#------------------------------------------------------------------------------
#$Date: 2016-03-25 10:42:24 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179760 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/56/7005629.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_7005629
loop_
_publ_author_name
'Lipstman, Sophia'
'Muniappan, Sankar'
'George, Sumod'
'Goldberg, Israel'
_publ_section_title
;
 Framework coordination polymers of tetra(4-carboxyphenyl)porphyrin and
 lanthanide ions in crystalline solids.
;
_journal_issue                   30
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              3273
_journal_page_last               3281
_journal_paper_doi               10.1039/b703698a
_journal_year                    2007
_chemical_formula_moiety         'C75 H45 Cu0.26 Eu2 N7 O15'
_chemical_formula_sum            'C75 H45 Cu0.26 Eu2 N7 O15'
_chemical_formula_weight         1604.62
_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                 105.7945(8)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   21.5909(3)
_cell_length_b                   24.0263(4)
_cell_length_c                   31.1146(5)
_cell_measurement_reflns_used    14712
_cell_measurement_temperature    110(2)
_cell_measurement_theta_max      27.28
_cell_measurement_theta_min      1.58
_cell_volume                     15531.3(4)
_computing_cell_refinement       Denzo
_computing_data_collection       'Collect, Nonius B.V.'
_computing_data_reduction        'Denzo & Scalepack'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    SIR-97
_diffrn_ambient_temperature      110(2)
_diffrn_detector_area_resol_mean 12.8
_diffrn_measured_fraction_theta_full 0.988
_diffrn_measured_fraction_theta_max 0.988
_diffrn_measurement_device_type  'Nonius KappaCCD'
_diffrn_measurement_method       '1 deg. φ 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  0.0520
_diffrn_reflns_av_sigmaI/netI    0.0702
_diffrn_reflns_limit_h_max       28
_diffrn_reflns_limit_h_min       0
_diffrn_reflns_limit_k_max       30
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       39
_diffrn_reflns_limit_l_min       -40
_diffrn_reflns_number            52947
_diffrn_reflns_theta_full        27.87
_diffrn_reflns_theta_max         27.87
_diffrn_reflns_theta_min         1.58
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    1.734
_exptl_absorpt_correction_T_max  0.8457
_exptl_absorpt_correction_T_min  0.6243
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Blessing, 1995'
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.372
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             6380
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.10
_refine_diff_density_max         1.918
_refine_diff_density_min         -1.587
_refine_diff_density_rms         0.122
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.003
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     907
_refine_ls_number_reflns         18311
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.003
_refine_ls_R_factor_all          0.0733
_refine_ls_R_factor_gt           0.0461
_refine_ls_shift/su_max          0.008
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0636P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1095
_refine_ls_wR_factor_ref         0.1180
_reflns_number_gt                12582
_reflns_number_total             18311
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b703698a.txt
_cod_data_source_block           Compound-8
_cod_original_sg_symbol_H-M      C2/c
_cod_database_code               7005629
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 0.913776(10) 0.229188(8) 0.198660(6) 0.02304(6) Uani 1 1 d . . .
Eu2 Eu 0.824788(11) 0.309566(8) 0.087268(6) 0.02735(7) Uani 1 1 d . . .
C1 C 0.8243(2) 0.30742(16) 0.53066(13) 0.0281(9) Uani 1 1 d . . .
C2 C 0.8167(2) 0.33557(17) 0.48909(14) 0.0341(10) Uani 1 1 d . . .
H2 H 0.8077 0.3740 0.4835 0.041 Uiso 1 1 calc R . .
C3 C 0.8247(2) 0.29720(17) 0.45935(14) 0.0341(10) Uani 1 1 d . . .
H3 H 0.8232 0.3037 0.4290 0.041 Uiso 1 1 calc R . .
C4 C 0.8359(2) 0.24463(16) 0.48235(13) 0.0263(9) Uani 1 1 d . . .
C5 C 0.8540(2) 0.19467(16) 0.46511(13) 0.0273(9) Uani 1 1 d . . .
C6 C 0.8605(2) 0.14305(17) 0.48629(13) 0.0297(9) Uani 1 1 d . . .
C7 C 0.8764(2) 0.09158(18) 0.46904(14) 0.0379(11) Uani 1 1 d . . .
H7 H 0.8888 0.0868 0.4422 0.046 Uiso 1 1 calc R . .
C8 C 0.8707(3) 0.05100(18) 0.49745(14) 0.0433(12) Uani 1 1 d . . .
H8 H 0.8784 0.0125 0.4944 0.052 Uiso 1 1 calc R . .
C9 C 0.8510(2) 0.07676(17) 0.53335(14) 0.0341(10) Uani 1 1 d . . .
C10 C 0.8357(2) 0.04920(16) 0.56858(13) 0.0310(10) Uani 1 1 d . . .
C11 C 0.8174(2) 0.07494(15) 0.60352(13) 0.0270(9) Uani 1 1 d . . .
C12 C 0.7980(2) 0.04562(18) 0.63812(13) 0.0304(9) Uani 1 1 d . . .
H12 H 0.7926 0.0065 0.6400 0.037 Uiso 1 1 calc R . .
C13 C 0.7889(2) 0.08416(16) 0.66740(13) 0.0302(9) Uani 1 1 d . . .
H13 H 0.7757 0.0773 0.6937 0.036 Uiso 1 1 calc R . .
C14 C 0.80293(19) 0.13783(16) 0.65126(12) 0.0263(9) Uani 1 1 d . . .
C15 C 0.80862(19) 0.18802(16) 0.67522(13) 0.0266(9) Uani 1 1 d . . .
C16 C 0.82617(19) 0.23876(16) 0.65964(13) 0.0257(9) Uani 1 1 d . . .
C17 C 0.8390(2) 0.28915(17) 0.68435(14) 0.0326(10) Uani 1 1 d . . .
H17 H 0.8411 0.2936 0.7151 0.039 Uiso 1 1 calc R . .
C18 C 0.8477(2) 0.32974(18) 0.65630(14) 0.0332(10) Uani 1 1 d . . .
H18 H 0.8585 0.3675 0.6638 0.040 Uiso 1 1 calc R . .
C19 C 0.8376(2) 0.30486(16) 0.61312(14) 0.0285(9) Uani 1 1 d . . .
C20 C 0.8308(2) 0.33331(16) 0.57280(14) 0.0286(9) Uani 1 1 d . . .
N21 N 0.83239(16) 0.25076(13) 0.52513(11) 0.0264(8) Uani 1 1 d . . .
N22 N 0.84687(17) 0.13319(13) 0.52627(11) 0.0302(8) Uani 1 1 d . . .
N23 N 0.81866(16) 0.13067(13) 0.61138(10) 0.0270(8) Uani 1 1 d . . .
