#------------------------------------------------------------------------------
#$Date: 2016-02-16 03:10:39 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176453 $
#$URL: svn://www.crystallography.net/cod/cif/7/03/29/7032928.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_7032928
loop_
_publ_author_name
'Feng, Xun'
'Feng, Yu-Quan'
'Chen, Jun Jing'
'Ng, Seik-Weng'
'Wang, Li-Ya'
'Guo, Jin-Zhong'
_publ_section_title
;
 Reticular three-dimensional 3d-4f frameworks constructed through
 substituted imidazole-dicarboxylate: syntheses, luminescence and magnetic
 properties study.
;
_journal_issue                   2
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              804
_journal_page_last               816
_journal_paper_doi               10.1039/c4dt02047b
_journal_volume                  44
_journal_year                    2015
_chemical_formula_moiety
'Er Zn (H2 O)2 (C6 H3 N2 O4) (C6 H4 N2 O4), 2.5H2 O'
_chemical_formula_sum            'C12 H16 Er N4 O12.5 Zn'
_chemical_formula_weight         648.92
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/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                 114.153(1)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   24.2346(14)
_cell_length_b                   9.1735(5)
_cell_length_c                   19.0739(11)
_cell_measurement_reflns_used    8254
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      28.1917
_cell_measurement_theta_min      2.4037
_cell_volume                     3869.2(4)
_computing_cell_refinement       'SAINT (Bruker, 2011)'
_computing_data_collection       'APEX2 (Bruker, 2011)'
_computing_data_reduction        SAINT
_computing_molecular_graphics    'X-Seed (Barbour, 2001)'
_computing_publication_material  'publCIF (Westrip, 2010)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.982
_diffrn_measured_fraction_theta_max 0.982
_diffrn_measurement_device_type  'Bruker SMART APEX diffractometer'
_diffrn_measurement_method       '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  0.0281
_diffrn_reflns_av_sigmaI/netI    0.0306
_diffrn_reflns_limit_h_max       29
_diffrn_reflns_limit_h_min       -31
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_number            13649
_diffrn_reflns_theta_full        27.50
_diffrn_reflns_theta_max         27.50
_diffrn_reflns_theta_min         2.40
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    5.622
_exptl_absorpt_correction_T_max  1
_exptl_absorpt_correction_T_min  0.518840
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS (Sheldrick, 1996)'
_exptl_crystal_colour            pink
_exptl_crystal_density_diffrn    2.228
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             2512
_exptl_crystal_size_max          0.19
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.13
_refine_diff_density_max         2.532
_refine_diff_density_min         -1.664
_refine_diff_density_rms         0.160
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.029
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     280
_refine_ls_number_reflns         4361
_refine_ls_number_restraints     24
_refine_ls_restrained_S_all      1.040
_refine_ls_R_factor_all          0.0327
_refine_ls_R_factor_gt           0.0301
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0560P)²+15.0410P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0846
_refine_ls_wR_factor_ref         0.0867
_reflns_number_gt                4013
_reflns_number_total             4361
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            c4dt02047b3.cif
_cod_data_source_block           er
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_absorpt_correction_type' value 'Multi-scan' changed to
'multi-scan' 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 2827 2014-09-09 07:05:25Z andrius 

 Adding full bibliography for 7032926--7032931.cif.
;
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_original_formula_sum        'C12 H16 Er N4 O12.50 Zn'
_cod_database_code               7032928
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -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
Er1 Er 0.541852(8) 0.694238(18) 0.494915(10) 0.01694(8) Uani 1 1 d .
Zn1 Zn 0.71220(2) 0.48920(5) 0.33596(3) 0.02032(12) Uani 1 1 d .
O1 O 0.61502(17) 0.6492(4) 0.4571(2) 0.0359(8) Uani 1 1 d .
O2 O 0.66433(17) 0.6349(4) 0.3819(2) 0.0338(8) Uani 1 1 d .
O3 O 0.54712(13) 0.4332(3) 0.49581(16) 0.0220(6) Uani 1 1 d .
O4 O 0.54105(15) 0.1964(3) 0.4821(2) 0.0286(8) Uani 1 1 d .
