#------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176432 $
#$URL: svn://www.crystallography.net/cod/cif/7/02/58/7025870.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_7025870
loop_
_publ_author_name
'Deng, Zhao-Peng'
'Kang, Wei'
'Huo, Li-Hua'
'Zhao, Hui'
'Gao, Shan'
_publ_section_title
;
 Rare-earth organic frameworks involving three types of architecture tuned
 by the lanthanide contraction effect: hydrothermal syntheses, structures
 and luminescence.
;
_journal_issue                   27
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              6276
_journal_page_last               6284
_journal_paper_doi               10.1039/c0dt00031k
_journal_volume                  39
_journal_year                    2010
_chemical_formula_moiety         'C20 H22 Eu2 N12 O12'
_chemical_formula_sum            'C20 H22 Eu2 N12 O12'
_chemical_formula_weight         926.42
_chemical_name_systematic
;
?
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 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                 94.16(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   9.832(2)
_cell_length_b                   11.437(2)
_cell_length_c                   24.755(5)
_cell_measurement_reflns_used    18974
_cell_measurement_temperature    295(2)
_cell_measurement_theta_max      24.97
_cell_measurement_theta_min      3.05
_cell_volume                     2776.3(9)
_computing_cell_refinement       RAPID-AUTO
_computing_data_collection       'RAPID-AUTO (Rigaku Corporation, 1998)'
_computing_data_reduction
'CrystalStructure (Rigaku/MSC and Rigaku Corporation, 2002)'
_computing_molecular_graphics    SHELXL-97
_computing_publication_material  SHELXL-97
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      295(2)
_diffrn_detector_area_resol_mean 10.000
_diffrn_measured_fraction_theta_full 0.988
_diffrn_measured_fraction_theta_max 0.988
_diffrn_measurement_device_type  'Rigaku RAXIS-RAPID'
_diffrn_measurement_method       ω
_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  0.0451
_diffrn_reflns_av_sigmaI/netI    0.0351
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       29
_diffrn_reflns_limit_l_min       -29
_diffrn_reflns_number            20983
_diffrn_reflns_theta_full        24.99
_diffrn_reflns_theta_max         24.99
_diffrn_reflns_theta_min         3.05
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    4.563
_exptl_absorpt_correction_T_max  0.6337
_exptl_absorpt_correction_T_min  0.4622
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'ABSCOR (Higashi, 1995)'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    2.216
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             1792
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.11
_refine_diff_density_max         2.274
_refine_diff_density_min         -1.784
_refine_diff_density_rms         0.159
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.042
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     433
_refine_ls_number_reflns         4827
_refine_ls_number_restraints     8
_refine_ls_restrained_S_all      1.042
_refine_ls_R_factor_all          0.0355
_refine_ls_R_factor_gt           0.0296
_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)+(0.0461P)²+1.8602P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0726
_refine_ls_wR_factor_ref         0.0766
_reflns_number_gt                4158
_reflns_number_total             4827
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c0dt00031k.txt
_cod_data_source_block           complex5
_cod_original_sg_symbol_Hall     '-P 2yn '
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               7025870
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -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
Eu1 Eu 0.641820(18) 0.515934(18) 0.239315(7) 0.01393(9) Uani 1 1 d .
Eu2 Eu 0.360030(19) 0.732557(18) 0.255069(7) 0.01387(9) Uani 1 1 d .
O1 O 0.1799(3) 0.8589(3) 0.28051(12) 0.0277(7) Uani 1 1 d .
O1W O 0.1560(3) 0.6214(3) 0.22684(14) 0.0287(7) Uani 1 1 d D
H1O1 H 0.127(4) 0.561(3) 0.2426(18) 0.043 Uiso 1 1 d D
H1O2 H 0.091(3) 0.652(4) 0.2073(18) 0.043 Uiso 1 1 d D
O2W O 0.8502(3) 0.6227(3) 0.26441(13) 0.0275(7) Uani 1 1 d D
H2O1 H 0.868(5) 0.691(2) 0.2539(18) 0.041 Uiso 1 1 d D
H2O2 H 0.907(4) 0.602(4) 0.2903(15) 0.041 Uiso 1 1 d D
O2 O 0.0028(3) 0.9109(3) 0.32745(12) 0.0257(7) Uani 1 1 d .