N24 N 0.82911(16) 0.24850(13) 0.61722(11) 0.0273(8) Uani 1 1 d . . .
C25 C 0.8711(2) 0.19846(16) 0.42151(12) 0.0257(9) Uani 1 1 d . . .
C26 C 0.8235(2) 0.20171(16) 0.38138(13) 0.0297(9) Uani 1 1 d . . .
H26 H 0.7794 0.1993 0.3810 0.036 Uiso 1 1 calc R . .
C27 C 0.8404(2) 0.20847(17) 0.34187(13) 0.0307(9) Uani 1 1 d . . .
H27 H 0.8077 0.2112 0.3145 0.037 Uiso 1 1 calc R . .
C28 C 0.9044(2) 0.21134(15) 0.34179(12) 0.0238(8) Uani 1 1 d . . .
C29 C 0.9514(2) 0.2053(2) 0.38118(14) 0.0395(11) Uani 1 1 d . . .
H29 H 0.9954 0.2054 0.3814 0.047 Uiso 1 1 calc R . .
C30 C 0.9340(2) 0.1991(2) 0.42118(14) 0.0462(13) Uani 1 1 d . . .
H30 H 0.9667 0.1953 0.4485 0.055 Uiso 1 1 calc R . .
C31 C 0.9216(2) 0.22126(15) 0.29960(13) 0.0270(9) Uani 1 1 d . . .
O32 O 0.87734(15) 0.22344(11) 0.26352(9) 0.0319(7) Uani 1 1 d . . .
O33 O 0.98061(15) 0.22695(11) 0.30058(9) 0.0327(7) Uani 1 1 d . . .
C34 C 0.8385(2) -0.01303(16) 0.57052(13) 0.0319(10) Uani 1 1 d . . .
C35 C 0.8932(2) -0.03965(17) 0.59662(15) 0.0396(11) Uani 1 1 d . . .
H35 H 0.9312 -0.0189 0.6093 0.048 Uiso 1 1 calc R . .
C36 C 0.8920(2) -0.09618(16) 0.60401(14) 0.0340(10) Uani 1 1 d . . .
H36 H 0.9290 -0.1139 0.6226 0.041 Uiso 1 1 calc R . .
C37 C 0.8376(2) -0.12744(17) 0.58469(12) 0.0285(10) Uani 1 1 d . . .
C38 C 0.7835(2) -0.10111(16) 0.55687(13) 0.0336(10) Uani 1 1 d . . .
H38 H 0.7464 -0.1223 0.5428 0.040 Uiso 1 1 calc R . .
C39 C 0.7842(2) -0.04469(17) 0.54988(13) 0.0373(11) Uani 1 1 d . . .
H39 H 0.7474 -0.0270 0.5309 0.045 Uiso 1 1 calc R . .
C40 C 0.8347(2) -0.18791(17) 0.59256(13) 0.0319(10) Uani 1 1 d . . .
O41 O 0.78593(16) -0.21484(12) 0.57285(10) 0.0379(7) Uani 1 1 d . . .
O42 O 0.88297(15) -0.21147(11) 0.61986(9) 0.0320(7) Uani 1 1 d . . .
C43 C 0.7897(2) 0.18675(15) 0.71798(13) 0.0256(9) Uani 1 1 d . . .
C44 C 0.7263(2) 0.17523(16) 0.71755(13) 0.0264(9) Uani 1 1 d . . .
H44 H 0.6959 0.1661 0.6901 0.032 Uiso 1 1 calc R . .
C45 C 0.7069(2) 0.17694(16) 0.75646(12) 0.0256(9) Uani 1 1 d . . .
H45 H 0.6635 0.1692 0.7557 0.031 Uiso 1 1 calc R . .
C46 C 0.7512(2) 0.19002(16) 0.79656(12) 0.0258(9) Uani 1 1 d . . .
C47 C 0.8150(2) 0.19834(18) 0.79797(14) 0.0324(10) Uani 1 1 d . . .
H47 H 0.8457 0.2048 0.8258 0.039 Uiso 1 1 calc R . .
C48 C 0.8351(2) 0.19726(17) 0.75854(14) 0.0336(10) Uani 1 1 d . . .
H48 H 0.8789 0.2036 0.7596 0.040 Uiso 1 1 calc R . .
C49 C 0.7295(2) 0.19682(15) 0.83813(13) 0.0247(9) Uani 1 1 d . . .
O50 O 0.66933(13) 0.20530(10) 0.83369(8) 0.0229(6) Uani 1 1 d . . .
O51 O 0.76844(14) 0.19433(11) 0.87614(9) 0.0301(6) Uani 1 1 d . . .
C52 C 0.8310(2) 0.39537(17) 0.57436(14) 0.0334(10) Uani 1 1 d . . .
C53 C 0.8768(2) 0.42612(18) 0.55984(15) 0.0413(11) Uani 1 1 d . . .
H53 H 0.9075 0.4073 0.5483 0.050 Uiso 1 1 calc R . .
C54 C 0.8776(3) 0.48342(19) 0.56227(17) 0.0515(14) Uani 1 1 d . . .
H54 H 0.9086 0.5040 0.5523 0.062 Uiso 1 1 calc R . .
C55 C 0.8326(3) 0.51134(19) 0.57935(16) 0.0472(13) Uani 1 1 d . . .
C56 C 0.7872(3) 0.48084(18) 0.59355(18) 0.0511(14) Uani 1 1 d . . .
H56 H 0.7565 0.4995 0.6051 0.061 Uiso 1 1 calc R . .
C57 C 0.7866(2) 0.42312(17) 0.59086(16) 0.0417(12) Uani 1 1 d . . .
H57 H 0.7552 0.4026 0.6005 0.050 Uiso 1 1 calc R . .
C58 C 0.8319(3) 0.57345(19) 0.58190(18) 0.0566(16) Uani 1 1 d . . .
O59 O 0.8067(2) 0.59678(13) 0.60965(13) 0.0727(13) Uani 1 1 d . . .
O60 O 0.8555(2) 0.60282(13) 0.55580(13) 0.0722(13) Uani 1 1 d . . .
Cu1 Cu 0.8317(2) 0.19023(16) 0.56940(14) 0.0374(10) Uani 0.13 1 d P . .
C61 C 1.0000 0.8733(2) 0.2500 0.0264(13) Uani 1 2 d S . .
C62 C 1.00199(19) 0.84578(15) 0.21024(13) 0.0253(9) Uani 1 1 d . . .
C63 C 1.0081(2) 0.87259(17) 0.17059(15) 0.0362(11) Uani 1 1 d . . .
H63 H 1.0075 0.9116 0.1654 0.043 Uiso 1 1 calc R . .
C64 C 1.0150(2) 0.83232(17) 0.14176(14) 0.0341(10) Uani 1 1 d . . .