O5 O 0.60784(14) 0.8765(3) 0.55409(19) 0.0303(7) Uani 1 1 d .
O6 O 0.69542(15) 0.9819(3) 0.57354(18) 0.0279(7) Uani 1 1 d .
O7 O 0.57664(15) 0.6323(4) 0.62112(18) 0.0296(7) Uani 1 1 d .
O8 O 0.62062(15) 0.5433(4) 0.73918(19) 0.0302(7) Uani 1 1 d .
O1w O 0.51820(17) 0.9106(4) 0.4181(2) 0.0359(8) Uani 1 1 d .
H11 H 0.5426 0.9766 0.4422 0.054 Uiso 1 1 d R
H12 H 0.4827 0.9375 0.4089 0.054 Uiso 1 1 d R
O2w O 0.48147(16) 0.6314(4) 0.36850(19) 0.0415(9) Uani 1 1 d .
H21 H 0.4610 0.5574 0.3684 0.062 Uiso 1 1 d R
H22 H 0.5031 0.6132 0.3444 0.062 Uiso 1 1 d R
O3w O 0.43583(16) 1.0547(4) 0.29726(19) 0.137(3) Uani 1 1 d RU
H31 H 0.4256 1.0037 0.2573 0.206 Uiso 1 1 d R
H32 H 0.4504 1.1344 0.2909 0.206 Uiso 1 1 d R
O4w O 0.4006(5) 0.8859(12) 0.1651(6) 0.155(4) Uani 1 1 d U
H41 H 0.3762 0.8167 0.1469 0.232 Uiso 1 1 d R
H42 H 0.4040 0.9322 0.1290 0.232 Uiso 1 1 d R
O5w O 0.5000 0.734(2) 0.2500 0.094(5) Uani 0.50 2 d SPU
H51 H 0.4703 0.7893 0.2286 0.140 Uiso 0.50 1 d PR
O6w O 0.5000 1.314(2) 0.2500 0.097(6) Uani 0.50 2 d SPU
H61 H 0.5230 1.3650 0.2869 0.146 Uiso 0.50 1 d PR
N1 N 0.68474(17) 0.3488(4) 0.4046(2) 0.0232(7) Uani 1 1 d .
N2 N 0.6432(2) 0.1827(4) 0.4502(3) 0.0298(9) Uani 1 1 d .
H2 H 0.6347 0.0970 0.4639 0.036 Uiso 1 1 calc R
N3 N 0.75692(17) 0.8328(4) 0.7039(2) 0.0212(7) Uani 1 1 d .
N4 N 0.72836(17) 0.6649(4) 0.7669(2) 0.0229(7) Uani 1 1 d .
C1 C 0.6406(2) 0.5776(5) 0.4217(3) 0.0240(9) Uani 1 1 d .
C2 C 0.64509(19) 0.4168(5) 0.4294(2) 0.0203(8) Uani 1 1 d .
C3 C 0.6182(2) 0.3131(4) 0.4576(3) 0.0218(9) Uani 1 1 d .
C4 C 0.5662(2) 0.3153(4) 0.4795(2) 0.0194(8) Uani 1 1 d .
C5 C 0.6831(2) 0.2073(5) 0.4184(3) 0.0272(10) Uani 1 1 d .
C6 C 0.7187(3) 0.0908(6) 0.4019(3) 0.0421(13) Uani 1 1 d .
H6A H 0.7574 0.1287 0.4083 0.063 Uiso 1 1 calc R
H6B H 0.6973 0.0575 0.3500 0.063 Uiso 1 1 calc R
H6C H 0.7243 0.0108 0.4366 0.063 Uiso 1 1 calc R
C7 C 0.6645(2) 0.8914(4) 0.5914(2) 0.0218(8) Uani 1 1 d .
C8 C 0.6969(2) 0.8038(4) 0.6616(2) 0.0190(8) Uani 1 1 d .
C9 C 0.6791(2) 0.6989(4) 0.7007(2) 0.0191(8) Uani 1 1 d .
C10 C 0.62214(19) 0.6210(4) 0.6863(2) 0.0206(8) Uani 1 1 d .
