1.403(6) .
C2 C3 1.415(5) .
C3 C4 1.369(6) .
C3 H3 0.9300 .
C4 C5 1.401(6) .
C4 C15 1.501(5) 3_655
C5 C6 1.388(6) .
C5 H5 0.9300 .
C6 C7 1.378(6) .
C6 N1 1.465(6) .
C7 C8 1.501(5) 1_655
C8 C9 1.389(6) .
C8 C13 1.418(6) .
C8 C7 1.501(5) 1_455
C9 C10 1.388(5) .
C9 N2 1.463(5) .
C10 C11 1.378(6) .
C10 H10 0.9300 .
C11 C12 1.375(6) .
C11 C16 1.505(5) 4_466
C12 C13 1.398(6) .
C12 H12 0.9300 .
C13 C14 1.502(6) .
C14 O8 1.238(5) .
C14 O7 1.264(6) .
C14 Cd2 2.758(4) .
C15 O5 1.220(5) .
C15 O6 1.263(5) .
C15 C4 1.501(5) 3_655
C16 O12 1.231(6) .
C16 O11 1.248(5) .
C16 C11 1.505(5) 4_665
C16 Cd3 2.732(4) .
C17 O14 1.210(6) .
C17 O13 1.273(6) .
C17 C18 1.504(5) .
C18 C19 1.380(6) .
C18 C23 1.393(6) .
C19 C20 1.390(6) 4_566
C19 H19 0.9300 .
C20 C21 1.386(6) .
C20 C19 1.390(6) 4_565
C20 C31 1.500(6) .
C21 C22 1.383(6) 4_565
C21 H21 0.9300 .
C22 C21 1.383(6) 4_566
C22 C23 1.408(6) .
C22 N4 1.483(6) .
C23 C24 1.491(5) .
C24 C29 1.398(6) .
C24 C25 1.418(6) 4_565
C25 C26 1.364(6) .
C25 C24 1.418(6) 4_566
C25 N3 1.472(6) .
C26 C27 1.389(6) .
C26 H26 0.9300 .
C27 C28 1.389(6) 4_566
C27 C32 1.504(6) .
C28 C29 1.382(6) .
C28 C27 1.389(6) 4_565
C28 H28 0.9300 .
C29 C30 1.511(6) .
C30 O19 1.246(5) .
C30 O20 1.249(5) .
C31 O17 1.238(6) .
C31 O18 1.246(6) .
C32 O23 1.238(5) .
C32 O24 1.276(5) .
C32 Cd2 2.751(4) .
Cd1 O17 2.213(3) .
Cd1 O13 2.260(3) .
Cd1 O1W 2.287(4) .
Cd1 O2 2.291(3) .
Cd1 O2W 2.308(3) .
Cd1 O19 2.330(3) .
Cd2 O8 2.308(3) .
Cd2 O20 2.323(3) .
Cd2 O6 2.352(3) .
Cd2 O24 2.384(3) .
Cd2 O23 2.440(3) .
Cd2 O5 2.512(3) .
Cd2 O19 2.537(3) .
Cd2 O7 2.564(3) .
Cd3 O18 2.239(4) .
Cd3 O1 2.239(3) .
Cd3 O13 2.298(3) .
Cd3 O11 2.314(3) .
Cd3 O3W 2.347(4) .
Cd3 O12 2.493(3) .
Cd3 O14 2.607(4) .
N1 O3 1.221(5) .
N1 O4 1.246(6) .
N2 O9 1.229(5) .
N2 O10 1.230(5) .
N3 O22 1.205(6) .
N3 O21 1.211(6) .
N4 O16 1.203(6) .
N4 O15 1.213(6) .
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
O1 C1 C2 C7 107.8(5) . .
O2 C1 C2 C7 -71.0(5) . .
O1 C1 C2 C3 -72.1(5) . .
O2 C1 C2 C3 109.1(5) . .
C7 C2 C3 C4 1.8(6) . .
C1 C2 C3 C4 -178.3(4) . .
C2 C3 C4 C5 -6.8(7) . .
C2 C3 C4 C15 171.8(4) . 3_655
C3 C4 C5 C6 6.3(7) . .