O3 O 0.3912(3) 0.9200(2) 0.21350(11) 0.0214(6) Uani 1 1 d .
O4 O 0.5006(3) 1.0114(3) 0.15020(12) 0.0271(7) Uani 1 1 d .
O5 O 0.8182(3) 0.3845(3) 0.21528(12) 0.0273(7) Uani 1 1 d .
O6 O 1.0031(3) 0.3351(3) 0.17356(12) 0.0261(7) Uani 1 1 d .
O7 O 0.6118(3) 0.3309(2) 0.28473(11) 0.0217(6) Uani 1 1 d .
O8 O 0.5107(4) 0.2430(3) 0.35144(13) 0.0293(8) Uani 1 1 d .
O9 O 0.4315(3) 0.5495(2) 0.27428(12) 0.0200(6) Uani 1 1 d D
O10 O 0.5716(3) 0.7009(2) 0.22022(12) 0.0200(6) Uani 1 1 d D
N1 N 0.2567(4) 0.6938(3) 0.34966(14) 0.0200(8) Uani 1 1 d .
N2 N 0.1490(4) 0.6709(4) 0.44967(15) 0.0291(9) Uani 1 1 d .
N3 N -0.0043(5) 0.8182(4) 0.42886(16) 0.0403(11) Uani 1 1 d .
H3A H -0.0349 0.8092 0.4603 0.048 Uiso 1 1 calc R
H3B H -0.0395 0.8704 0.4070 0.048 Uiso 1 1 calc R
N4 N 0.3233(4) 0.7425(3) 0.14803(14) 0.0222(8) Uani 1 1 d .
N5 N 0.3891(5) 0.7345(4) 0.04102(15) 0.0321(10) Uani 1 1 d .
N6 N 0.5100(5) 0.9055(4) 0.05199(16) 0.0389(11) Uani 1 1 d .
H6A H 0.5331 0.8984 0.0193 0.047 Uiso 1 1 calc R
H6B H 0.5381 0.9645 0.0713 0.047 Uiso 1 1 calc R
N7 N 0.7452(4) 0.5437(3) 0.14294(14) 0.0204(8) Uani 1 1 d .
N8 N 0.8590(4) 0.5571(4) 0.04332(15) 0.0334(10) Uani 1 1 d .
N9 N 1.0141(5) 0.4143(4) 0.06941(17) 0.0463(13) Uani 1 1 d .
H9A H 1.0467 0.4199 0.0382 0.056 Uiso 1 1 calc R
H9B H 1.0488 0.3653 0.0929 0.056 Uiso 1 1 calc R
N10 N 0.6796(4) 0.5163(3) 0.34528(14) 0.0191(8) Uani 1 1 d .
N11 N 0.6178(4) 0.5363(4) 0.45201(15) 0.0304(9) Uani 1 1 d .
N12 N 0.5112(5) 0.3574(4) 0.44831(16) 0.0402(11) Uani 1 1 d .
H12A H 0.4914 0.3675 0.4812 0.048 Uiso 1 1 calc R
H12B H 0.4862 0.2945 0.4313 0.048 Uiso 1 1 calc R
C1 C 0.3035(5) 0.6126(4) 0.38457(18) 0.0272(10) Uani 1 1 d .
H1 H 0.3727 0.5624 0.3756 0.033 Uiso 1 1 calc R
C2 C 0.2491(5) 0.6031(4) 0.43419(18) 0.0289(11) Uani 1 1 d .
H2 H 0.2842 0.5462 0.4581 0.035 Uiso 1 1 calc R
C3 C 0.0983(5) 0.7508(4) 0.41385(18) 0.0251(10) Uani 1 1 d .
C4 C 0.1562(4) 0.7638(4) 0.36304(16) 0.0176(9) Uani 1 1 d .
C5 C 0.1094(4) 0.8505(4) 0.32047(16) 0.0194(9) Uani 1 1 d .
C6 C 0.2847(5) 0.6523(4) 0.11582(18) 0.0301(11) Uani 1 1 d .
H6 H 0.2358 0.5906 0.1294 0.036 Uiso 1 1 calc R
C7 C 0.3172(6) 0.6510(5) 0.0629(2) 0.0367(12) Uani 1 1 d .
