#------------------------------------------------------------------------------
#$Date: 2016-02-16 03:10:39 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176453 $
#$URL: svn://www.crystallography.net/cod/cif/7/02/54/7025443.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_7025443
loop_
_publ_author_name
'Xu, Hai-Bing'
'Zhong, Ye-Teng'
'Zhang, Wei-Xiong'
'Chen, Zhong-Ning'
'Chen, Xiao-Ming'
_publ_section_title
;
 Syntheses, structures and photophysical properties of heterotrinuclear
 Zn2Ln clusters (Ln = Nd, Eu, Tb, Er, Yb).
;
_journal_issue                   24
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              5676
_journal_page_last               5682
_journal_paper_doi               10.1039/c000783h
_journal_volume                  39
_journal_year                    2010
_chemical_formula_sum            'C50 H33.5 Cl Eu F12 N4 O10 Zn2'
_chemical_formula_weight         1396.46
_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                 124.9360(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   34.7248(15)
_cell_length_b                   18.3371(8)
_cell_length_c                   23.9455(11)
_cell_measurement_reflns_used    8565
_cell_measurement_temperature    298(2)
_cell_measurement_theta_max      26.013
_cell_measurement_theta_min      2.331
_cell_volume                     12499.7(10)
_computing_cell_refinement       'Bruker XSCANS'
_computing_data_collection       'Bruker XSCANS'
_computing_data_reduction        'Bruker SHELXTL'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      298(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  CCD
_diffrn_measurement_method       '/w scan'
_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  0.0342
_diffrn_reflns_av_sigmaI/netI    0.0436
_diffrn_reflns_limit_h_max       42
_diffrn_reflns_limit_h_min       -41
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_limit_l_min       -29
_diffrn_reflns_number            33696
_diffrn_reflns_theta_full        26.00
_diffrn_reflns_theta_max         26.00
_diffrn_reflns_theta_min         1.32
_exptl_absorpt_coefficient_mu    1.883
_exptl_absorpt_correction_T_max  0.8488
_exptl_absorpt_correction_T_min  0.7654
_exptl_absorpt_correction_type   psi-scan
_exptl_absorpt_process_details   '(North et al., 1968)'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.484
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             5516
_exptl_crystal_size_max          0.18
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.10
_refine_diff_density_max         1.602
_refine_diff_density_min         -0.635
_refine_diff_density_rms         0.210
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.049
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     719
_refine_ls_number_reflns         12279
_refine_ls_number_restraints     110
_refine_ls_restrained_S_all      1.055
_refine_ls_R_factor_all          0.0794
_refine_ls_R_factor_gt           0.0511
_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)+(0.0981P)²+1.2424P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1371
_refine_ls_wR_factor_ref         0.1654
_reflns_number_gt                8513
_reflns_number_total             12279
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c000783h.txt
_cod_data_source_block           eu
_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 
;
_cod_original_sg_symbol_H-M      C2/c
_cod_original_formula_sum        'C50 H33.50 Cl Eu F12 N4 O10 Zn2'
_cod_database_code               7025443
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
_atom_site_disorder_assembly
_atom_site_disorder_group
Eu1 Eu 0.142021(8) 0.681500(15) 0.588753(13) 0.05550(12) Uani 1 1 d . . .
Zn1 Zn 0.16660(2) 0.58231(4) 0.49672(3) 0.06163(19) Uani 1 1 d . . .
Zn2 Zn 0.05847(2) 0.62737(3) 0.43078(3) 0.05682(18) Uani 1 1 d . . .
N1 N 0.21855(19) 0.5046(3) 0.5480(3) 0.0805(15) Uani 1 1 d . . .
N2 N 0.19557(15) 0.6454(3) 0.4558(2) 0.0636(12) Uani 1 1 d . . .
N3 N 0.02205(14) 0.5361(2) 0.4310(2) 0.0554(10) Uani 1 1 d . . .
N4 N 0.00419(17) 0.6986(3) 0.3681(2) 0.0657(12) Uani 1 1 d . . .
O1 O 0.20561(11) 0.6246(2) 0.59853(18) 0.0638(10) Uani 1 1 d . . .
O2 O 0.13018(12) 0.68347(18) 0.47715(18) 0.0580(9) Uani 1 1 d . . .
O3 O 0.11272(11) 0.57060(18) 0.52088(17) 0.0562(9) Uani 1 1 d . . .
O4 O 0.06166(11) 0.69685(19) 0.50415(18) 0.0560(9) Uani 1 1 d . . .
O5 O 0.06203(15) 0.5882(3) 0.35392(19) 0.0760(11) Uani 1 1 d . C .
O6 O 0.12656(14) 0.5198(2) 0.4125(2) 0.0781(11) Uani 1 1 d . C .
O7 O 0.13688(16) 0.8102(2) 0.5692(2) 0.0793(12) Uani 1 1 d . . .
O8 O 0.20696(13) 0.7417(3) 0.6871(2) 0.0826(13) Uani 1 1 d . . .
O9 O 0.11238(14) 0.7200(2) 0.6535(2) 0.0763(11) Uani 1 1 d . B .
O10 O 0.16584(14) 0.5957(2) 0.6800(2) 0.0752(11) Uani 1 1 d . B .
C101 C 0.1320(3) 0.9356(4) 0.5713(4) 0.124(3) Uani 1 1 d D . .