H64 H 1.0205 0.8379 0.1128 0.041 Uiso 1 1 calc R . .
C65 C 1.0125(2) 0.77982(16) 0.16287(13) 0.0280(9) Uani 1 1 d . . .
C66 C 1.02096(19) 0.72818(16) 0.14455(13) 0.0266(9) Uani 1 1 d . . .
C67 C 1.0165(2) 0.67601(16) 0.16418(12) 0.0259(9) Uani 1 1 d . . .
C68 C 1.0195(2) 0.62308(16) 0.14278(13) 0.0293(9) Uani 1 1 d . . .
H68 H 1.0251 0.6173 0.1139 0.035 Uiso 1 1 calc R . .
C69 C 1.0126(2) 0.58314(16) 0.17208(13) 0.0317(10) Uani 1 1 d . . .
H69 H 1.0121 0.5441 0.1671 0.038 Uiso 1 1 calc R . .
C70 C 1.00614(19) 0.60993(15) 0.21147(13) 0.0255(9) Uani 1 1 d . . .
C71 C 1.0000 0.5834(2) 0.2500 0.0261(12) Uani 1 2 d S . .
N72 N 1.00355(16) 0.78881(13) 0.20461(11) 0.0251(7) Uani 1 1 d . . .
N73 N 1.00862(15) 0.66706(13) 0.20602(10) 0.0239(7) Uani 1 1 d . . .
C74 C 1.0000 0.9350(2) 0.2500 0.0260(12) Uani 1 2 d S . .
C75 C 0.9497(2) 0.96544(17) 0.22201(15) 0.0347(10) Uani 1 1 d . . .
H75 H 0.9147 0.9462 0.2026 0.042 Uiso 1 1 calc R . .
C76 C 0.9500(2) 1.02291(16) 0.22198(14) 0.0330(10) Uani 1 1 d . . .
H76 H 0.9154 1.0425 0.2024 0.040 Uiso 1 1 calc R . .
C77 C 1.0000 1.0522(2) 0.2500 0.0284(13) Uani 1 2 d S . .
C78 C 1.0000 1.1153(2) 0.2500 0.0308(13) Uani 1 2 d S . .
O79 O 1.04841(14) 1.13924(11) 0.27498(9) 0.0334(7) Uani 1 1 d . . .
C80 C 1.0366(2) 0.72670(15) 0.10056(13) 0.0275(9) Uani 1 1 d . . .
C81 C 1.0988(2) 0.7236(2) 0.09793(17) 0.0495(13) Uani 1 1 d . . .
H81 H 1.1326 0.7249 0.1249 0.059 Uiso 1 1 calc R . .
C82 C 1.1145(3) 0.7189(2) 0.05848(19) 0.0523(15) Uani 1 1 d . . .
H82 H 1.1583 0.7171 0.0581 0.063 Uiso 1 1 calc R . .
C83 C 1.0660(3) 0.7167(2) 0.01915(17) 0.0495(14) Uani 1 1 d . . .
C84 C 1.0044(3) 0.7197(3) 0.02129(17) 0.088(2) Uani 1 1 d . . .
H84 H 0.9704 0.7176 -0.0055 0.106 Uiso 1 1 calc R . .
C85 C 0.9902(3) 0.7257(3) 0.06140(17) 0.077(2) Uani 1 1 d . . .
H85 H 0.9465 0.7293 0.0616 0.093 Uiso 1 1 calc R . .
C86 C 1.0796(4) 0.7103(2) -0.0271(2) 0.073(2) Uani 1 1 d . . .
O87 O 1.0334(3) 0.6959(3) -0.05900(16) 0.149(3) Uani 1 1 d . . .
O88 O 1.1329(3) 0.71874(14) -0.02955(15) 0.0798(16) Uani 1 1 d . . .
C89 C 1.0000 0.5211(2) 0.2500 0.0252(12) Uani 1 2 d S . .
C90 C 0.9472(2) 0.49174(16) 0.22455(13) 0.0305(9) Uani 1 1 d . . .
H90 H 0.9109 0.5114 0.2070 0.037 Uiso 1 1 calc R . .
C91 C 0.9472(2) 0.43344(16) 0.22463(14) 0.0301(9) Uani 1 1 d . . .
H91 H 0.9108 0.4138 0.2072 0.036 Uiso 1 1 calc R . .
C92 C 1.0000 0.4042(2) 0.2500 0.0220(12) Uani 1 2 d S . .
C93 C 1.0000 0.3421(2) 0.2500 0.0234(12) Uani 1 2 d S . .
O94 O 0.95009(14) 0.31737(11) 0.22745(9) 0.0300(6) Uiso 1 1 d . . .
Cu2 Cu 0.5000 0.2268(3) 0.2500 0.141(3) Uani 0.26 2 d SP . .
O95 O 0.81429(14) 0.17436(11) 0.18012(9) 0.0296(6) Uani 1 1 d . . .
C96 C 0.7777(3) 0.1604(2) 0.20284(16) 0.0568(15) Uani 1 1 d . . .
H96 H 0.7885 0.1728 0.2330 0.068 Uiso 1 1 calc R . .
N97 N 0.7260(2) 0.13061(18) 0.18934(14) 0.0576(12) Uani 1 1 d . . .
C98 C 0.7057(3) 0.1092(3) 0.14534(18) 0.0739(19) Uani 1 1 d . . .
H98A H 0.7191 0.1345 0.1249 0.111 Uiso 1 1 calc R . .
H98B H 0.6587 0.1057 0.1363 0.111 Uiso 1 1 calc R . .
H98C H 0.7252 0.0725 0.1444 0.111 Uiso 1 1 calc R . .
C99 C 0.6836(3) 0.1184(3) 0.2187(2) 0.088(2) Uani 1 1 d . . .
H99A H 0.6775 0.0780 0.2199 0.132 Uiso 1 1 calc R . .
H99B H 0.6418 0.1364 0.2065 0.132 Uiso 1 1 calc R . .
H99C H 0.7036 0.1325 0.2488 0.132 Uiso 1 1 calc R . .
O100A O 0.7310(3) 0.3372(4) 0.0361(3) 0.040(3) Uiso 0.438(13) 1 d P . .
O100B O 0.7292(3) 0.3051(3) 0.0221(2) 0.047(2) Uiso 0.562(13) 1 d P . .
O101 O 0.93397(19) 0.3212(2) 0.13332(12) 0.0948(17) Uani 1 1 d . . .
H10A H 0.9424 0.3585 0.1473 0.114 Uiso 1 1 calc R . .
H10B H 0.9669 0.3115 0.1178 0.114 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'
Eu Eu -0.1578 3.6682 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cu Cu 0.3201 1.2651 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
O33 Eu1 O94 77.76(10) 2_755 . ?