C15 C4 C5 C6 -172.3(4) 3_655 .
C4 C5 C6 C7 -0.9(8) . .
C4 C5 C6 N1 179.2(4) . .
C5 C6 C7 C2 -4.0(7) . .
N1 C6 C7 C2 175.9(4) . .
C5 C6 C7 C8 178.1(4) . 1_655
N1 C6 C7 C8 -1.9(7) . 1_655
C3 C2 C7 C6 3.6(6) . .
C1 C2 C7 C6 -176.3(4) . .
C3 C2 C7 C8 -178.4(4) . 1_655
C1 C2 C7 C8 1.7(6) . 1_655
C13 C8 C9 C10 -2.8(6) . .
C7 C8 C9 C10 -176.0(4) 1_455 .
C13 C8 C9 N2 174.8(4) . .
C7 C8 C9 N2 1.6(6) 1_455 .
C8 C9 C10 C11 2.0(7) . .
N2 C9 C10 C11 -175.7(4) . .
C9 C10 C11 C12 2.2(7) . .
C9 C10 C11 C16 178.6(4) . 4_466
C10 C11 C12 C13 -5.4(7) . .
C16 C11 C12 C13 178.3(4) 4_466 .
C11 C12 C13 C8 4.5(7) . .
C11 C12 C13 C14 -173.1(4) . .
C9 C8 C13 C12 -0.4(6) . .
C7 C8 C13 C12 173.1(4) 1_455 .
C9 C8 C13 C14 177.2(4) . .
C7 C8 C13 C14 -9.3(6) 1_455 .
C12 C13 C14 O8 112.6(5) . .
C8 C13 C14 O8 -64.9(5) . .
C12 C13 C14 O7 -65.8(6) . .
C8 C13 C14 O7 116.6(5) . .
C12 C13 C14 Cd2 77(2) . .
C8 C13 C14 Cd2 -100(2) . .
O14 C17 C18 C19 -100.5(6) . .
O13 C17 C18 C19 80.6(5) . .
O14 C17 C18 C23 77.5(6) . .
O13 C17 C18 C23 -101.3(5) . .
C23 C18 C19 C20 -3.3(7) . 4_566
C17 C18 C19 C20 174.7(4) . 4_566
C19 C20 C21 C22 0.1(6) 4_565 4_565
C31 C20 C21 C22 -177.2(4) . 4_565
C19 C18 C23 C22 0.4(6) . .
C17 C18 C23 C22 -177.6(4) . .
C19 C18 C23 C24 -173.5(4) . .
C17 C18 C23 C24 8.5(6) . .
C21 C22 C23 C18 2.7(6) 4_566 .
N4 C22 C23 C18 179.5(4) . .
C21 C22 C23 C24 176.3(4) 4_566 .
N4 C22 C23 C24 -6.9(6) . .
C18 C23 C24 C29 100.8(5) . .
C22 C23 C24 C29 -72.5(6) . .
C18 C23 C24 C25 -77.3(6) . 4_565
C22 C23 C24 C25 109.3(5) . 4_565
C24 C25 C26 C27 -0.2(7) 4_566 .
N3 C25 C26 C27 177.7(4) . .
C25 C26 C27 C28 1.7(7) . 4_566
C25 C26 C27 C32 -173.7(4) . .
C27 C28 C29 C24 3.2(6) 4_565 .
C27 C28 C29 C30 -179.5(4) 4_565 .
C25 C24 C29 C28 -4.5(6) 4_565 .
C23 C24 C29 C28 177.2(4) . .
C25 C24 C29 C30 178.2(4) 4_565 .
C23 C24 C29 C30 -0.1(6) . .
C28 C29 C30 O19 112.3(5) . .
C24 C29 C30 O19 -70.3(5) . .
C28 C29 C30 O20 -67.0(5) . .
C24 C29 C30 O20 110.3(5) . .
C21 C20 C31 O17 20.1(7) . .
C19 C20 C31 O17 -157.3(4) 4_565 .
C21 C20 C31 O18 -159.8(5) . .
C19 C20 C31 O18 22.9(6) 4_565 .
C26 C27 C32 O23 174.9(4) . .
C28 C27 C32 O23 -0.4(6) 4_566 .