H7 H 0.2875 0.5883 0.0413 0.044 Uiso 1 1 calc R
C8 C 0.4300(5) 0.8247(4) 0.07288(17) 0.0246(10) Uani 1 1 d .
C9 C 0.3917(4) 0.8304(4) 0.12739(16) 0.0200(9) Uani 1 1 d .
C10 C 0.4321(4) 0.9285(4) 0.16609(16) 0.0191(9) Uani 1 1 d .
C11 C 0.6995(5) 0.6197(4) 0.10530(18) 0.0279(10) Uani 1 1 d .
H11 H 0.6284 0.6698 0.1124 0.033 Uiso 1 1 calc R
C12 C 0.7553(5) 0.6256(4) 0.0562(2) 0.0353(12) Uani 1 1 d .
H12 H 0.7198 0.6793 0.0308 0.042 Uiso 1 1 calc R
C13 C 0.9085(5) 0.4825(4) 0.08158(18) 0.0279(11) Uani 1 1 d .
C14 C 0.8493(4) 0.4740(4) 0.13212(16) 0.0181(9) Uani 1 1 d .
C15 C 0.8937(4) 0.3923(4) 0.17707(16) 0.0194(9) Uani 1 1 d .
C16 C 0.7151(5) 0.6105(4) 0.37436(19) 0.0287(10) Uani 1 1 d .
H16 H 0.7614 0.6710 0.3586 0.034 Uiso 1 1 calc R
C17 C 0.6845(5) 0.6197(4) 0.42725(19) 0.0317(11) Uani 1 1 d .
H17 H 0.7112 0.6865 0.4466 0.038 Uiso 1 1 calc R
C18 C 0.5809(5) 0.4392(4) 0.42357(17) 0.0241(10) Uani 1 1 d .
C19 C 0.6153(4) 0.4291(4) 0.36866(17) 0.0208(9) Uani 1 1 d .
C20 C 0.5754(4) 0.3258(4) 0.33304(16) 0.0185(9) Uani 1 1 d .
H9O H 0.385(4) 0.488(3) 0.2685(19) 0.028 Uiso 1 1 d D
H10O H 0.614(4) 0.764(2) 0.226(2) 0.028 Uiso 1 1 d 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'
Eu Eu -0.1578 3.6682 '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
O10 Eu1 O9 70.03(10) . .
O10 Eu1 O5 138.37(10) . .
O9 Eu1 O5 150.56(10) . .
O10 Eu1 O2 99.56(11) . 2_545
O9 Eu1 O2 80.92(10) . 2_545
O5 Eu1 O2 85.36(11) . 2_545
O10 Eu1 O7 150.08(10) . .
O9 Eu1 O7 80.23(10) . .
O5 Eu1 O7 71.52(10) . .
O2 Eu1 O7 78.36(10) 2_545 .
O10 Eu1 O2W 79.78(11) . .
O9 Eu1 O2W 125.28(11) . .
O5 Eu1 O2W 76.51(12) . .
O2 Eu1 O2W 150.21(10) 2_545 .
O7 Eu1 O2W 116.69(11) . .
O10 Eu1 N10 103.08(10) . .
O9 Eu1 N10 72.14(11) . .
O5 Eu1 N10 101.31(11) . .
O2 Eu1 N10 135.85(10) 2_545 .
O7 Eu1 N10 63.29(10) . .
O2W Eu1 N10 71.79(11) . .
O10 Eu1 N7 80.39(10) . .
O9 Eu1 N7 135.68(11) . .
O5 Eu1 N7 61.72(10) . .
O2 Eu1 N7 72.11(10) 2_545 .
O7 Eu1 N7 125.68(10) . .
O2W Eu1 N7 78.49(11) . .
N10 Eu1 N7 148.78(11) . .
O10 Eu1 Eu2 35.89(7) . .
O9 Eu1 Eu2 34.15(7) . .
O5 Eu1 Eu2 171.54(7) . .
O2 Eu1 Eu2 89.84(8) 2_545 .
O7 Eu1 Eu2 114.33(7) . .
O2W Eu1 Eu2 104.89(8) . .