F1 F 0.1603(4) 0.9915(5) 0.5943(6) 0.148(2) Uani 0.564(6) 1 d PD A 1
F2 F 0.1040(4) 0.9333(6) 0.5037(5) 0.148(2) Uani 0.564(6) 1 d PD A 1
F3 F 0.1022(4) 0.9556(5) 0.5896(5) 0.148(2) Uani 0.564(6) 1 d PD A 1
F1B F 0.1381(5) 0.9941(7) 0.6062(6) 0.148(2) Uani 0.436(6) 1 d PD A 2
F2B F 0.1555(4) 0.9560(6) 0.5419(6) 0.148(2) Uani 0.436(6) 1 d PD A 2
F3B F 0.0872(4) 0.9331(8) 0.5164(7) 0.148(2) Uani 0.436(6) 1 d PD A 2
C15A C 0.2549(4) 0.8117(8) 0.7830(5) 0.144(3) Uani 0.540(8) 1 d PDU A 1
F4 F 0.2678(6) 0.8813(7) 0.7992(7) 0.145(2) Uani 0.540(8) 1 d PDU A 1
F5 F 0.2929(4) 0.7719(7) 0.8028(6) 0.145(2) Uani 0.540(8) 1 d PDU A 1
F6 F 0.2415(4) 0.7887(7) 0.8227(5) 0.145(2) Uani 0.540(8) 1 d PDU A 1
C15B C 0.2601(4) 0.8109(9) 0.7793(5) 0.144(3) Uani 0.460(8) 1 d PD A 2
F4B F 0.2676(7) 0.8712(9) 0.8157(8) 0.145(2) Uani 0.460(8) 1 d PD A 2
F5B F 0.2960(4) 0.8047(8) 0.7734(7) 0.145(2) Uani 0.460(8) 1 d PD A 2
F6B F 0.2662(5) 0.7569(8) 0.8216(6) 0.145(2) Uani 0.460(8) 1 d PD A 2
C16A C 0.1020(5) 0.7565(7) 0.7368(7) 0.152(3) Uani 0.494(9) 1 d PDU B 1
F7 F 0.0903(5) 0.8220(7) 0.7064(7) 0.1446(18) Uani 0.494(9) 1 d PDU B 1
F8 F 0.0629(5) 0.7290(7) 0.7264(8) 0.1446(18) Uani 0.494(9) 1 d PDU B 1
F9 F 0.1303(4) 0.7705(8) 0.8033(6) 0.1446(18) Uani 0.494(9) 1 d PDU B 1
C16B C 0.0996(5) 0.7576(7) 0.7323(7) 0.152(3) Uani 0.506(9) 1 d PDU B 2
F7B F 0.1140(5) 0.8261(7) 0.7341(7) 0.1446(18) Uani 0.506(9) 1 d PDU B 2
F8B F 0.0528(4) 0.7593(8) 0.6875(6) 0.1446(18) Uani 0.506(9) 1 d PDU B 2
F9B F 0.1059(5) 0.7449(7) 0.7915(6) 0.1446(18) Uani 0.506(9) 1 d PDU B 2
C11A C 0.2008(6) 0.5399(8) 0.7846(9) 0.163(4) Uani 0.341(6) 1 d PD B 1
F10 F 0.2075(8) 0.4792(9) 0.7596(8) 0.156(2) Uani 0.341(6) 1 d PD B 1
F11 F 0.2436(6) 0.5702(9) 0.8255(9) 0.156(2) Uani 0.341(6) 1 d PD B 1
F12 F 0.1886(7) 0.5153(11) 0.8250(11) 0.156(2) Uani 0.341(6) 1 d PD B 1
C11B C 0.1965(4) 0.5369(6) 0.7826(6) 0.163(4) Uani 0.659(6) 1 d PDU B 2
F10B F 0.1702(3) 0.4773(5) 0.7604(4) 0.156(2) Uani 0.659(6) 1 d PDU B 2
F11B F 0.2357(3) 0.5203(6) 0.7864(5) 0.156(2) Uani 0.659(6) 1 d PDU B 2
F12B F 0.2088(4) 0.5470(6) 0.8459(5) 0.156(2) Uani 0.659(6) 1 d PDU B 2
C1 C 0.2243(3) 0.4475(5) 0.5205(5) 0.120(3) Uani 1 1 d . . .
H1A H 0.2010 0.4348 0.4757 0.144 Uiso 1 1 d R . .
C2 C 0.2655(4) 0.4022(6) 0.5581(7) 0.162(5) Uani 1 1 d . . .
H2A H 0.2691 0.3601 0.5399 0.195 Uiso 1 1 d R . .
C3 C 0.2986(4) 0.4227(6) 0.6220(6) 0.143(4) Uani 1 1 d . . .
H3A H 0.3266 0.3966 0.6467 0.172 Uiso 1 1 d R . .
C4 C 0.2944(3) 0.4827(4) 0.6544(5) 0.098(2) Uani 1 1 d . . .
C5 C 0.3269(3) 0.5038(6) 0.7233(5) 0.117(3) Uani 1 1 d . . .
H5A H 0.3544 0.4771 0.7505 0.140 Uiso 1 1 d R . .
C6 C 0.3176(2) 0.5612(5) 0.7472(4) 0.098(3) Uani 1 1 d . . .
H6A H 0.3395 0.5735 0.7926 0.117 Uiso 1 1 d R . .