O33 Eu1 O32 123.78(10) 2_755 . ?
O94 Eu1 O32 83.17(9) . . ?
O33 Eu1 O79 74.07(10) 2_755 2_745 ?
O94 Eu1 O79 129.85(10) . 2_745 ?
O32 Eu1 O79 79.33(10) . 2_745 ?
O33 Eu1 O50 130.89(9) 2_755 7_656 ?
O94 Eu1 O50 72.64(9) . 7_656 ?
O32 Eu1 O50 90.69(9) . 7_656 ?
O79 Eu1 O50 153.04(9) 2_745 7_656 ?
O33 Eu1 O42 90.27(10) 2_755 6 ?
O94 Eu1 O42 121.39(9) . 6 ?
O32 Eu1 O42 143.09(10) . 6 ?
O79 Eu1 O42 99.50(9) 2_745 6 ?
O50 Eu1 O42 73.68(9) 7_656 6 ?
O33 Eu1 O95 143.28(9) 2_755 . ?
O94 Eu1 O95 138.96(9) . . ?
O32 Eu1 O95 72.26(9) . . ?
O79 Eu1 O95 77.83(9) 2_745 . ?
O50 Eu1 O95 75.28(9) 7_656 . ?
O42 Eu1 O95 71.49(9) 6 . ?
O33 Eu1 O33 78.65(8) 2_755 . ?
O94 Eu1 O33 67.20(8) . . ?
O32 Eu1 O33 45.31(9) . . ?
O79 Eu1 O33 67.13(8) 2_745 . ?
O50 Eu1 O33 121.84(8) 7_656 . ?
O42 Eu1 O33 164.45(9) 6 . ?
O95 Eu1 O33 111.40(8) . . ?
O33 Eu1 C31 102.12(11) 2_755 . ?
O94 Eu1 C31 75.47(9) . . ?
O32 Eu1 C31 21.68(11) . . ?
O79 Eu1 C31 71.10(10) 2_745 . ?
O50 Eu1 C31 107.09(9) 7_656 . ?
O42 Eu1 C31 161.29(10) 6 . ?
O95 Eu1 C31 90.45(10) . . ?
O33 Eu1 C31 23.68(9) . . ?
O33 Eu1 O101 72.87(10) 2_755 . ?
O94 Eu1 O101 61.13(10) . . ?
O32 Eu1 O101 137.57(11) . . ?
O79 Eu1 O101 140.83(11) 2_745 . ?
O50 Eu1 O101 58.70(10) 7_656 . ?
O42 Eu1 O101 60.49(10) 6 . ?
O95 Eu1 O101 119.83(9) . . ?
O33 Eu1 O101 124.76(9) . . ?
C31 Eu1 O101 136.50(10) . . ?
O33 Eu1 Eu2 105.41(7) 2_755 . ?
O94 Eu1 Eu2 85.77(7) . . ?
O32 Eu1 Eu2 125.39(7) . . ?
O79 Eu1 Eu2 141.43(7) 2_745 . ?
O50 Eu1 Eu2 35.39(6) 7_656 . ?
O42 Eu1 Eu2 42.36(7) 6 . ?
O95 Eu1 Eu2 82.60(6) . . ?
O33 Eu1 Eu2 151.43(5) . . ?
C31 Eu1 Eu2 142.35(7) . . ?
O101 Eu1 Eu2 37.46(7) . . ?
O33 Eu1 Eu1 46.57(7) 2_755 2_755 ?
O94 Eu1 Eu1 64.84(7) . 2_755 ?
O32 Eu1 Eu1 77.42(7) . 2_755 ?
O79 Eu1 Eu1 65.59(7) 2_745 2_755 ?
O50 Eu1 Eu1 136.79(6) 7_656 2_755 ?
O42 Eu1 Eu1 136.10(7) 6 2_755 ?
O95 Eu1 Eu1 135.94(6) . 2_755 ?
O33 Eu1 Eu1 32.12(5) . 2_755 ?
C31 Eu1 Eu1 55.75(8) . 2_755 ?
O101 Eu1 Eu1 104.14(7) . 2_755 ?
Eu2 Eu1 Eu1 141.452(6) . 2_755 ?
O100A Eu2 O88 90.4(2) . 5_765 ?
O100A Eu2 O59 75.5(3) . 6_565 ?
O88 Eu2 O59 128.47(11) 5_765 6_565 ?
O100A Eu2 O101 155.0(2) . . ?
O88 Eu2 O101 88.09(17) 5_765 . ?
O59 Eu2 O101 85.96(17) 6_565 . ?
O100A Eu2 O41 87.0(2) . 6 ?
O88 Eu2 O41 76.81(12) 5_765 6 ?
O59 Eu2 O41 148.39(12) 6_565 6 ?
O101 Eu2 O41 116.79(16) . 6 ?
O100A Eu2 O50 121.97(19) . 7_656 ?
O88 Eu2 O50 143.77(13) 5_765 7_656 ?
O59 Eu2 O50 79.36(10) 6_565 7_656 ?
O101 Eu2 O50 69.32(11) . 7_656 ?
O41 Eu2 O50 88.27(9) 6 7_656 ?
O88 Eu2 O100B 76.7(2) 5_765 . ?
O59 Eu2 O100B 96.5(2) 6_565 . ?
O101 Eu2 O100B 162.35(16) . . ?
O41 Eu2 O100B 68.74(19) 6 . ?
O50 Eu2 O100B 128.32(15) 7_656 . ?
O100A Eu2 O60 76.2(2) . 6_565 ?
O88 Eu2 O60 74.98(11) 5_765 6_565 ?
O59 Eu2 O60 53.62(10) 6_565 6_565 ?
O101 Eu2 O60 79.28(17) . 6_565 ?
O41 Eu2 O60 146.89(11) 6 6_565 ?
O50 Eu2 O60 124.84(11) 7_656 6_565 ?
O100B Eu2 O60 88.08(19) . 6_565 ?
O100A Eu2 O51 70.71(18) . 7_656 ?
O88 Eu2 O51 148.29(15) 5_765 7_656 ?
O59 Eu2 O51 72.48(10) 6_565 7_656 ?
O101 Eu2 O51 119.76(10) . 7_656 ?
O41 Eu2 O51 76.97(9) 6 7_656 ?
O50 Eu2 O51 51.97(9) 7_656 7_656 ?
O100B Eu2 O51 77.41(15) . 7_656 ?
O60 Eu2 O51 122.01(10) 6_565 7_656 ?
O100A Eu2 O42 137.2(2) . 6 ?
O88 Eu2 O42 78.27(11) 5_765 6 ?
O59 Eu2 O42 142.15(12) 6_565 6 ?