N10 Eu1 Eu2 86.98(8) . .
N7 Eu1 Eu2 110.15(8) . .
O10 Eu1 H9O 83.7(8) . .
O9 Eu1 H9O 17.6(6) . .
O5 Eu1 H9O 134.3(7) . .
O2 Eu1 H9O 66.9(8) 2_545 .
O7 Eu1 H9O 67.9(9) . .
O2W Eu1 H9O 141.4(7) . .
N10 Eu1 H9O 78.4(10) . .
N7 Eu1 H9O 132.5(10) . .
Eu2 Eu1 H9O 48.6(8) . .
O9 Eu2 O10 70.19(10) . .
O9 Eu2 O1 136.78(10) . .
O10 Eu2 O1 151.87(10) . .
O9 Eu2 O3 150.73(10) . .
O10 Eu2 O3 80.55(10) . .
O1 Eu2 O3 72.30(10) . .
O9 Eu2 O1W 79.19(11) . .
O10 Eu2 O1W 123.37(11) . .
O1 Eu2 O1W 77.40(12) . .
O3 Eu2 O1W 118.06(11) . .
O9 Eu2 O6 98.46(11) . 2_655
O10 Eu2 O6 83.27(10) . 2_655
O1 Eu2 O6 84.24(11) . 2_655
O3 Eu2 O6 78.51(10) . 2_655
O1W Eu2 O6 149.09(11) . 2_655
O9 Eu2 N4 105.62(11) . .
O10 Eu2 N4 72.43(11) . .
O1 Eu2 N4 100.75(11) . .
O3 Eu2 N4 63.06(10) . .
O1W Eu2 N4 71.68(12) . .
O6 Eu2 N4 136.94(10) 2_655 .
O9 Eu2 N1 77.98(10) . .
O10 Eu2 N1 135.00(11) . .
O1 Eu2 N1 62.18(10) . .
O3 Eu2 N1 126.45(10) . .
O1W Eu2 N1 78.81(11) . .
O6 Eu2 N1 70.64(10) 2_655 .
N4 Eu2 N1 148.78(11) . .
O9 Eu2 C10 134.76(10) . .
O10 Eu2 C10 67.28(10) . .
O1 Eu2 C10 87.95(10) . .
O3 Eu2 C10 19.47(9) . .
O1W Eu2 C10 112.36(11) . .
O6 Eu2 C10 91.34(10) 2_655 .
N4 Eu2 C10 46.75(11) . .
N1 Eu2 C10 145.80(10) . .
O9 Eu2 Eu1 35.58(7) . .
O10 Eu2 Eu1 34.61(7) . .
O1 Eu2 Eu1 170.33(7) . .
O3 Eu2 Eu1 115.15(7) . .
O1W Eu2 Eu1 102.95(8) . .
O6 Eu2 Eu1 91.15(8) 2_655 .
N4 Eu2 Eu1 88.43(8) . .
N1 Eu2 Eu1 108.27(8) . .
C10 Eu2 Eu1 100.68(7) . .
O9 Eu2 H10O 84.3(8) . .
O10 Eu2 H10O 17.8(6) . .
O1 Eu2 H10O 135.1(7) . .
O3 Eu2 H10O 67.2(9) . .
O1W Eu2 H10O 139.4(7) . .
O6 Eu2 H10O 69.7(8) 2_655 .
N4 Eu2 H10O 77.7(10) . .
N1 Eu2 H10O 133.2(11) . .
C10 Eu2 H10O 58.0(10) . .
Eu1 Eu2 H10O 49.6(8) . .
C5 O1 Eu2 128.4(3) . .
Eu2 O1W H1O1 126(3) . .
Eu2 O1W H1O2 121(3) . .
H1O1 O1W H1O2 109(4) . .
Eu1 O2W H2O1 125(3) . .
Eu1 O2W H2O2 123(3) . .
H2O1 O2W H2O2 110(4) . .
C5 O2 Eu1 128.5(3) . 2
C10 O3 Eu2 121.4(2) . .
C15 O5 Eu1 128.6(3) . .
C15 O6 Eu2 128.6(3) . 2_645
C20 O7 Eu1 121.8(2) . .
Eu2 O9 Eu1 110.27(12) . .