C7 C 0.27699(19) 0.6036(4) 0.7078(3) 0.0806(19) Uani 1 1 d . . .
H7A H 0.2723 0.6431 0.7276 0.097 Uiso 1 1 d R . .
C8 C 0.24374(18) 0.5856(3) 0.6406(3) 0.0666(16) Uani 1 1 d . . .
C9 C 0.2519(2) 0.5228(4) 0.6133(4) 0.0808(19) Uani 1 1 d . . .
C10 C 0.2280(2) 0.6262(4) 0.4461(3) 0.0771(17) Uani 1 1 d . . .
H10A H 0.2414 0.5801 0.4601 0.093 Uiso 1 1 d R . .
C11 C 0.2434(3) 0.6720(5) 0.4163(4) 0.093(2) Uani 1 1 d . . .
H11A H 0.2662 0.6565 0.4100 0.111 Uiso 1 1 d R . .
C12 C 0.2242(2) 0.7392(5) 0.3964(4) 0.088(2) Uani 1 1 d . . .
H12A H 0.2343 0.7700 0.3763 0.106 Uiso 1 1 d R . .
C13 C 0.1894(2) 0.7633(4) 0.4045(3) 0.0678(15) Uani 1 1 d . . .
C14 C 0.1677(2) 0.8320(4) 0.3842(3) 0.0807(19) Uani 1 1 d . . .
H14A H 0.1765 0.8655 0.3644 0.097 Uiso 1 1 d R . .
C15 C 0.1344(2) 0.8501(4) 0.3950(3) 0.0772(18) Uani 1 1 d . . .
H15A H 0.1202 0.8957 0.3811 0.093 Uiso 1 1 d R . .
C16 C 0.1205(2) 0.7997(3) 0.4266(3) 0.0686(15) Uani 1 1 d . . .
H16A H 0.0976 0.8131 0.4334 0.082 Uiso 1 1 d R . .
C17 C 0.14082(18) 0.7325(3) 0.4465(2) 0.0569(13) Uani 1 1 d . . .
C18 C 0.17587(18) 0.7134(3) 0.4355(3) 0.0577(13) Uani 1 1 d . . .
C19 C -0.02279(19) 0.5212(3) 0.3867(3) 0.0677(15) Uani 1 1 d . . .
H19A H -0.0422 0.5559 0.3543 0.081 Uiso 1 1 d R . .
C20 C -0.0420(2) 0.4537(4) 0.3876(3) 0.0770(18) Uani 1 1 d . . .
H20A H -0.0739 0.4450 0.3560 0.092 Uiso 1 1 d R . .
C21 C -0.0153(2) 0.4032(4) 0.4331(3) 0.0722(16) Uani 1 1 d . . .
H21A H -0.0282 0.3586 0.4327 0.087 Uiso 1 1 d R . .
C22 C 0.03297(19) 0.4168(3) 0.4821(3) 0.0648(14) Uani 1 1 d . . .
C23 C 0.0638(2) 0.3685(3) 0.5336(3) 0.0781(18) Uani 1 1 d . . .
H23A H 0.0530 0.3233 0.5368 0.094 Uiso 1 1 d R . .
C24 C 0.1090(2) 0.3870(3) 0.5788(3) 0.085(2) Uani 1 1 d . . .
H24A H 0.1293 0.3541 0.6128 0.102 Uiso 1 1 d R . .
C25 C 0.1262(2) 0.4550(3) 0.5760(3) 0.0731(17) Uani 1 1 d . . .
H25A H 0.1577 0.4661 0.6080 0.088 Uiso 1 1 d R . .
C26 C 0.09817(16) 0.5042(3) 0.5268(3) 0.0542(12) Uani 1 1 d . . .
C27 C 0.05011(16) 0.4859(3) 0.4790(3) 0.0529(12) Uani 1 1 d . . .
C28 C -0.0241(3) 0.6967(4) 0.3016(3) 0.093(2) Uani 1 1 d . . .
H28A H -0.0192 0.6618 0.2780 0.112 Uiso 1 1 d R . .
C29 C -0.0624(3) 0.7464(5) 0.2646(4) 0.123(3) Uani 1 1 d . . .
H29A H -0.0825 0.7431 0.2174 0.148 Uiso 1 1 d R . .
C30 C -0.0696(3) 0.7963(6) 0.2979(5) 0.131(4) Uani 1 1 d . . .
H30A H -0.0943 0.8290 0.2737 0.157 Uiso 1 1 d R . .
C31 C -0.0394(3) 0.8017(5) 0.3697(4) 0.103(3) Uani 1 1 d . . .
C32 C -0.0444(3) 0.8514(5) 0.4092(5) 0.127(3) Uani 1 1 d . . .
H32A H -0.0690 0.8847 0.3882 0.153 Uiso 1 1 d R . .
C33 C -0.0137(3) 0.8509(5) 0.4780(4) 0.114(3) Uani 1 1 d . . .
H33A H -0.0169 0.8854 0.5035 0.136 Uiso 1 1 d R . .
C34 C 0.0225(2) 0.7995(4) 0.5115(4) 0.0802(18) Uani 1 1 d . . .
H34A H 0.0426 0.7997 0.5589 0.096 Uiso 1 1 d R . .
C35 C 0.02870(18) 0.7485(3) 0.4758(3) 0.0631(14) Uani 1 1 d . . .