O101 Eu2 O42 66.71(15) . 6 ?
O41 Eu2 O42 50.22(10) 6 6 ?
O50 Eu2 O42 67.01(8) 7_656 6 ?
O100B Eu2 O42 117.63(19) . 6 ?
O60 Eu2 O42 137.00(11) 6_565 6 ?
O51 Eu2 O42 98.09(8) 7_656 6 ?
O100A Eu2 C58 74.0(3) . 6_565 ?
O88 Eu2 C58 101.90(13) 5_765 6_565 ?
O59 Eu2 C58 26.63(11) 6_565 6_565 ?
O101 Eu2 C58 81.94(19) . 6_565 ?
O41 Eu2 C58 160.98(15) 6 6_565 ?
O50 Eu2 C58 102.44(12) 7_656 6_565 ?
O100B Eu2 C58 92.4(2) . 6_565 ?
O60 Eu2 C58 26.99(11) 6_565 6_565 ?
O51 Eu2 C58 97.14(12) 7_656 6_565 ?
O42 Eu2 C58 148.64(15) 6 6_565 ?
O100A Eu2 C49 95.6(2) . 7_656 ?
O88 Eu2 C49 159.95(11) 5_765 7_656 ?
O59 Eu2 C49 71.58(10) 6_565 7_656 ?
O101 Eu2 C49 94.22(12) . 7_656 ?
O41 Eu2 C49 84.42(10) 6 7_656 ?
O50 Eu2 C49 26.41(10) 7_656 7_656 ?
O100B Eu2 C49 103.15(16) . 7_656 ?
O60 Eu2 C49 125.03(10) 6_565 7_656 ?
O51 Eu2 C49 25.83(10) 7_656 7_656 ?
O42 Eu2 C49 84.35(9) 6 7_656 ?
C58 Eu2 C49 98.15(12) 6_565 7_656 ?
N21 C1 C20 123.9(4) . . ?
N21 C1 C2 109.8(3) . . ?
C20 C1 C2 125.8(4) . . ?
C3 C2 C1 107.0(4) . . ?
C3 C2 H2 126.5 . . ?
C1 C2 H2 126.5 . . ?
C2 C3 C4 107.1(4) . . ?
C2 C3 H3 126.5 . . ?
C4 C3 H3 126.5 . . ?
N21 C4 C5 123.9(3) . . ?
N21 C4 C3 110.2(3) . . ?
C5 C4 C3 125.7(3) . . ?
C6 C5 C4 125.4(3) . . ?
C6 C5 C25 117.6(3) . . ?
C4 C5 C25 116.9(3) . . ?
N22 C6 C5 124.2(3) . . ?
N22 C6 C7 108.9(3) . . ?
C5 C6 C7 126.7(3) . . ?
C8 C7 C6 107.9(3) . . ?
C8 C7 H7 126.1 . . ?
C6 C7 H7 126.1 . . ?
C7 C8 C9 107.3(4) . . ?
C7 C8 H8 126.3 . . ?
C9 C8 H8 126.3 . . ?
N22 C9 C10 125.2(3) . . ?
N22 C9 C8 108.7(3) . . ?
C10 C9 C8 126.1(4) . . ?
C11 C10 C9 125.3(4) . . ?
C11 C10 C34 115.3(3) . . ?
C9 C10 C34 119.3(3) . . ?
N23 C11 C10 125.5(4) . . ?
N23 C11 C12 110.0(3) . . ?
C10 C11 C12 124.5(4) . . ?
C13 C12 C11 107.1(4) . . ?
C13 C12 H12 126.4 . . ?
C11 C12 H12 126.4 . . ?
C12 C13 C14 107.1(3) . . ?
C12 C13 H13 126.4 . . ?
C14 C13 H13 126.4 . . ?
N23 C14 C15 125.1(3) . . ?
N23 C14 C13 109.1(3) . . ?
C15 C14 C13 125.3(3) . . ?
C16 C15 C14 123.8(3) . . ?
C16 C15 C43 119.4(3) . . ?
C14 C15 C43 116.7(3) . . ?
N24 C16 C15 125.0(3) . . ?
N24 C16 C17 109.0(3) . . ?
C15 C16 C17 125.8(3) . . ?
C18 C17 C16 107.8(4) . . ?
C18 C17 H17 126.1 . . ?
C16 C17 H17 126.1 . . ?
C17 C18 C19 106.9(4) . . ?
C17 C18 H18 126.5 . . ?
C19 C18 H18 126.5 . . ?
N24 C19 C20 125.4(4) . . ?
N24 C19 C18 108.3(3) . . ?
C20 C19 C18 126.0(4) . . ?
C19 C20 C1 124.9(4) . . ?
C19 C20 C52 117.4(3) . . ?
C1 C20 C52 117.7(3) . . ?
C4 N21 C1 105.6(3) . . ?
C4 N21 Cu1 127.3(3) . . ?
C1 N21 Cu1 126.9(3) . . ?
C9 N22 C6 107.2(3) . . ?
C9 N22 Cu1 125.6(3) . . ?
C6 N22 Cu1 127.0(3) . . ?
C11 N23 C14 106.6(3) . . ?
C11 N23 Cu1 125.7(3) . . ?
C14 N23 Cu1 127.4(3) . . ?
C16 N24 C19 107.6(3) . . ?
C16 N24 Cu1 127.1(3) . . ?
C19 N24 Cu1 124.9(3) . . ?
C30 C25 C26 119.3(4) . . ?
C30 C25 C5 119.9(4) . . ?
C26 C25 C5 120.8(4) . . ?
C27 C26 C25 119.7(4) . . ?
C27 C26 H26 120.1 . . ?
C25 C26 H26 120.1 . . ?
C28 C27 C26 120.8(4) . . ?
C28 C27 H27 119.6 . . ?
C26 C27 H27 119.6 . . ?
C29 C28 C27 119.3(4) . . ?
C29 C28 C31 120.6(4) . . ?
C27 C28 C31 120.1(4) . . ?
C28 C29 C30 119.6(4) . . ?
C28 C29 H29 120.2 . . ?
C30 C29 H29 120.2 . . ?
C25 C30 C29 121.1(4) . . ?
C25 C30 H30 119.5 . . ?
C29 C30 H30 119.5 . . ?
O32 C31 O33 121.8(3) . . ?
O32 C31 C28 119.0(4) . . ?
O33 C31 C28 119.2(4) . . ?
O32 C31 Eu1 43.76(18) . . ?
O33 C31 Eu1 78.2(2) . . ?
C28 C31 Eu1 162.0(3) . . ?
C31 O32 Eu1 114.6(3) . . ?
C31 O33 Eu1 175.1(2) . 2_755 ?
C31 O33 Eu1 78.1(2) . . ?