C11 C 0.77405(19) 0.7463(5) 0.7661(2) 0.0231(8) Uani 1 1 d .
C12 C 0.8365(2) 0.7445(8) 0.8273(3) 0.0475(15) Uani 1 1 d .
H12A H 0.8645 0.7208 0.8053 0.071 Uiso 1 1 calc R
H12B H 0.8391 0.6728 0.8652 0.071 Uiso 1 1 calc R
H12C H 0.8461 0.8388 0.8511 0.071 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'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Zn Zn 0.2839 1.4301 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Er Er -0.2586 4.9576 '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 Er1 O5 78.69(13) . .
O1 Er1 O7 107.44(14) . .
O5 Er1 O7 77.12(11) . .
O1 Er1 O2w 82.15(14) . .
O5 Er1 O2w 135.66(12) . .
O7 Er1 O2w 147.14(12) . .
O1 Er1 O1w 88.75(14) . .
O5 Er1 O1w 68.72(12) . .
O7 Er1 O1w 138.41(12) . .
O2w Er1 O1w 71.27(12) . .
O1 Er1 O3 76.59(11) . .
O5 Er1 O3 135.04(11) . .
O7 Er1 O3 75.35(11) . .
O2w Er1 O3 76.64(11) . .
O1w Er1 O3 146.23(11) . .
O1 Er1 O4 164.82(12) . 5_666
O5 Er1 O4 94.13(12) . 5_666
O7 Er1 O4 83.59(12) . 5_666
O2w Er1 O4 94.20(13) . 5_666
O1w Er1 O4 76.15(12) . 5_666
O3 Er1 O4 117.05(9) . 5_666
O1 Er1 O3 139.43(11) . 5_666
O5 Er1 O3 139.07(11) . 5_666
O7 Er1 O3 76.53(10) . 5_666
O2w Er1 O3 76.37(11) . 5_666
O1w Er1 O3 115.47(11) . 5_666
O3 Er1 O3 65.23(11) . 5_666
O4 Er1 O3 52.25(11) 5_666 5_666
N3 Zn1 N4 96.55(15) 7_666 6_565
N3 Zn1 N1 162.96(14) 7_666 .
N4 Zn1 N1 99.54(15) 6_565 .
N3 Zn1 O2 89.78(13) 7_666 .
N4 Zn1 O2 160.77(15) 6_565 .
N1 Zn1 O2 76.78(13) . .
N3 Zn1 O6 77.84(13) 7_666 7_666
N4 Zn1 O6 100.55(14) 6_565 7_666
N1 Zn1 O6 93.66(13) . 7_666
O2 Zn1 O6 98.52(14) . 7_666
N3 Zn1 O8 100.77(14) 7_666 6_565
N4 Zn1 O8 76.60(13) 6_565 6_565
N1 Zn1 O8 88.44(14) . 6_565
O2 Zn1 O8 84.39(13) . 6_565
O6 Zn1 O8 176.73(12) 7_666 6_565
C1 O1 Er1 154.3(3) . .
C1 O2 Zn1 116.3(3) . .
C4 O3 Er1 151.2(3) . .
C4 O3 Er1 91.7(2) . 5_666
Er1 O3 Er1 114.77(11) . 5_666
C4 O4 Er1 95.7(2) . 5_666
C7 O5 Er1 137.6(3) . .
C7 O6 Zn1 113.1(3) . 7_666
C10 O7 Er1 147.6(3) . .
C10 O8 Zn1 113.1(3) . 6_566
Er1 O1w H11 108.9 . .
Er1 O1w H12 109.9 . .
H11 O1w H12 109.4 . .
Er1 O2w H21 108.9 . .
Er1 O2w H22 110.3 . .
H21 O2w H22 109.6 . .
H31 O3w H32 109.7 . .
H41 O4w H42 109.5 . .
C5 N1 C2 107.0(4) . .
C5 N1 Zn1 139.1(3) . .
C2 N1 Zn1 111.9(3) . .
C5 N2 C3 109.1(4) . .
C5 N2 H2 125.4 . .
C3 N2 H2 125.4 . .
C11 N3 C8 106.0(3) . .