C36 C -0.00228(19) 0.7495(3) 0.4033(3) 0.0674(15) Uani 1 1 d . . .
C51 C 0.0879(2) 0.5379(4) 0.3578(3) 0.0783(17) Uani 1 1 d DU . .
C52A C 0.0785(9) 0.5109(19) 0.2919(8) 0.109(5) Uani 0.50(3) 1 d PDU C 1
H52A H 0.0841 0.5497 0.2703 0.163 Uiso 0.50(3) 1 calc PR C 1
H52B H 0.0465 0.4951 0.2624 0.163 Uiso 0.50(3) 1 calc PR C 1
H52C H 0.0991 0.4709 0.3007 0.163 Uiso 0.50(3) 1 calc PR C 1
C52B C 0.0688(9) 0.4811(14) 0.3019(11) 0.109(5) Uani 0.50(3) 1 d PDU C 2
H52D H 0.0620 0.4370 0.3162 0.163 Uiso 0.50(3) 1 calc PR C 2
H52E H 0.0918 0.4712 0.2927 0.163 Uiso 0.50(3) 1 calc PR C 2
H52F H 0.0407 0.4991 0.2613 0.163 Uiso 0.50(3) 1 calc PR C 2
C102 C 0.1542(2) 0.8652(4) 0.6066(4) 0.0823(18) Uani 1 1 d D A .
C103 C 0.1909(2) 0.8680(4) 0.6735(4) 0.089(2) Uani 1 1 d . . .
H10B H 0.1999 0.9129 0.6956 0.106 Uiso 1 1 d R A .
C104 C 0.2155(2) 0.8059(4) 0.7089(3) 0.086(2) Uani 1 1 d D A .
C107 C 0.1233(2) 0.7065(4) 0.7122(4) 0.0803(18) Uani 1 1 d D . .
C108 C 0.1517(2) 0.6508(5) 0.7552(3) 0.087(2) Uani 1 1 d . B .
H10C H 0.1587 0.6487 0.7989 0.104 Uiso 1 1 d R . .
C109 C 0.1707(2) 0.5995(4) 0.7357(3) 0.0769(18) Uani 1 1 d D . .
C1A C -0.0157(19) 0.0131(13) 0.365(2) 0.56(3) Uiso 0.50 1 d PD D 1
H1AA H 0.0040 0.0132 0.4143 0.835 Uiso 0.50 1 calc PR D 1
H1AB H -0.0352 -0.0296 0.3495 0.835 Uiso 0.50 1 calc PR D 1
H1AC H -0.0352 0.0559 0.3495 0.835 Uiso 0.50 1 calc PR D 1
C2A C 0.0141(12) 0.0131(13) 0.3389(10) 0.56(3) Uiso 0.50 1 d PD D 1
H2AA H 0.0341 0.0559 0.3556 0.668 Uiso 0.50 1 calc PR D 1
H2AB H 0.0341 -0.0296 0.3556 0.668 Uiso 0.50 1 calc PR D 1
C3A C -0.0153(6) 0.0131(13) 0.2628(9) 0.56(3) Uiso 0.50 1 d PD . 1
H3AA H -0.0353 0.0560 0.2459 0.668 Uiso 0.50 1 calc PR . 1
H3AB H -0.0353 -0.0297 0.2459 0.668 Uiso 0.50 1 calc PR . 1
C4A C 0.110(3) 0.176(4) 0.468(2) 0.81(2) Uiso 0.50 1 d PD E 1
H4AA H 0.1058 0.1784 0.5040 0.977 Uiso 0.50 1 calc PR E 1
H4AB H 0.1401 0.1513 0.4857 0.977 Uiso 0.50 1 calc PR E 1
Cl1 Cl 0.1135(14) 0.264(2) 0.4436(18) 0.81(2) Uiso 0.50 1 d PD E 1
Cl2 Cl 0.0650(16) 0.125(2) 0.400(2) 0.81(2) Uiso 0.50 1 d PD E 1
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'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 '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'
Eu Eu -0.1578 3.6682 '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'
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 Eu1 O4 137.00(13) . .
O1 Eu1 O7 114.94(15) . .
O4 Eu1 O7 78.11(14) . .
O1 Eu1 O8 78.68(15) . .
O4 Eu1 O8 140.96(14) . .
O7 Eu1 O8 70.20(15) . .
O1 Eu1 O9 142.85(13) . .
O4 Eu1 O9 77.59(13) . .
O7 Eu1 O9 79.96(16) . .
O8 Eu1 O9 75.00(15) . .
O1 Eu1 O10 78.68(13) . .
O4 Eu1 O10 118.71(13) . .
O7 Eu1 O10 140.02(15) . .
O8 Eu1 O10 76.73(15) . .
O9 Eu1 O10 70.13(15) . .
O1 Eu1 O3 72.69(12) . .
O4 Eu1 O3 71.80(12) . .
O7 Eu1 O3 137.55(13) . .
O8 Eu1 O3 146.94(13) . .
O9 Eu1 O3 120.40(13) . .
O10 Eu1 O3 81.70(13) . .
O1 Eu1 O2 71.03(12) . .
O4 Eu1 O2 71.56(12) . .
O7 Eu1 O2 79.95(14) . .
O8 Eu1 O2 122.50(14) . .
O9 Eu1 O2 145.96(13) . .