Eu2 O9 H9O 126(4) . .
Eu1 O9 H9O 106(3) . .
Eu1 O10 Eu2 109.50(11) . .
Eu1 O10 H10O 129(4) . .
Eu2 O10 H10O 104(3) . .
C1 N1 C4 119.1(4) . .
C1 N1 Eu2 123.6(3) . .
C4 N1 Eu2 117.2(3) . .
C2 N2 C3 116.9(4) . .
C3 N3 H3A 120.0 . .
C3 N3 H3B 120.0 . .
H3A N3 H3B 120.0 . .
C9 N4 C6 118.8(4) . .
C9 N4 Eu2 112.3(3) . .
C6 N4 Eu2 125.0(3) . .
C7 N5 C8 117.3(4) . .
C8 N6 H6A 120.0 . .
C8 N6 H6B 120.0 . .
H6A N6 H6B 120.0 . .
C11 N7 C14 118.3(4) . .
C11 N7 Eu1 124.8(3) . .
C14 N7 Eu1 116.9(3) . .
C13 N8 C12 116.5(4) . .
C13 N9 H9A 120.0 . .
C13 N9 H9B 120.0 . .
H9A N9 H9B 120.0 . .
C16 N10 C19 119.0(4) . .
C16 N10 Eu1 123.8(3) . .
C19 N10 Eu1 113.3(3) . .
C17 N11 C18 118.1(4) . .
C18 N12 H12A 120.0 . .
C18 N12 H12B 120.0 . .
H12A N12 H12B 120.0 . .
N1 C1 C2 119.8(4) . .
N1 C1 H1 120.1 . .
C2 C1 H1 120.1 . .
N2 C2 C1 123.6(4) . .
N2 C2 H2 118.2 . .
C1 C2 H2 118.2 . .
N3 C3 N2 117.2(4) . .
N3 C3 C4 122.7(4) . .
N2 C3 C4 120.0(4) . .
N1 C4 C3 120.5(4) . .
N1 C4 C5 114.8(3) . .
C3 C4 C5 124.7(4) . .
O1 C5 O2 124.9(4) . .
O1 C5 C4 116.6(4) . .
O2 C5 C4 118.5(3) . .
N4 C6 C7 120.0(4) . .
N4 C6 H6 120.0 . .
C7 C6 H6 120.0 . .
N5 C7 C6 123.4(4) . .
N5 C7 H7 118.3 . .
C6 C7 H7 118.3 . .
N6 C8 N5 117.5(4) . .
N6 C8 C9 122.4(4) . .
N5 C8 C9 120.1(4) . .
N4 C9 C8 120.2(4) . .
N4 C9 C10 115.7(3) . .
C8 C9 C10 123.9(4) . .
O4 C10 O3 124.4(4) . .
O4 C10 C9 119.3(4) . .
O3 C10 C9 116.3(4) . .
O4 C10 Eu2 152.7(3) . .
C9 C10 Eu2 81.8(2) . .
N7 C11 C12 121.1(4) . .
N7 C11 H11 119.4 . .
C12 C11 H11 119.4 . .
N8 C12 C11 122.8(4) . .
N8 C12 H12 118.6 . .
C11 C12 H12 118.6 . .
N8 C13 N9 117.1(4) . .
N8 C13 C14 121.0(4) . .
N9 C13 C14 121.9(4) . .
N7 C14 C13 120.2(4) . .
N7 C14 C15 114.2(3) . .
C13 C14 C15 125.6(4) . .
O5 C15 O6 124.8(4) . .
O5 C15 C14 116.8(4) . .
O6 C15 C14 118.4(4) . .
N10 C16 C17 120.9(4) . .
N10 C16 H16 119.6 . .
C17 C16 H16 119.6 . .
N11 C17 C16 122.4(4) . .
N11 C17 H17 118.8 . .
C16 C17 H17 118.8 . .
N12 C18 N11 117.7(4) . .
N12 C18 C19 123.0(4) . .
N11 C18 C19 119.3(4) . .
N10 C19 C18 120.3(4) . .
N10 C19 C20 116.3(3) . .
C18 C19 C20 123.3(4) . .
O8 C20 O7 124.4(4) . .
O8 C20 C19 120.0(4) . .