Eu1 O33 Eu1 101.30(8) 2_755 . ?
C39 C34 C35 119.3(4) . . ?
C39 C34 C10 120.3(4) . . ?
C35 C34 C10 120.0(4) . . ?
C36 C35 C34 119.9(4) . . ?
C36 C35 H35 120.1 . . ?
C34 C35 H35 120.1 . . ?
C35 C36 C37 120.9(4) . . ?
C35 C36 H36 119.6 . . ?
C37 C36 H36 119.6 . . ?
C36 C37 C38 119.2(4) . . ?
C36 C37 C40 122.0(4) . . ?
C38 C37 C40 118.7(4) . . ?
C39 C38 C37 120.1(4) . . ?
C39 C38 H38 120.0 . . ?
C37 C38 H38 120.0 . . ?
C38 C39 C34 120.5(4) . . ?
C38 C39 H39 119.8 . . ?
C34 C39 H39 119.8 . . ?
O41 C40 O42 121.5(4) . . ?
O41 C40 C37 119.8(4) . . ?
O42 C40 C37 118.7(4) . . ?
O41 C40 Eu2 54.2(2) . 6_556 ?
O42 C40 Eu2 68.3(2) . 6_556 ?
C37 C40 Eu2 167.6(3) . 6_556 ?
C40 O41 Eu2 101.1(3) . 6_556 ?
C40 O42 Eu1 134.8(2) . 6_556 ?
C40 O42 Eu2 85.8(2) . 6_556 ?
Eu1 O42 Eu2 101.42(9) 6_556 6_556 ?
C44 C43 C48 119.4(3) . . ?
C44 C43 C15 120.1(4) . . ?
C48 C43 C15 120.5(4) . . ?
C45 C44 C43 121.0(4) . . ?
C45 C44 H44 119.5 . . ?
C43 C44 H44 119.5 . . ?
C44 C45 C46 119.7(4) . . ?
C44 C45 H45 120.2 . . ?
C46 C45 H45 120.2 . . ?
C47 C46 C45 119.9(3) . . ?
C47 C46 C49 120.0(4) . . ?
C45 C46 C49 120.0(4) . . ?
C46 C47 C48 120.7(4) . . ?
C46 C47 H47 119.6 . . ?
C48 C47 H47 119.6 . . ?
C43 C48 C47 119.0(4) . . ?
C43 C48 H48 120.5 . . ?
C47 C48 H48 120.5 . . ?
O51 C49 O50 120.6(3) . . ?
O51 C49 C46 121.5(4) . . ?
O50 C49 C46 117.9(3) . . ?
O51 C49 Eu2 63.4(2) . 7_656 ?
O50 C49 Eu2 58.19(18) . 7_656 ?
C46 C49 Eu2 169.2(3) . 7_656 ?
C49 O50 Eu1 140.4(2) . 7_656 ?
C49 O50 Eu2 95.4(2) . 7_656 ?
Eu1 O50 Eu2 110.22(9) 7_656 7_656 ?
C49 O51 Eu2 90.8(2) . 7_656 ?
C57 C52 C53 119.3(4) . . ?
C57 C52 C20 120.0(4) . . ?
C53 C52 C20 120.8(4) . . ?
C54 C53 C52 120.4(4) . . ?
C54 C53 H53 119.8 . . ?
C52 C53 H53 119.8 . . ?
C53 C54 C55 120.1(4) . . ?
C53 C54 H54 120.0 . . ?
C55 C54 H54 120.0 . . ?
C56 C55 C54 119.4(4) . . ?
C56 C55 C58 119.4(4) . . ?
C54 C55 C58 121.2(4) . . ?
C57 C56 C55 120.3(4) . . ?
C57 C56 H56 119.9 . . ?
C55 C56 H56 119.9 . . ?
C52 C57 C56 120.6(4) . . ?
C52 C57 H57 119.7 . . ?
C56 C57 H57 119.7 . . ?
O59 C58 O60 120.4(4) . . ?
O59 C58 C55 119.3(4) . . ?
O60 C58 C55 120.3(4) . . ?
O59 C58 Eu2 58.7(2) . 6_566 ?
O60 C58 Eu2 61.7(2) . 6_566 ?
C55 C58 Eu2 177.4(4) . 6_566 ?
C58 O59 Eu2 94.7(3) . 6_566 ?
C58 O60 Eu2 91.3(3) . 6_566 ?
N21 Cu1 N22 90.2(2) . . ?
N21 Cu1 N23 172.6(3) . . ?
N22 Cu1 N23 91.5(2) . . ?
N21 Cu1 N24 90.6(2) . . ?
N22 Cu1 N24 172.4(3) . . ?
N23 Cu1 N24 88.7(2) . . ?
C62 C61 C62 124.2(5) 2_755 . ?
C62 C61 C74 117.9(2) 2_755 . ?
C62 C61 C74 117.9(2) . . ?
N72 C62 C61 125.6(4) . . ?
N72 C62 C63 109.0(3) . . ?
C61 C62 C63 125.2(4) . . ?
C64 C63 C62 107.6(4) . . ?
C64 C63 H63 126.2 . . ?
C62 C63 H63 126.2 . . ?
C63 C64 C65 107.5(4) . . ?
C63 C64 H64 126.2 . . ?
C65 C64 H64 126.2 . . ?
N72 C65 C66 126.1(3) . . ?
N72 C65 C64 109.1(3) . . ?
C66 C65 C64 124.8(4) . . ?
C65 C66 C67 125.5(3) . . ?
C65 C66 C80 118.7(3) . . ?
C67 C66 C80 115.7(3) . . ?
N73 C67 C66 126.2(3) . . ?
N73 C67 C68 109.3(3) . . ?
C66 C67 C68 124.5(3) . . ?
C69 C68 C67 106.6(3) . . ?
C69 C68 H68 126.7 . . ?
C67 C68 H68 126.7 . . ?
C68 C69 C70 108.2(3) . . ?
C68 C69 H69 125.9 . . ?
C70 C69 H69 125.9 . . ?
N73 C70 C71 124.9(4) . . ?
N73 C70 C69 109.1(3) . . ?
C71 C70 C69 126.0(4) . . ?
C70 C71 C70 125.7(5) . 2_755 ?
C70 C71 C89 117.1(2) . . ?
C70 C71 C89 117.1(2) 2_755 . ?
C65 N72 C62 106.8(3) . . ?
C65 N72 Cu2 124.8(3) . 3 ?
C62 N72 Cu2 128.3(3) . 3 ?
C67 N73 C70 106.8(3) . . ?
C67 N73 Cu2 125.9(3) . 3 ?
C70 N73 Cu2 127.3(3) . 3 ?
C75 C74 C75 117.0(5) 2_755 . ?
C75 C74 C61 121.5(3) 2_755 . ?