O10 Eu1 O2 138.40(14) . .
O3 Eu1 O2 62.67(11) . .
O1 Eu1 Zn1 39.92(9) . .
O4 Eu1 Zn1 97.08(9) . .
O7 Eu1 Zn1 115.38(12) . .
O8 Eu1 Zn1 116.64(11) . .
O9 Eu1 Zn1 162.70(11) . .
O10 Eu1 Zn1 99.08(11) . .
O3 Eu1 Zn1 42.90(8) . .
O2 Eu1 Zn1 40.05(8) . .
O1 Eu1 Zn2 98.02(9) . .
O4 Eu1 Zn2 39.13(9) . .
O7 Eu1 Zn2 98.77(10) . .
O8 Eu1 Zn2 165.15(11) . .
O9 Eu1 Zn2 113.74(10) . .
O10 Eu1 Zn2 117.09(10) . .
O3 Eu1 Zn2 40.07(8) . .
O2 Eu1 Zn2 43.73(8) . .
Zn1 Eu1 Zn2 58.163(16) . .
O6 Zn1 N1 94.0(2) . .
O6 Zn1 N2 94.94(18) . .
N1 Zn1 N2 99.7(2) . .
O6 Zn1 O2 106.85(16) . .
N1 Zn1 O2 159.2(2) . .
N2 Zn1 O2 78.58(17) . .
O6 Zn1 O1 164.40(16) . .
N1 Zn1 O1 78.8(2) . .
N2 Zn1 O1 99.86(15) . .
O2 Zn1 O1 81.07(14) . .
O6 Zn1 O3 90.23(15) . .
N1 Zn1 O3 110.58(18) . .
N2 Zn1 O3 148.86(16) . .
O2 Zn1 O3 70.54(12) . .
O1 Zn1 O3 79.64(13) . .
O6 Zn1 Eu1 132.78(12) . .
N1 Zn1 Eu1 116.91(18) . .
N2 Zn1 Eu1 112.35(13) . .
O2 Zn1 Eu1 47.70(10) . .
O1 Zn1 Eu1 44.20(10) . .
O3 Zn1 Eu1 47.05(9) . .
O5 Zn2 N4 93.94(18) . .
O5 Zn2 N3 93.95(17) . .
N4 Zn2 N3 101.86(18) . .
O5 Zn2 O4 162.81(16) . .
N4 Zn2 O4 79.33(17) . .
N3 Zn2 O4 102.89(15) . .
O5 Zn2 O3 105.24(16) . .
N4 Zn2 O3 160.79(18) . .
N3 Zn2 O3 78.17(14) . .
O4 Zn2 O3 81.94(13) . .
O5 Zn2 O2 89.13(15) . .
N4 Zn2 O2 110.58(16) . .
N3 Zn2 O2 147.12(14) . .
O4 Zn2 O2 78.67(13) . .
O3 Zn2 O2 69.47(12) . .
O5 Zn2 Eu1 131.55(12) . .
N4 Zn2 Eu1 118.30(14) . .
N3 Zn2 Eu1 111.62(11) . .
O4 Zn2 Eu1 44.23(9) . .
O3 Zn2 Eu1 46.69(9) . .
O2 Zn2 Eu1 47.47(9) . .
C1 N1 C9 120.2(6) . .
C1 N1 Zn1 125.8(5) . .
C9 N1 Zn1 113.3(5) . .
C10 N2 C18 118.9(5) . .
C10 N2 Zn1 128.2(4) . .
C18 N2 Zn1 112.9(3) . .
C19 N3 C27 119.0(5) . .
C19 N3 Zn2 126.9(4) . .
C27 N3 Zn2 113.7(3) . .
C28 N4 C36 119.9(5) . .
C28 N4 Zn2 127.1(5) . .
C36 N4 Zn2 112.9(3) . .
C8 O1 Zn1 112.0(4) . .
C8 O1 Eu1 142.8(4) . .
Zn1 O1 Eu1 95.88(12) . .
C17 O2 Zn1 112.8(3) . .
C17 O2 Zn2 126.6(3) . .
Zn1 O2 Zn2 93.35(12) . .
C17 O2 Eu1 132.7(3) . .
Zn1 O2 Eu1 92.25(12) . .
Zn2 O2 Eu1 88.80(12) . .
C26 O3 Zn2 112.0(3) . .
C26 O3 Zn1 121.6(3) . .
Zn2 O3 Zn1 94.31(13) . .
C26 O3 Eu1 135.9(3) . .
Zn2 O3 Eu1 93.24(12) . .
Zn1 O3 Eu1 90.05(11) . .
C35 O4 Zn2 112.5(3) . .
C35 O4 Eu1 140.8(3) . .
Zn2 O4 Eu1 96.63(14) . .
C51 O5 Zn2 127.0(4) . .
C51 O6 Zn1 126.6(4) . .
C102 O7 Eu1 134.7(4) . .
C104 O8 Eu1 135.0(4) . .
C107 O9 Eu1 134.3(4) . .
C109 O10 Eu1 134.1(4) . .
F1B C101 F1 43.4(8) . .
F1B C101 F2 123.0(10) . .
F1 C101 F2 112.9(9) . .
F1B C101 F3B 109.1(10) . .
F1 C101 F3B 127.6(10) . .
F2 C101 F3B 34.7(8) . .