C11 N3 Zn1 139.8(3) . 7_666
C8 N3 Zn1 113.2(3) . 7_666
C11 N4 C9 105.9(3) . .
C11 N4 Zn1 139.3(3) . 6_566
C9 N4 Zn1 114.8(3) . 6_566
O2 C1 O1 123.7(4) . .
O2 C1 C2 116.6(4) . .
O1 C1 C2 119.7(4) . .
C3 C2 N1 109.1(4) . .
C3 C2 C1 134.2(4) . .
N1 C2 C1 116.7(4) . .
N2 C3 C2 105.1(4) . .
N2 C3 C4 120.2(4) . .
C2 C3 C4 133.8(4) . .
O4 C4 O3 119.9(4) . .
O4 C4 C3 118.7(4) . .
O3 C4 C3 121.4(4) . .
N1 C5 N2 109.6(4) . .
N1 C5 C6 126.5(4) . .
N2 C5 C6 123.9(4) . .
C5 C6 H6A 109.5 . .
C5 C6 H6B 109.5 . .
H6A C6 H6B 109.5 . .
C5 C6 H6C 109.5 . .
H6A C6 H6C 109.5 . .
H6B C6 H6C 109.5 . .
O6 C7 O5 123.2(4) . .
O6 C7 C8 116.8(4) . .
O5 C7 C8 120.0(4) . .
N3 C8 C9 107.8(4) . .
N3 C8 C7 117.9(4) . .
C9 C8 C7 134.1(4) . .
N4 C9 C8 107.9(4) . .
N4 C9 C10 117.1(4) . .
C8 C9 C10 134.9(4) . .
O8 C10 O7 122.1(4) . .
O8 C10 C9 117.4(4) . .
O7 C10 C9 120.5(4) . .
N4 C11 N3 112.4(4) . .
N4 C11 C12 124.3(4) . .
N3 C11 C12 123.3(4) . .
C11 C12 H12A 109.5 . .
C11 C12 H12B 109.5 . .
H12A C12 H12B 109.5 . .
C11 C12 H12C 109.5 . .
H12A C12 H12C 109.5 . .
H12B C12 H12C 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Er1 O1 2.210(3) .
Er1 O3 2.397(3) .
Er1 O3 2.522(3) 5_666
Er1 O4 2.441(3) 5_666
Er1 O5 2.269(3) .
Er1 O7 2.273(3) .
Er1 O1w 2.393(3) .
Er1 O2w 2.324(3) .
Zn1 O2 2.175(3) .
Zn1 O6 2.214(3) 7_666
Zn1 O8 2.252(3) 6_565
Zn1 N1 2.129(4) .
Zn1 N3 2.066(4) 7_666
Zn1 N4 2.076(4) 6_565
O1 C1 1.269(5) .
O2 C1 1.242(5) .
O3 C4 1.265(5) .
O3 Er1 2.522(3) 5_666
O4 C4 1.261(5) .
O4 Er1 2.441(3) 5_666
O5 C7 1.270(5) .
O6 C7 1.255(5) .
O6 Zn1 2.214(3) 7_666
O7 C10 1.285(5) .
O8 C10 1.248(5) .
O8 Zn1 2.252(3) 6_566
O1w H11 0.8395 .
O1w H12 0.8405 .
O2w H21 0.8403 .
O2w H22 0.8432 .
O3w H31 0.8416 .
O3w H32 0.8418 .
O4w H41 0.8400 .
O4w H42 0.8401 .
O5w H51 0.8396 .
O6w H61 0.8397 .
N1 C5 1.327(6) .
N1 C2 1.381(5) .
N2 C5 1.353(6) .
N2 C3 1.375(5) .
N2 H2 0.8800 .
N3 C11 1.343(5) .
N3 C8 1.370(6) .
N3 Zn1 2.066(4) 7_666
N4 C11 1.341(6) .
N4 C9 1.372(6) .
N4 Zn1 2.076(4) 6_566
C1 C2 1.482(6) .
C2 C3 1.381(6) .
C3 C4 1.480(6) .
C5 C6 1.486(6) .
C6 H6A 0.9600 .
C6 H6B 0.9600 .
C6 H6C 0.9600 .