C26 C27 C32 O24 -2.8(6) . .
C28 C27 C32 O24 -178.1(4) 4_566 .
C26 C27 C32 Cd2 76(2) . .
C28 C27 C32 Cd2 -99.0(19) 4_566 .
O23 C32 Cd2 O8 -90.0(3) . .
O24 C32 Cd2 O8 98.5(3) . .
C27 C32 Cd2 O8 13.8(19) . .
O23 C32 Cd2 O20 47.9(3) . .
O24 C32 Cd2 O20 -123.6(2) . .
C27 C32 Cd2 O20 151.7(19) . .
O23 C32 Cd2 O6 -179.7(2) . .
O24 C32 Cd2 O6 8.8(3) . .
C27 C32 Cd2 O6 -75.9(19) . .
O23 C32 Cd2 O24 171.5(4) . .
C27 C32 Cd2 O24 -84.7(19) . .
O24 C32 Cd2 O23 -171.5(4) . .
C27 C32 Cd2 O23 103.8(19) . .
O23 C32 Cd2 O5 -131.5(6) . .
O24 C32 Cd2 O5 57.0(7) . .
C27 C32 Cd2 O5 -28(2) . .
O23 C32 Cd2 O19 97.3(3) . .
O24 C32 Cd2 O19 -74.3(2) . .
C27 C32 Cd2 O19 -158.9(19) . .
O23 C32 Cd2 O7 -38.8(3) . .
O24 C32 Cd2 O7 149.7(2) . .
C27 C32 Cd2 O7 65.0(19) . .
O23 C32 Cd2 C14 -64.5(3) . .
O24 C32 Cd2 C14 124.0(3) . .
C27 C32 Cd2 C14 39.3(19) . .
O7 C14 Cd2 O8 -176.3(4) . .
C13 C14 Cd2 O8 38(2) . .
O8 C14 Cd2 O20 174.3(3) . .
O7 C14 Cd2 O20 -1.9(3) . .
C13 C14 Cd2 O20 -147(2) . .
O8 C14 Cd2 O6 48.9(3) . .
O7 C14 Cd2 O6 -127.3(2) . .
C13 C14 Cd2 O6 87(2) . .
O8 C14 Cd2 O24 -49.9(3) . .
O7 C14 Cd2 O24 133.8(2) . .
C13 C14 Cd2 O24 -12(2) . .
O8 C14 Cd2 O23 -97.8(3) . .
O7 C14 Cd2 O23 85.9(3) . .
C13 C14 Cd2 O23 -60(2) . .
O8 C14 Cd2 O5 95.9(3) . .
O7 C14 Cd2 O5 -80.4(3) . .
C13 C14 Cd2 O5 134(2) . .
O8 C14 Cd2 O19 -160.1(3) . .
O7 C14 Cd2 O19 23.6(5) . .
C13 C14 Cd2 O19 -122(2) . .
O8 C14 Cd2 O7 176.3(4) . .
C13 C14 Cd2 O7 -145(2) . .
O8 C14 Cd2 C32 -73.4(3) . .
O7 C14 Cd2 C32 110.3(3) . .
C13 C14 Cd2 C32 -35(2) . .
O12 C16 Cd3 O18 -93.3(3) . .
O11 C16 Cd3 O18 94.2(3) . .
C11 C16 Cd3 O18 40(2) 4_665 .
O12 C16 Cd3 O1 0.6(3) . .
O11 C16 Cd3 O1 -171.9(3) . .
C11 C16 Cd3 O1 134(2) 4_665 .
O12 C16 Cd3 O13 -163.2(3) . .
O11 C16 Cd3 O13 24.3(4) . .
C11 C16 Cd3 O13 -30(2) 4_665 .
O12 C16 Cd3 O11 172.5(5) . .
C11 C16 Cd3 O11 -55(2) 4_665 .
O12 C16 Cd3 O3W 89.3(3) . .
O11 C16 Cd3 O3W -83.2(3) . .
C11 C16 Cd3 O3W -138(2) 4_665 .
O11 C16 Cd3 O12 -172.5(5) . .
C11 C16 Cd3 O12 133(2) 4_665 .
O12 C16 Cd3 O14 168.4(3) . .