F1B C101 F3 56.9(8) . .
F1 C101 F3 100.1(8) . .
F2 C101 F3 103.7(9) . .
F3B C101 F3 70.3(8) . .
F1B C101 F2B 100.1(10) . .
F1 C101 F2B 59.2(7) . .
F2 C101 F2B 68.1(8) . .
F3B C101 F2B 101.5(10) . .
F3 C101 F2B 147.7(8) . .
F1B C101 C102 120.5(9) . .
F1 C101 C102 114.8(8) . .
F2 C101 C102 116.3(8) . .
F3B C101 C102 117.3(9) . .
F3 C101 C102 106.7(7) . .
F2B C101 C102 104.7(8) . .
F4 C15A F5 108.7(11) . .
F4 C15A F6 106.8(11) . .
F5 C15A F6 104.6(10) . .
F4 C15A C104 109.7(11) . .
F5 C15A C104 115.3(10) . .
F6 C15A C104 111.3(10) . .
F4B C15B F5B 107.0(12) . .
F4B C15B F6B 103.4(11) . .
F5B C15B F6B 105.2(12) . .
F4B C15B C104 118.2(13) . .
F5B C15B C104 107.4(11) . .
F6B C15B C104 114.7(11) . .
F8 C16A F9 105.8(10) . .
F8 C16A F7 106.1(11) . .
F9 C16A F7 105.2(11) . .
F8 C16A C107 112.1(10) . .
F9 C16A C107 113.4(11) . .
F7 C16A C107 113.6(12) . .
F9B C16B F8B 104.0(10) . .
F9B C16B F7B 107.3(11) . .
F8B C16B F7B 105.3(11) . .
F9B C16B C107 116.7(11) . .
F8B C16B C107 113.3(11) . .
F7B C16B C107 109.4(11) . .
F12 C11A F10 104.5(12) . .
F12 C11A F11 106.6(13) . .
F10 C11A F11 105.3(12) . .
F12 C11A C109 116.3(14) . .
F10 C11A C109 118.4(14) . .
F11 C11A C109 104.6(12) . .
F10B C11B F12B 105.7(9) . .
F10B C11B F11B 106.1(10) . .
F12B C11B F11B 107.6(10) . .
F10B C11B C109 110.6(9) . .
F12B C11B C109 114.5(9) . .
F11B C11B C109 111.8(9) . .
N1 C1 C2 121.9(9) . .
N1 C1 H1A 119.8 . .
C2 C1 H1A 118.2 . .
C3 C2 C1 116.7(10) . .
C3 C2 H2A 120.7 . .
C1 C2 H2A 122.6 . .
C2 C3 C4 124.0(9) . .
C2 C3 H3A 118.9 . .
C4 C3 H3A 117.0 . .
C3 C4 C5 126.3(8) . .
C3 C4 C9 114.7(8) . .
C5 C4 C9 118.9(8) . .
C6 C5 C4 119.4(7) . .
C6 C5 H5A 121.5 . .
C4 C5 H5A 119.0 . .
C5 C6 C7 123.4(8) . .
C5 C6 H6A 117.4 . .
C7 C6 H6A 119.2 . .
C8 C7 C6 120.1(8) . .
C8 C7 H7A 120.5 . .
C6 C7 H7A 119.4 . .
O1 C8 C7 124.2(6) . .
O1 C8 C9 117.5(6) . .
C7 C8 C9 118.2(6) . .
N1 C9 C4 122.4(8) . .
N1 C9 C8 117.7(6) . .
C4 C9 C8 119.9(7) . .
N2 C10 C11 123.0(7) . .
N2 C10 H10A 118.6 . .
C11 C10 H10A 118.4 . .
C12 C11 C10 118.4(7) . .
C12 C11 H11A 120.9 . .
C10 C11 H11A 120.6 . .
C11 C12 C13 121.9(6) . .
C11 C12 H12A 118.8 . .
C13 C12 H12A 119.3 . .
C14 C13 C12 124.7(6) . .
C14 C13 C18 119.2(6) . .
C12 C13 C18 116.1(6) . .
C15 C14 C13 120.0(6) . .
C15 C14 H14A 119.9 . .
C13 C14 H14A 120.1 . .
C14 C15 C16 121.3(6) . .
C14 C15 H15A 119.3 . .
C16 C15 H15A 119.5 . .
C17 C16 C15 120.0(6) . .
C17 C16 H16A 120.0 . .
C15 C16 H16A 120.0 . .
O2 C17 C16 123.3(5) . .
O2 C17 C18 117.9(5) . .
C16 C17 C18 118.8(5) . .
N2 C18 C13 121.7(5) . .
N2 C18 C17 117.6(5) . .
C13 C18 C17 120.7(5) . .
N3 C19 C20 121.5(5) . .
N3 C19 H19A 119.2 . .
C20 C19 H19A 119.3 . .
C21 C20 C19 120.7(5) . .
C21 C20 H20A 119.8 . .
C19 C20 H20A 119.5 . .
C20 C21 C22 120.0(6) . .
C20 C21 H21A 120.0 . .
C22 C21 H21A 119.9 . .
C23 C22 C21 124.6(5) . .
C23 C22 C27 118.8(5) . .
C21 C22 C27 116.6(5) . .
C24 C23 C22 120.2(5) . .
C24 C23 H23A 119.8 . .
C22 C23 H23A 119.9 . .