C7 C8 1.481(6) .
C8 C9 1.389(6) .
C9 C10 1.478(6) .
C11 C12 1.486(7) .
C12 H12A 0.9600 .
C12 H12B 0.9600 .
C12 H12C 0.9600 .
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
O1w H11 O4 0.84 2.16 2.849(5) 139.1 1_565
O1w H12 O3w 0.84 2.24 2.698(5) 114.7 .
O2w H21 O7 0.84 2.01 2.847(5) 171.8 5_666
O2w H22 O5w 0.84 2.09 2.649(8) 123.7 .
O3w H31 O4w 0.84 1.94 2.779(10) 178.9 .
O3w H32 O6w 0.84 2.35 3.167(15) 163.2 .
O4w H41 O2 0.84 1.90 2.725(11) 167.6 2_655
O4w H42 O1w 0.84 2.41 2.999(10) 128.1 2_655
O5w H51 O4w 0.84 1.85 2.681(15) 168.4 .
N2 H2 O6 0.88 2.27 2.845(5) 123.3 1_545
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
O5 Er1 O1 C1 178.3(8) . .
O7 Er1 O1 C1 105.9(8) . .
O2w Er1 O1 C1 -41.9(8) . .
O1w Er1 O1 C1 -113.1(8) . .
O3 Er1 O1 C1 36.2(8) . .
O4 Er1 O1 C1 -118.8(8) 5_666 .
O3 Er1 O1 C1 16.4(9) 5_666 .
N3 Zn1 O2 C1 -173.0(4) 7_666 .
N4 Zn1 O2 C1 77.4(6) 6_565 .
N1 Zn1 O2 C1 -3.5(3) . .
O6 Zn1 O2 C1 -95.3(3) 7_666 .
O8 Zn1 O2 C1 86.2(4) 6_565 .
O1 Er1 O3 C4 -10.6(6) . .
O5 Er1 O3 C4 -69.0(6) . .
O7 Er1 O3 C4 -123.0(6) . .
O2w Er1 O3 C4 74.3(6) . .
O1w Er1 O3 C4 56.0(7) . .
O4 Er1 O3 C4 162.2(6) 5_666 .
O3 Er1 O3 C4 155.3(7) 5_666 .
O1 Er1 O3 Er1 -165.93(16) . 5_666
O5 Er1 O3 Er1 135.68(15) . 5_666
O7 Er1 O3 Er1 81.69(13) . 5_666
O2w Er1 O3 Er1 -80.96(14) . 5_666
O1w Er1 O3 Er1 -99.3(2) . 5_666
O4 Er1 O3 Er1 6.93(17) 5_666 5_666
O3 Er1 O3 Er1 0.0 5_666 5_666
O1 Er1 O5 C7 -43.4(4) . .
O7 Er1 O5 C7 67.7(4) . .
O2w Er1 O5 C7 -109.6(4) . .
O1w Er1 O5 C7 -136.5(5) . .
O3 Er1 O5 C7 14.3(5) . .
O4 Er1 O5 C7 150.1(4) 5_666 .
O3 Er1 O5 C7 118.7(4) 5_666 .
O1 Er1 O7 C10 31.1(6) . .
O5 Er1 O7 C10 -42.5(5) . .
O2w Er1 O7 C10 134.0(5) . .
O1w Er1 O7 C10 -77.5(6) . .
O3 Er1 O7 C10 101.6(6) . .
O4 Er1 O7 C10 -138.2(6) 5_666 .
O3 Er1 O7 C10 169.1(6) 5_666 .
N3 Zn1 N1 C5 -150.7(5) 7_666 .
N4 Zn1 N1 C5 9.9(5) 6_565 .
O2 Zn1 N1 C5 170.6(5) . .
O6 Zn1 N1 C5 -91.5(5) 7_666 .
O8 Zn1 N1 C5 86.0(5) 6_565 .
N3 Zn1 N1 C2 48.3(6) 7_666 .
N4 Zn1 N1 C2 -151.2(3) 6_565 .
O2 Zn1 N1 C2 9.6(3) . .
O6 Zn1 N1 C2 107.5(3) 7_666 .