C75 C74 C61 121.5(3) . . ?
C76 C75 C74 121.3(4) . . ?
C76 C75 H75 119.3 . . ?
C74 C75 H75 119.3 . . ?
C77 C76 C75 120.8(4) . . ?
C77 C76 H76 119.6 . . ?
C75 C76 H76 119.6 . . ?
C76 C77 C76 118.7(5) . 2_755 ?
C76 C77 C78 120.7(3) . . ?
C76 C77 C78 120.7(3) 2_755 . ?
O79 C78 O79 125.7(5) . 2_755 ?
O79 C78 C77 117.2(3) . . ?
O79 C78 C77 117.2(3) 2_755 . ?
C78 O79 Eu1 141.1(3) . 2_765 ?
C85 C80 C81 116.3(4) . . ?
C85 C80 C66 121.9(4) . . ?
C81 C80 C66 121.7(4) . . ?
C80 C81 C82 123.1(5) . . ?
C80 C81 H81 118.4 . . ?
C82 C81 H81 118.4 . . ?
C81 C82 C83 119.2(5) . . ?
C81 C82 H82 120.4 . . ?
C83 C82 H82 120.4 . . ?
C84 C83 C82 118.3(4) . . ?
C84 C83 C86 119.2(6) . . ?
C82 C83 C86 122.5(6) . . ?
C83 C84 C85 121.1(6) . . ?
C83 C84 H84 119.4 . . ?
C85 C84 H84 119.4 . . ?
C80 C85 C84 121.9(5) . . ?
C80 C85 H85 119.0 . . ?
C84 C85 H85 119.0 . . ?
O88 C86 O87 124.9(6) . . ?
O88 C86 C83 118.2(8) . . ?
O87 C86 C83 116.9(7) . . ?
O88 C86 Eu2 36.3(3) . 5_765 ?
O87 C86 Eu2 89.8(4) . 5_765 ?
C83 C86 Eu2 151.4(5) . 5_765 ?
C86 O88 Eu2 126.1(5) . 5_765 ?
C90 C89 C90 119.0(5) 2_755 . ?
C90 C89 C71 120.5(2) 2_755 . ?
C90 C89 C71 120.5(2) . . ?
C89 C90 C91 120.5(4) . . ?
C89 C90 H90 119.8 . . ?
C91 C90 H90 119.8 . . ?
C92 C91 C90 120.4(4) . . ?
C92 C91 H91 119.8 . . ?
C90 C91 H91 119.8 . . ?
C91 C92 C91 119.2(5) 2_755 . ?
C91 C92 C93 120.4(2) 2_755 . ?
C91 C92 C93 120.4(2) . . ?
O94 C93 O94 123.9(5) 2_755 . ?
O94 C93 C92 118.1(2) 2_755 . ?
O94 C93 C92 118.1(2) . . ?
C93 O94 Eu1 141.4(3) . . ?
N73 Cu2 N73 89.8(3) 4_645 3_445 ?
N73 Cu2 N72 91.25(12) 4_645 4_645 ?
N73 Cu2 N72 176.88(16) 3_445 4_645 ?
N73 Cu2 N72 176.88(16) 4_645 3_445 ?
N73 Cu2 N72 91.25(12) 3_445 3_445 ?
N72 Cu2 N72 87.9(3) 4_645 3_445 ?
C96 O95 Eu1 131.6(3) . . ?
O95 C96 N97 126.1(5) . . ?
O95 C96 H96 116.9 . . ?
N97 C96 H96 116.9 . . ?
C96 N97 C98 121.9(4) . . ?
C96 N97 C99 122.0(5) . . ?
C98 N97 C99 116.1(4) . . ?
N97 C98 H98A 109.5 . . ?
N97 C98 H98B 109.5 . . ?
H98A C98 H98B 109.5 . . ?
N97 C98 H98C 109.5 . . ?
H98A C98 H98C 109.5 . . ?
H98B C98 H98C 109.5 . . ?
N97 C99 H99A 109.5 . . ?
N97 C99 H99B 109.5 . . ?
H99A C99 H99B 109.5 . . ?
N97 C99 H99C 109.5 . . ?
H99A C99 H99C 109.5 . . ?
H99B C99 H99C 109.5 . . ?
Eu2 O101 Eu1 91.00(13) . . ?
Eu2 O101 H10A 113.5 . . ?
Eu1 O101 H10A 113.5 . . ?
Eu2 O101 H10B 113.5 . . ?
Eu1 O101 H10B 113.5 . . ?
H10A O101 H10B 110.8 . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Eu1 O33 2.275(3) 2_755 ?
Eu1 O94 2.350(3) . ?
Eu1 O32 2.361(3) . ?
Eu1 O79 2.376(3) 2_745 ?
Eu1 O50 2.393(3) 7_656 ?
Eu1 O42 2.397(3) 6 ?
Eu1 O95 2.451(3) . ?
Eu1 O33 3.107(3) . ?
Eu1 C31 3.105(4) . ?
Eu1 O101 3.114(5) . ?
Eu1 Eu2 3.9760(3) . ?
Eu1 Eu1 4.1945(4) 2_755 ?
Eu2 O100A 2.306(7) . ?
Eu2 O88 2.328(3) 5_765 ?
Eu2 O59 2.418(3) 6_565 ?
Eu2 O101 2.419(4) . ?
Eu2 O41 2.425(3) 6 ?
Eu2 O50 2.454(2) 7_656 ?
Eu2 O100B 2.471(6) . ?
Eu2 O60 2.487(3) 6_565 ?
Eu2 O51 2.570(3) 7_656 ?
Eu2 O42 2.733(3) 6 ?
Eu2 C58 2.822(4) 6_565 ?
Eu2 C49 2.874(4) 7_656 ?
C1 N21 1.389(5) . ?
C1 C20 1.424(6) . ?
C1 C2 1.429(6) . ?
C2 C3 1.350(6) . ?
C2 H2 0.9500 . ?
C3 C4 1.440(6) . ?
C3 H3 0.9500 . ?
C4 N21 1.361(5) . ?
C4 C5 1.413(5) . ?
C5 C6 1.393(5) . ?
C5 C25 1.503(5) . ?
C6 N22 1.375(5) . ?
C6 C7 1.427(6) . ?
C7 C8 1.344(6) . ?
C7 H7 0.9500 . ?
C8 C9 1.440(5) . ?
C8 H8 0.9500 . ?
C9 N22 1.373(5) . ?
C9 C10 1.395(5) . ?
C10 C11 1.397(5) . ?
C10 C34 1.497(6) . ?
C11 N23 1.360(5) . ?
C11 C12 1.442(5) . ?
C12 C13 1.350(5) . ?
C12 H12 0.9500 . ?