C23 C24 C25 121.3(6) . .
C23 C24 H24A 119.4 . .
C25 C24 H24A 119.4 . .
C26 C25 C24 121.4(5) . .
C26 C25 H25A 119.5 . .
C24 C25 H25A 119.1 . .
C25 C26 O3 124.3(5) . .
C25 C26 C27 118.1(5) . .
O3 C26 C27 117.7(4) . .
N3 C27 C22 122.1(4) . .
N3 C27 C26 117.7(4) . .
C22 C27 C26 120.2(5) . .
N4 C28 C29 121.4(7) . .
N4 C28 H28A 119.2 . .
C29 C28 H28A 119.4 . .
C30 C29 C28 119.7(7) . .
C30 C29 H29A 120.4 . .
C28 C29 H29A 119.8 . .
C29 C30 C31 121.0(7) . .
C29 C30 H30A 119.5 . .
C31 C30 H30A 119.4 . .
C32 C31 C30 125.2(7) . .
C32 C31 C36 118.6(7) . .
C30 C31 C36 116.2(7) . .
C33 C32 C31 120.2(7) . .
C33 C32 H32A 120.1 . .
C31 C32 H32A 119.7 . .
C32 C33 C34 121.7(7) . .
C32 C33 H33A 119.2 . .
C34 C33 H33A 119.2 . .
C35 C34 C33 120.9(7) . .
C35 C34 H34A 119.3 . .
C33 C34 H34A 119.8 . .
O4 C35 C34 124.3(6) . .
O4 C35 C36 117.3(5) . .
C34 C35 C36 118.4(5) . .
N4 C36 C35 118.0(5) . .
N4 C36 C31 121.8(6) . .
C35 C36 C31 120.2(6) . .
O5 C51 O6 123.9(6) . .
O5 C51 C52A 116.7(11) . .
O6 C51 C52A 117.6(11) . .
O5 C51 C52B 120.5(11) . .
O6 C51 C52B 113.6(11) . .
C52A C51 C52B 28.8(11) . .
C51 C52A H52A 109.5 . .
C51 C52A H52B 109.5 . .
H52A C52A H52B 109.5 . .
C51 C52A H52C 109.5 . .
H52A C52A H52C 109.5 . .
H52B C52A H52C 109.5 . .
C51 C52B H52D 109.5 . .
C51 C52B H52E 109.5 . .
H52D C52B H52E 109.5 . .
C51 C52B H52F 109.5 . .
H52D C52B H52F 109.5 . .
H52E C52B H52F 109.5 . .
O7 C102 C103 128.0(7) . .
O7 C102 C101 114.2(6) . .
C103 C102 C101 117.8(7) . .
C102 C103 C104 121.5(6) . .
C102 C103 H10B 119.0 . .
C104 C103 H10B 119.4 . .
O8 C104 C103 127.0(6) . .
O8 C104 C15A 113.4(8) . .
C103 C104 C15A 119.4(8) . .
O8 C104 C15B 111.8(9) . .
C103 C104 C15B 121.0(9) . .
C15A C104 C15B 9.2(9) . .
O9 C107 C108 127.6(7) . .
O9 C107 C16A 114.9(8) . .
C108 C107 C16A 117.5(8) . .
O9 C107 C16B 111.6(8) . .
C108 C107 C16B 120.8(8) . .
C16A C107 C16B 3.6(9) . .
C109 C108 C107 121.9(6) . .
C109 C108 H10C 119.1 . .
C107 C108 H10C 119.0 . .
O10 C109 C108 127.2(6) . .
O10 C109 C11B 114.7(8) . .
C108 C109 C11B 117.8(7) . .
O10 C109 C11A 113.7(10) . .
C108 C109 C11A 119.2(10) . .
C11B C109 C11A 5.3(9) . .
C2A C1A H1AA 109.5 . .
C2A C1A H1AB 109.5 . .
H1AA C1A H1AB 109.5 . .
C2A C1A H1AC 109.5 . .
H1AA C1A H1AC 109.5 . .
H1AB C1A H1AC 109.5 . .
C3A C2A C1A 111.3(16) . .
C3A C2A H2AA 109.4 . .
C1A C2A H2AA 109.4 . .
C3A C2A H2AB 109.4 . .
C1A C2A H2AB 109.4 . .
H2AA C2A H2AB 108.0 . .
C2A C3A C3A 110.5(16) . 2
C2A C3A H3AA 109.6 . .
C3A C3A H3AA 109.6 2 .
C2A C3A H3AB 109.6 . .
C3A C3A H3AB 109.6 2 .
H3AA C3A H3AB 108.1 . .
Cl1 C4A Cl2 112.4(14) . .
Cl1 C4A H4AA 109.1 . .
Cl2 C4A H4AA 109.1 . .
Cl1 C4A H4AB 109.1 . .
Cl2 C4A H4AB 109.1 . .
H4AA C4A H4AB 107.9 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Eu1 O1 2.330(4) .
Eu1 O4 2.344(3) .
Eu1 O7 2.392(4) .
Eu1 O8 2.402(4) .
Eu1 O9 2.407(5) .
Eu1 O10 2.421(4) .
Eu1 O3 2.433(3) .
Eu1 O2 2.460(4) .
Eu1 Zn1 3.3238(8) .
Eu1 Zn2 3.3379(6) .
Zn1 O6 2.025(4) .