O11 C16 Cd3 O14 -4.1(3) . .
C11 C16 Cd3 O14 -59(2) 4_665 .
C7 C6 N1 O3 22.8(7) . .
C5 C6 N1 O3 -157.3(5) . .
C7 C6 N1 O4 -157.5(5) . .
C5 C6 N1 O4 22.4(8) . .
C10 C9 N2 O9 -150.8(4) . .
C8 C9 N2 O9 31.5(6) . .
C10 C9 N2 O10 31.3(6) . .
C8 C9 N2 O10 -146.4(4) . .
C26 C25 N3 O22 29.2(7) . .
C24 C25 N3 O22 -152.9(5) 4_566 .
C26 C25 N3 O21 -149.0(5) . .
C24 C25 N3 O21 29.0(7) 4_566 .
C21 C22 N4 O16 -22.8(6) 4_566 .
C23 C22 N4 O16 160.1(4) . .
C21 C22 N4 O15 157.5(5) 4_566 .
C23 C22 N4 O15 -19.6(7) . .
O2 C1 O1 Cd3 13.0(7) . .
C2 C1 O1 Cd3 -165.7(3) . .
O18 Cd3 O1 C1 -75.7(4) . .
O13 Cd3 O1 C1 10.2(4) . .
O11 Cd3 O1 C1 -167.5(4) . .
O3W Cd3 O1 C1 101.8(4) . .
O12 Cd3 O1 C1 -161.7(4) . .
O14 Cd3 O1 C1 37.8(5) . .
C16 Cd3 O1 C1 -161.9(4) . .
O1 C1 O2 Cd1 11.0(8) . .
C2 C1 O2 Cd1 -170.3(3) . .
O17 Cd1 O2 C1 52.9(5) . .
O13 Cd1 O2 C1 -47.2(5) . .
O1W Cd1 O2 C1 137.5(5) . .
O2W Cd1 O2 C1 -133.9(5) . .
O19 Cd1 O2 C1 -164.4(6) . .
O6 C15 O5 Cd2 5.5(5) . .
C4 C15 O5 Cd2 -170.4(4) 3_655 .
O8 Cd2 O5 C15 -98.5(3) . .
O20 Cd2 O5 C15 123.3(3) . .
O6 Cd2 O5 C15 -3.1(3) . .
O24 Cd2 O5 C15 -14.8(4) . .
O23 Cd2 O5 C15 -165.8(3) . .
O19 Cd2 O5 C15 73.2(3) . .
O7 Cd2 O5 C15 -151.9(3) . .
C32 Cd2 O5 C15 -57.3(7) . .
C14 Cd2 O5 C15 -124.8(3) . .
O5 C15 O6 Cd2 -5.9(5) . .
C4 C15 O6 Cd2 170.1(3) 3_655 .
O8 Cd2 O6 C15 88.2(3) . .
O20 Cd2 O6 C15 -56.0(3) . .
O24 Cd2 O6 C15 176.3(3) . .
O23 Cd2 O6 C15 172.0(2) . .
O5 Cd2 O6 C15 3.0(3) . .
O19 Cd2 O6 C15 -102.7(3) . .
O7 Cd2 O6 C15 42.0(3) . .
C32 Cd2 O6 C15 172.2(2) . .
C14 Cd2 O6 C15 68.6(3) . .
O8 C14 O7 Cd2 -3.7(4) . .
C13 C14 O7 Cd2 174.7(3) . .
O8 Cd2 O7 C14 2.1(2) . .
O20 Cd2 O7 C14 178.2(3) . .
O6 Cd2 O7 C14 65.6(3) . .
O24 Cd2 O7 C14 -55.9(3) . .
O23 Cd2 O7 C14 -88.8(3) . .
O5 Cd2 O7 C14 96.2(3) . .
O19 Cd2 O7 C14 -169.7(2) . .
C32 Cd2 O7 C14 -72.1(3) . .
O7 C14 O8 Cd2 4.1(5) . .
C13 C14 O8 Cd2 -174.3(3) . .
O20 Cd2 O8 C14 -7.8(3) . .
O6 Cd2 O8 C14 -135.3(3) . .