O7 C20 C19 115.7(4) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Eu1 O10 2.265(3) .
Eu1 O9 2.331(3) .
Eu1 O5 2.403(3) .
Eu1 O2 2.420(3) 2_545
Eu1 O7 2.424(3) .
Eu1 O2W 2.427(3) .
Eu1 N10 2.623(3) .
Eu1 N7 2.679(3) .
Eu1 H9O 2.70(4) .
Eu2 O9 2.249(3) .
Eu2 O10 2.337(3) .
Eu2 O1 2.405(3) .
Eu2 O3 2.408(3) .
Eu2 O1W 2.434(3) .
Eu2 O6 2.442(3) 2_655
Eu2 N4 2.651(4) .
Eu2 N1 2.657(3) .
Eu2 C10 3.256(4) .
Eu2 H10O 2.67(4) .
O1 C5 1.252(5) .
O1W H1O1 0.85(4) .
O1W H1O2 0.85(4) .
O2W H2O1 0.85(4) .
O2W H2O2 0.85(4) .
O2 C5 1.278(5) .
O2 Eu1 2.420(3) 2
O3 C10 1.271(5) .
O4 C10 1.244(5) .
O5 C15 1.247(5) .
O6 C15 1.267(5) .
O6 Eu2 2.442(3) 2_645
O7 C20 1.274(5) .
O8 C20 1.245(5) .
O9 H9O 0.85(4) .
O10 H10O 0.84(3) .
N1 C1 1.327(6) .
N1 C4 1.332(5) .
N2 C2 1.331(6) .
N2 C3 1.344(6) .
N3 C3 1.343(6) .
N3 H3A 0.8600 .
N3 H3B 0.8600 .
N4 C9 1.332(6) .
N4 C6 1.342(6) .
N5 C7 1.327(7) .
N5 C8 1.343(6) .
N6 C8 1.341(6) .
N6 H6A 0.8600 .
N6 H6B 0.8600 .
N7 C11 1.329(6) .
N7 C14 1.340(5) .
N8 C13 1.340(6) .
N8 C12 1.343(6) .
N9 C13 1.350(6) .
N9 H9A 0.8600 .
N9 H9B 0.8600 .
N10 C16 1.328(6) .
N10 C19 1.335(6) .
N11 C17 1.331(6) .
N11 C18 1.350(6) .
N12 C18 1.335(6) .
N12 H12A 0.8600 .
N12 H12B 0.8600 .
C1 C2 1.379(6) .
C1 H1 0.9300 .
C2 H2 0.9300 .
C3 C4 1.425(6) .
C4 C5 1.495(6) .
C6 C7 1.370(6) .
C6 H6 0.9300 .
C7 H7 0.9300 .
C8 C9 1.429(6) .
C9 C10 1.509(6) .
C11 C12 1.370(6) .
C11 H11 0.9300 .
C12 H12 0.9300 .
C13 C14 1.421(6) .
C14 C15 1.494(6) .
C16 C17 1.369(6) .
C16 H16 0.9300 .
C17 H17 0.9300 .
C18 C19 1.429(6) .
C19 C20 1.509(6) .
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 H1O1 O3 0.85(4) 1.96(4) 2.793(4) 165(4) 2_545
O1W H1O2 O8 0.85(4) 2.00(4) 2.813(5) 162(4) 2
O2W H2O1 O7 0.85(4) 1.88(3) 2.712(4) 167(4) 2_655
O2W H2O2 O4 0.85(4) 1.97(4) 2.791(5) 162(4) 2_645
N3 H3A N5 0.86 2.24 3.098(5) 173.9 4_576
N3 H3B O2 0.86 2.09 2.730(5) 130.2 .
N6 H6A N2 0.86 2.28 3.090(5) 157.9 4_675
N6 H6B O4 0.86 2.09 2.724(5) 130.6 .
N9 H9A N8 0.86 2.30 3.155(5) 176.9 3_765
N9 H9B O6 0.86 2.11 2.742(5) 130.2 .
N12 H12A N11 0.86 2.31 3.103(6) 152.9 3_666
N12 H12B O8 0.86 2.09 2.731(5) 130.5 .