Zn1 N1 2.063(5) .
Zn1 N2 2.107(5) .
Zn1 O2 2.140(4) .
Zn1 O1 2.144(4) .
Zn1 O3 2.263(4) .
Zn2 O5 2.044(4) .
Zn2 N4 2.067(4) .
Zn2 N3 2.099(4) .
Zn2 O4 2.121(4) .
Zn2 O3 2.152(3) .
Zn2 O2 2.308(3) .
N1 C1 1.311(10) .
N1 C9 1.350(8) .
N2 C10 1.322(7) .
N2 C18 1.370(7) .
N3 C19 1.316(6) .
N3 C27 1.355(6) .
N4 C28 1.309(8) .
N4 C36 1.358(8) .
O1 C8 1.324(6) .
O2 C17 1.339(6) .
O3 C26 1.356(6) .
O4 C35 1.334(6) .
O5 C51 1.254(7) .
O6 C51 1.270(7) .
O7 C102 1.251(8) .
O8 C104 1.252(8) .
O9 C107 1.252(8) .
O10 C109 1.247(7) .
C101 F1B 1.301(9) .
C101 F1 1.303(8) .
C101 F2 1.327(8) .
C101 F3B 1.344(9) .
C101 F3 1.385(8) .
C101 F2B 1.400(9) .
C101 C102 1.493(7) .
C15A F4 1.334(9) .
C15A F5 1.336(9) .
C15A F6 1.343(9) .
C15A C104 1.500(9) .
C15B F4B 1.337(9) .
C15B F5B 1.340(9) .
C15B F6B 1.343(9) .
C15B C104 1.502(9) .
C16A F8 1.330(9) .
C16A F9 1.332(9) .
C16A F7 1.342(9) .
C16A C107 1.494(9) .
C16B F9B 1.327(9) .
C16B F8B 1.338(9) .
C16B F7B 1.344(9) .
C16B C107 1.497(9) .
C11A F12 1.336(10) .
C11A F10 1.346(10) .
C11A F11 1.346(10) .
C11A C109 1.502(9) .
C11B F10B 1.326(9) .
C11B F12B 1.330(9) .
C11B F11B 1.346(9) .
C11B C109 1.493(9) .
C1 C2 1.439(12) .
C1 H1A 0.9298 .
C2 C3 1.338(14) .
C2 H2A 0.9302 .
C3 C4 1.401(13) .
C3 H3A 0.9302 .
C4 C5 1.418(12) .
C4 C9 1.423(9) .
C5 C6 1.324(12) .
C5 H5A 0.9302 .
C6 C7 1.399(9) .
C6 H6A 0.9298 .
C7 C8 1.380(8) .
C7 H7A 0.9297 .
C8 C9 1.430(9) .
C10 C11 1.391(9) .
C10 H10A 0.9296 .
C11 C12 1.350(10) .
C11 H11A 0.9302 .
C12 C13 1.403(10) .
C12 H12A 0.9306 .
C13 C14 1.403(9) .
C13 C18 1.418(8) .
C14 C15 1.360(10) .
C14 H14A 0.9296 .
C15 C16 1.443(9) .
C15 H15A 0.9299 .
C16 C17 1.364(8) .
C16 H16A 0.9295 .
C17 C18 1.428(8) .
C19 C20 1.411(8) .
C19 H19A 0.9298 .
C20 C21 1.323(9) .
C20 H20A 0.9298 .
C21 C22 1.412(8) .
C21 H21A 0.9299 .
C22 C23 1.393(8) .
C22 C27 1.419(7) .
C23 C24 1.344(8) .
C23 H23A 0.9303 .
C24 C25 1.402(8) .
C24 H24A 0.9300 .
C25 C26 1.355(7) .
C25 H25A 0.9300 .
C26 C27 1.422(6) .
C28 C29 1.426(10) .
C28 H28A 0.9302 .
C29 C30 1.328(12) .
C29 H29A 0.9298 .
C30 C31 1.413(11) .
C30 H30A 0.9297 .
C31 C32 1.395(12) .
C31 C36 1.427(8) .
C32 C33 1.357(11) .
C32 H32A 0.9301 .
C33 C34 1.398(9) .
C33 H33A 0.9300 .
C34 C35 1.366(9) .
C34 H34A 0.9302 .
C35 C36 1.425(8) .
C51 C52A 1.502(9) .
C51 C52B 1.517(9) .
C52A H52A 0.9600 .
C52A H52B 0.9600 .
C52A H52C 0.9600 .
C52B H52D 0.9600 .
C52B H52E 0.9600 .
C52B H52F 0.9600 .
C102 C103 1.362(9) .
C103 C104 1.384(10) .
C103 H10B 0.9299 .
C107 C108 1.383(10) .
C108 C109 1.376(10) .
C108 H10C 0.9293 .
C1A C2A 1.495(10) .
C1A H1AA 0.9600 .
C1A H1AB 0.9600 .
C1A H1AC 0.9600 .
C2A C3A 1.494(10) .
C2A H2AA 0.9700 .
C2A H2AB 0.9700 .
C3A C3A 1.497(10) 2
C3A H3AA 0.9700 .
C3A H3AB 0.9700 .
C4A Cl1 1.738(10) .
C4A Cl2 1.746(10) .
C4A H4AA 0.9700 .
C4A H4AB 0.9700 .