O24 Cd2 O8 C14 132.5(3) . .
O23 Cd2 O8 C14 78.3(3) . .
O5 Cd2 O8 C14 -82.4(3) . .
O19 Cd2 O8 C14 146.2(5) . .
O7 Cd2 O8 C14 -2.1(2) . .
C32 Cd2 O8 C14 105.2(3) . .
O12 C16 O11 Cd3 -8.1(5) . .
C11 C16 O11 Cd3 172.2(3) 4_665 .
O18 Cd3 O11 C16 -83.7(3) . .
O1 Cd3 O11 C16 11.4(4) . .
O13 Cd3 O11 C16 -165.8(3) . .
O3W Cd3 O11 C16 99.4(3) . .
O12 Cd3 O11 C16 4.2(3) . .
O14 Cd3 O11 C16 175.9(3) . .
O11 C16 O12 Cd3 7.5(5) . .
C11 C16 O12 Cd3 -172.8(4) 4_665 .
O18 Cd3 O12 C16 84.5(3) . .
O1 Cd3 O12 C16 -179.5(3) . .
O13 Cd3 O12 C16 80.9(9) . .
O11 Cd3 O12 C16 -4.2(3) . .
O3W Cd3 O12 C16 -93.9(3) . .
O14 Cd3 O12 C16 -14.6(4) . .
O14 C17 O13 Cd1 -141.5(4) . .
C18 C17 O13 Cd1 37.3(6) . .
O14 C17 O13 Cd3 -6.9(5) . .
C18 C17 O13 Cd3 171.9(3) . .
O17 Cd1 O13 C17 86.9(5) . .
O1W Cd1 O13 C17 -153.6(6) . .
O2 Cd1 O13 C17 -174.6(5) . .
O2W Cd1 O13 C17 -82.3(5) . .
O19 Cd1 O13 C17 -4.0(5) . .
O17 Cd1 O13 Cd3 -44.21(19) . .
O1W Cd1 O13 Cd3 75.3(7) . .
O2 Cd1 O13 Cd3 54.24(17) . .
O2W Cd1 O13 Cd3 146.63(18) . .
O19 Cd1 O13 Cd3 -135.11(16) . .
O18 Cd3 O13 C17 -102.1(3) . .
O1 Cd3 O13 C17 162.6(3) . .
O11 Cd3 O13 C17 -19.3(3) . .
O3W Cd3 O13 C17 76.2(3) . .
O12 Cd3 O13 C17 -98.5(8) . .
O14 Cd3 O13 C17 3.5(3) . .
C16 Cd3 O13 C17 -32.5(4) . .
O18 Cd3 O13 Cd1 45.9(2) . .
O1 Cd3 O13 Cd1 -49.41(19) . .
O11 Cd3 O13 Cd1 128.74(16) . .
O3W Cd3 O13 Cd1 -135.74(19) . .
O12 Cd3 O13 Cd1 49.5(9) . .
O14 Cd3 O13 Cd1 151.5(3) . .
C16 Cd3 O13 Cd1 115.5(3) . .
O13 C17 O14 Cd3 6.0(5) . .
C18 C17 O14 Cd3 -172.7(4) . .
O18 Cd3 O14 C17 73.0(3) . .
O1 Cd3 O14 C17 -39.5(4) . .
O13 Cd3 O14 C17 -3.6(3) . .
O11 Cd3 O14 C17 157.4(3) . .
O3W Cd3 O14 C17 -106.0(3) . .
O12 Cd3 O14 C17 166.0(3) . .
C16 Cd3 O14 C17 159.3(3) . .
O18 C31 O17 Cd1 -9.9(8) . .
C20 C31 O17 Cd1 170.3(3) . .
O13 Cd1 O17 C31 21.0(4) . .
O1W Cd1 O17 C31 -147.6(4) . .
O2 Cd1 O17 C31 -65.0(4) . .
O2W Cd1 O17 C31 146.2(6) . .
O19 Cd1 O17 C31 121.3(4) . .
O17 C31 O18 Cd3 34.7(10) . .
C20 C31 O18 Cd3 -145.5(5) . .
O1 Cd3 O18 C31 41.8(7) . .
O13 Cd3 O18 C31 -53.7(6) . .