O9 H9O O1 0.85(4) 1.98(2) 2.752(4) 150(4) 2_545
O10 H10O O5 0.84(3) 2.08(3) 2.807(4) 145(4) 2_655
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
O10 Eu1 Eu2 O9 -179.39(17) . .
O2 Eu1 Eu2 O9 73.92(15) 2_545 .
O7 Eu1 Eu2 O9 -3.21(15) . .
O2W Eu1 Eu2 O9 -132.28(15) . .
N10 Eu1 Eu2 O9 -62.02(15) . .
N7 Eu1 Eu2 O9 144.75(15) . .
O9 Eu1 Eu2 O10 179.39(17) . .
O2 Eu1 Eu2 O10 -106.70(15) 2_545 .
O7 Eu1 Eu2 O10 176.18(15) . .
O2W Eu1 Eu2 O10 47.11(15) . .
N10 Eu1 Eu2 O10 117.36(15) . .
N7 Eu1 Eu2 O10 -35.86(15) . .
O10 Eu1 Eu2 O3 1.44(15) . .
O9 Eu1 Eu2 O3 -179.17(15) . .
O2 Eu1 Eu2 O3 -105.25(10) 2_545 .
O7 Eu1 Eu2 O3 177.62(10) . .
O2W Eu1 Eu2 O3 48.55(11) . .
N10 Eu1 Eu2 O3 118.81(11) . .
N7 Eu1 Eu2 O3 -34.42(12) . .
O10 Eu1 Eu2 O1W 131.33(15) . .
O9 Eu1 Eu2 O1W -49.29(15) . .
O2 Eu1 Eu2 O1W 24.63(11) 2_545 .
O7 Eu1 Eu2 O1W -52.50(12) . .
O2W Eu1 Eu2 O1W 178.44(11) . .
N10 Eu1 Eu2 O1W -111.31(11) . .
N7 Eu1 Eu2 O1W 95.47(12) . .
O10 Eu1 Eu2 O6 -76.40(14) . 2_655
O9 Eu1 Eu2 O6 102.99(15) . 2_655
O2 Eu1 Eu2 O6 176.91(9) 2_545 2_655
O7 Eu1 Eu2 O6 99.78(10) . 2_655
O2W Eu1 Eu2 O6 -29.29(10) . 2_655
N10 Eu1 Eu2 O6 40.97(10) . 2_655
N7 Eu1 Eu2 O6 -112.26(11) . 2_655
O10 Eu1 Eu2 N4 60.54(15) . .
O9 Eu1 Eu2 N4 -120.08(15) . .
O2 Eu1 Eu2 N4 -46.16(11) 2_545 .
O7 Eu1 Eu2 N4 -123.29(11) . .
O2W Eu1 Eu2 N4 107.64(11) . .
N10 Eu1 Eu2 N4 177.90(11) . .
N7 Eu1 Eu2 N4 24.67(12) . .
O10 Eu1 Eu2 N1 -146.36(15) . .
O9 Eu1 Eu2 N1 33.02(15) . .
O2 Eu1 Eu2 N1 106.94(11) 2_545 .
O7 Eu1 Eu2 N1 29.81(11) . .
O2W Eu1 Eu2 N1 -99.25(11) . .
N10 Eu1 Eu2 N1 -29.00(11) . .
N7 Eu1 Eu2 N1 177.78(11) . .
O10 Eu1 Eu2 C10 15.18(15) . .
O9 Eu1 Eu2 C10 -165.43(15) . .
O2 Eu1 Eu2 C10 -91.51(10) 2_545 .
O7 Eu1 Eu2 C10 -168.64(11) . .
O2W Eu1 Eu2 C10 62.29(11) . .
N10 Eu1 Eu2 C10 132.55(11) . .
N7 Eu1 Eu2 C10 -20.68(11) . .
O9 Eu2 O1 C5 18.4(5) . .
O10 Eu2 O1 C5 -141.8(3) . .
O3 Eu2 O1 C5 -157.5(4) . .
O1W Eu2 O1 C5 77.2(4) . .
O6 Eu2 O1 C5 -77.8(4) 2_655 .
N4 Eu2 O1 C5 145.5(4) . .
N1 Eu2 O1 C5 -6.7(4) . .