C13 C14 1.446(5) . ?
C13 H13 0.9500 . ?
C14 N23 1.383(5) . ?
C14 C15 1.405(5) . ?
C15 C16 1.402(5) . ?
C15 C43 1.495(5) . ?
C16 N24 1.359(5) . ?
C16 C17 1.420(6) . ?
C17 C18 1.356(6) . ?
C17 H17 0.9500 . ?
C18 C19 1.432(6) . ?
C18 H18 0.9500 . ?
C19 N24 1.377(5) . ?
C19 C20 1.401(6) . ?
C20 C52 1.492(6) . ?
N21 Cu1 2.006(5) . ?
N22 Cu1 2.006(5) . ?
N23 Cu1 2.009(5) . ?
N24 Cu1 2.055(5) . ?
C25 C30 1.361(6) . ?
C25 C26 1.387(6) . ?
C26 C27 1.384(5) . ?
C26 H26 0.9500 . ?
C27 C28 1.384(6) . ?
C27 H27 0.9500 . ?
C28 C29 1.369(6) . ?
C28 C31 1.477(5) . ?
C29 C30 1.402(5) . ?
C29 H29 0.9500 . ?
C30 H30 0.9500 . ?
C31 O32 1.261(5) . ?
C31 O33 1.275(5) . ?
O33 Eu1 2.275(3) 2_755 ?
C34 C39 1.399(6) . ?
C34 C35 1.393(6) . ?
C35 C36 1.379(6) . ?
C35 H35 0.9500 . ?
C36 C37 1.386(6) . ?
C36 H36 0.9500 . ?
C37 C38 1.400(6) . ?
C37 C40 1.477(6) . ?
C38 C39 1.374(6) . ?
C38 H38 0.9500 . ?
C39 H39 0.9500 . ?
C40 O41 1.246(5) . ?
C40 O42 1.283(5) . ?
C40 Eu2 2.932(4) 6_556 ?
O41 Eu2 2.425(3) 6_556 ?
O42 Eu1 2.397(3) 6_556 ?
O42 Eu2 2.733(3) 6_556 ?
C43 C44 1.393(6) . ?
C43 C48 1.394(6) . ?
C44 C45 1.385(5) . ?
C44 H44 0.9500 . ?
C45 C46 1.386(5) . ?
C45 H45 0.9500 . ?
C46 C47 1.381(6) . ?
C46 C49 1.500(5) . ?
C47 C48 1.408(5) . ?
C47 H47 0.9500 . ?
C48 H48 0.9500 . ?
C49 O51 1.252(5) . ?
C49 O50 1.284(5) . ?
C49 Eu2 2.875(4) 7_656 ?
O50 Eu1 2.393(3) 7_656 ?
O50 Eu2 2.454(2) 7_656 ?
O51 Eu2 2.570(3) 7_656 ?
C52 C57 1.377(6) . ?
C52 C53 1.404(6) . ?
C53 C54 1.379(6) . ?
C53 H53 0.9500 . ?
C54 C55 1.398(6) . ?
C54 H54 0.9500 . ?
C55 C56 1.389(6) . ?
C55 C58 1.495(6) . ?
C56 C57 1.389(6) . ?
C56 H56 0.9500 . ?
C57 H57 0.9500 . ?
C58 O59 1.269(5) . ?
C58 O60 1.281(5) . ?
C58 Eu2 2.822(4) 6_566 ?
O59 Eu2 2.419(3) 6_566 ?
O60 Eu2 2.487(3) 6_566 ?
C61 C62 1.414(4) 2_755 ?
C61 C62 1.414(4) . ?
C61 C74 1.483(7) . ?
C62 N72 1.382(5) . ?
C62 C63 1.429(5) . ?
C63 C64 1.355(6) . ?
C63 H63 0.9500 . ?
C64 C65 1.430(6) . ?
C64 H64 0.9500 . ?
C65 N72 1.381(5) . ?
C65 C66 1.398(5) . ?
C66 C67 1.409(5) . ?
C66 C80 1.497(5) . ?
C67 N73 1.375(4) . ?
C67 C68 1.445(5) . ?
C68 C69 1.360(5) . ?
C68 H68 0.9500 . ?
C69 C70 1.424(5) . ?
C69 H69 0.9500 . ?
C70 N73 1.386(5) . ?
C70 C71 1.395(4) . ?
C71 C70 1.395(4) 2_755 ?
C71 C89 1.498(7) . ?
N72 Cu2 2.068(6) 3 ?
N73 Cu2 2.027(6) 3 ?
C74 C75 1.398(5) 2_755 ?
C74 C75 1.398(5) . ?
C75 C76 1.381(6) . ?
C75 H75 0.9500 . ?
C76 C77 1.381(5) . ?
C76 H76 0.9500 . ?
C77 C76 1.381(5) 2_755 ?
C77 C78 1.516(8) . ?
C78 O79 1.259(4) . ?
C78 O79 1.259(4) 2_755 ?
O79 Eu1 2.376(3) 2_765 ?
C80 C85 1.350(7) . ?
C80 C81 1.369(6) . ?
C81 C82 1.364(6) . ?
C81 H81 0.9500 . ?
C82 C83 1.378(8) . ?
C82 H82 0.9500 . ?
C83 C84 1.352(8) . ?
C83 C86 1.552(7) . ?
C84 C85 1.372(7) . ?
C84 H84 0.9500 . ?
C85 H85 0.9500 . ?
C86 O88 1.190(8) . ?
C86 O87 1.251(10) . ?
C86 Eu2 3.178(6) 5_765 ?
O88 Eu2 2.328(3) 5_765 ?
C89 C90 1.390(5) 2_755 ?
C89 C90 1.390(5) . ?
C90 C91 1.401(5) . ?
C90 H90 0.9500 . ?
C91 C92 1.389(5) . ?
C91 H91 0.9500 . ?
C92 C91 1.389(5) 2_755 ?
C92 C93 1.491(7) . ?
C93 O94 1.263(4) 2_755 ?
C93 O94 1.263(4) . ?
Cu2 N73 2.027(6) 4_645 ?
Cu2 N73 2.027(6) 3_445 ?
Cu2 N72 2.068(6) 4_645 ?
Cu2 N72 2.068(6) 3_445 ?
O95 C96 1.242(5) . ?
C96 N97 1.295(6) . ?
C96 H96 0.9500 . ?
N97 C98 1.416(6) . ?
N97 C99 1.488(6) . ?
C98 H98A 0.9800 . ?
C98 H98B 0.9800 . ?
C98 H98C 0.9800 . ?
C99 H99A 0.9800 . ?
C99 H99B 0.9800 . ?
C99 H99C 0.9800 . ?
O101 H10A 0.9900 . ?
O101 H10B 0.9900 . ?