O11 Cd3 O18 C31 -179.4(7) . .
O3W Cd3 O18 C31 -86(3) . .
O12 Cd3 O18 C31 126.8(7) . .
O14 Cd3 O18 C31 -103.9(6) . .
C16 Cd3 O18 C31 153.6(7) . .
O20 C30 O19 Cd1 156.1(3) . .
C29 C30 O19 Cd1 -23.1(6) . .
O20 C30 O19 Cd2 -1.0(4) . .
C29 C30 O19 Cd2 179.7(3) . .
O17 Cd1 O19 C30 -34.6(4) . .
O13 Cd1 O19 C30 66.2(4) . .
O1W Cd1 O19 C30 -120.3(4) . .
O2 Cd1 O19 C30 -177.9(6) . .
O2W Cd1 O19 C30 151.1(4) . .
O17 Cd1 O19 Cd2 113.8(2) . .
O13 Cd1 O19 Cd2 -145.36(19) . .
O1W Cd1 O19 Cd2 28.1(2) . .
O2 Cd1 O19 Cd2 -29.5(8) . .
O2W Cd1 O19 Cd2 -60.50(19) . .
O8 Cd2 O19 C30 -157.4(5) . .
O20 Cd2 O19 C30 0.6(2) . .
O6 Cd2 O19 C30 123.3(2) . .
O24 Cd2 O19 C30 -143.6(3) . .
O23 Cd2 O19 C30 -90.2(2) . .
O5 Cd2 O19 C30 72.0(2) . .
O7 Cd2 O19 C30 -14.6(3) . .
C32 Cd2 O19 C30 -116.8(3) . .
C14 Cd2 O19 C30 -29.7(5) . .
O8 Cd2 O19 Cd1 44.0(7) . .
O20 Cd2 O19 Cd1 -158.0(3) . .
O6 Cd2 O19 Cd1 -35.30(18) . .
O24 Cd2 O19 Cd1 57.80(18) . .
O23 Cd2 O19 Cd1 111.17(19) . .
O5 Cd2 O19 Cd1 -86.58(19) . .
O7 Cd2 O19 Cd1 -173.16(14) . .
C32 Cd2 O19 Cd1 84.6(2) . .
C14 Cd2 O19 Cd1 171.7(3) . .
O19 C30 O20 Cd2 1.1(5) . .
C29 C30 O20 Cd2 -179.6(3) . .
O8 Cd2 O20 C30 173.4(2) . .
O6 Cd2 O20 C30 -65.3(3) . .
O24 Cd2 O20 C30 43.3(3) . .
O23 Cd2 O20 C30 90.3(3) . .
O5 Cd2 O20 C30 -109.3(3) . .
O19 Cd2 O20 C30 -0.6(2) . .
O7 Cd2 O20 C30 168.8(3) . .
C32 Cd2 O20 C30 70.8(3) . .
C14 Cd2 O20 C30 169.7(3) . .
O24 C32 O23 Cd2 8.7(4) . .
C27 C32 O23 Cd2 -169.0(3) . .
O8 Cd2 O23 C32 87.0(3) . .
O20 Cd2 O23 C32 -136.0(3) . .
O6 Cd2 O23 C32 0.5(4) . .
O24 Cd2 O23 C32 -4.8(2) . .
O5 Cd2 O23 C32 155.0(3) . .
O19 Cd2 O23 C32 -82.8(3) . .
O7 Cd2 O23 C32 141.0(3) . .
C14 Cd2 O23 C32 113.3(3) . .
O23 C32 O24 Cd2 -8.9(4) . .
C27 C32 O24 Cd2 168.8(3) . .
O8 Cd2 O24 C32 -79.4(3) . .
O20 Cd2 O24 C32 69.1(3) . .
O6 Cd2 O24 C32 -172.4(3) . .
O23 Cd2 O24 C32 4.7(2) . .
O5 Cd2 O24 C32 -163.0(3) . .
O19 Cd2 O24 C32 103.3(3) . .
O7 Cd2 O24 C32 -36.3(3) . .
C14 Cd2 O24 C32 -59.4(3) . .
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 0.000 0.386 -0.105 1391 464 ' '