O8 Zn1 N1 C2 -75.0(3) 6_565 .
Zn1 O2 C1 O1 174.6(4) . .
Zn1 O2 C1 C2 -3.1(5) . .
Er1 O1 C1 O2 135.1(6) . .
Er1 O1 C1 C2 -47.3(10) . .
C5 N1 C2 C3 -1.1(5) . .
Zn1 N1 C2 C3 166.0(3) . .
C5 N1 C2 C1 178.3(4) . .
Zn1 N1 C2 C1 -14.5(5) . .
O2 C1 C2 C3 -168.6(5) . .
O1 C1 C2 C3 13.6(8) . .
O2 C1 C2 N1 12.1(6) . .
O1 C1 C2 N1 -165.6(4) . .
C5 N2 C3 C2 -0.5(6) . .
C5 N2 C3 C4 170.5(4) . .
N1 C2 C3 N2 1.0(5) . .
C1 C2 C3 N2 -178.4(5) . .
N1 C2 C3 C4 -168.2(5) . .
C1 C2 C3 C4 12.5(9) . .
Er1 O4 C4 O3 7.0(5) 5_666 .
Er1 O4 C4 C3 -173.4(4) 5_666 .
Er1 O3 C4 O4 -164.4(4) . .
Er1 O3 C4 O4 -6.7(4) 5_666 .
Er1 O3 C4 C3 15.9(9) . .
Er1 O3 C4 C3 173.6(4) 5_666 .
N2 C3 C4 O4 -8.5(7) . .
C2 C3 C4 O4 159.4(5) . .
N2 C3 C4 O3 171.2(4) . .
C2 C3 C4 O3 -21.0(8) . .
C2 N1 C5 N2 0.8(5) . .
Zn1 N1 C5 N2 -160.8(4) . .
C2 N1 C5 C6 -179.6(5) . .
Zn1 N1 C5 C6 18.8(9) . .
C3 N2 C5 N1 -0.2(6) . .
C3 N2 C5 C6 -179.8(5) . .
Zn1 O6 C7 O5 167.8(3) 7_666 .
Zn1 O6 C7 C8 -9.7(5) 7_666 .
Er1 O5 C7 O6 125.2(4) . .
Er1 O5 C7 C8 -57.4(6) . .
C11 N3 C8 C9 0.4(5) . .
Zn1 N3 C8 C9 -170.4(3) 7_666 .
C11 N3 C8 C7 176.1(4) . .
Zn1 N3 C8 C7 5.4(5) 7_666 .
O6 C7 C8 N3 3.3(6) . .
O5 C7 C8 N3 -174.2(4) . .
O6 C7 C8 C9 177.7(4) . .
O5 C7 C8 C9 0.2(7) . .
C11 N4 C9 C8 -0.9(5) . .
Zn1 N4 C9 C8 179.3(3) 6_566 .
C11 N4 C9 C10 178.7(4) . .
Zn1 N4 C9 C10 -1.1(5) 6_566 .
N3 C8 C9 N4 0.3(5) . .
C7 C8 C9 N4 -174.5(4) . .
N3 C8 C9 C10 -179.2(4) . .
C7 C8 C9 C10 6.1(8) . .
Zn1 O8 C10 O7 168.3(3) 6_566 .
Zn1 O8 C10 C9 -10.6(5) 6_566 .
Er1 O7 C10 O8 -161.2(4) . .
Er1 O7 C10 C9 17.7(8) . .
N4 C9 C10 O8 8.4(6) . .
C8 C9 C10 O8 -172.2(4) . .
N4 C9 C10 O7 -170.5(4) . .
C8 C9 C10 O7 8.9(7) . .
C9 N4 C11 N3 1.2(5) . .
Zn1 N4 C11 N3 -179.1(3) 6_566 .
C9 N4 C11 C12 179.9(5) . .
Zn1 N4 C11 C12 -0.3(8) 6_566 .
C8 N3 C11 N4 -1.0(5) . .
Zn1 N3 C11 N4 165.8(3) 7_666 .
C8 N3 C11 C12 -179.8(5) . .
Zn1 N3 C11 C12 -13.0(8) 7_666 .