C10 Eu2 O1 C5 -169.3(4) . .
O9 Eu2 O3 C10 43.5(4) . .
O10 Eu2 O3 C10 45.3(3) . .
O1 Eu2 O3 C10 -142.2(3) . .
O1W Eu2 O3 C10 -77.6(3) . .
O6 Eu2 O3 C10 130.3(3) 2_655 .
N4 Eu2 O3 C10 -29.7(3) . .
N1 Eu2 O3 C10 -174.5(3) . .
Eu1 Eu2 O3 C10 44.4(3) . .
O10 Eu1 O5 C15 -15.1(5) . .
O9 Eu1 O5 C15 146.3(3) . .
O2 Eu1 O5 C15 84.1(4) 2_545 .
O7 Eu1 O5 C15 163.4(4) . .
O2W Eu1 O5 C15 -72.1(4) . .
N10 Eu1 O5 C15 -140.0(4) . .
N7 Eu1 O5 C15 11.9(4) . .
O10 Eu1 O7 C20 -40.9(4) . .
O9 Eu1 O7 C20 -47.2(3) . .
O5 Eu1 O7 C20 141.2(3) . .
O2 Eu1 O7 C20 -129.9(3) 2_545 .
O2W Eu1 O7 C20 77.5(3) . .
N10 Eu1 O7 C20 27.6(3) . .
N7 Eu1 O7 C20 172.4(3) . .
Eu2 Eu1 O7 C20 -45.4(3) . .
O10 Eu2 O9 Eu1 -0.37(10) . .
O1 Eu2 O9 Eu1 -170.61(13) . .
O3 Eu2 O9 Eu1 1.5(3) . .
O1W Eu2 O9 Eu1 131.23(14) . .
O6 Eu2 O9 Eu1 -80.04(13) 2_655 .
N4 Eu2 O9 Eu1 63.92(15) . .
N1 Eu2 O9 Eu1 -148.05(14) . .
C10 Eu2 O9 Eu1 20.4(2) . .
O10 Eu1 O9 Eu2 0.38(11) . .
O5 Eu1 O9 Eu2 -166.61(16) . .
O2 Eu1 O9 Eu2 -103.33(13) 2_545 .
O7 Eu1 O9 Eu2 177.03(14) . .
O2W Eu1 O9 Eu2 61.15(17) . .
N10 Eu1 O9 Eu2 112.10(14) . .
N7 Eu1 O9 Eu2 -50.8(2) . .
O9 Eu1 O10 Eu2 -0.37(10) . .
O5 Eu1 O10 Eu2 170.05(13) . .
O2 Eu1 O10 Eu2 76.25(13) 2_545 .
O7 Eu1 O10 Eu2 -7.0(3) . .
O2W Eu1 O10 Eu2 -133.99(14) . .
N10 Eu1 O10 Eu2 -65.57(14) . .
N7 Eu1 O10 Eu2 146.10(14) . .
O9 Eu2 O10 Eu1 0.38(10) . .
O1 Eu2 O10 Eu1 166.13(17) . .
O3 Eu2 O10 Eu1 -178.68(14) . .
O1W Eu2 O10 Eu1 -61.20(17) . .
O6 Eu2 O10 Eu1 101.91(13) 2_655 .
N4 Eu2 O10 Eu1 -114.09(14) . .
N1 Eu2 O10 Eu1 48.06(19) . .
C10 Eu2 O10 Eu1 -163.80(16) . .
O9 Eu2 N1 C1 20.7(3) . .
O10 Eu2 N1 C1 -24.6(4) . .
O1 Eu2 N1 C1 -176.5(4) . .
O3 Eu2 N1 C1 -141.3(3) . .
O1W Eu2 N1 C1 101.9(4) . .
O6 Eu2 N1 C1 -82.8(4) 2_655 .
N4 Eu2 N1 C1 121.1(4) . .
C10 Eu2 N1 C1 -144.6(3) . .
Eu1 Eu2 N1 C1 1.8(4) . .
O9 Eu2 N1 C4 -162.2(3) . .
O10 Eu2 N1 C4 152.5(3) . .
O1 Eu2 N1 C4 0.5(3) . .
O3 Eu2 N1 C4 35.8(3) . .
O1W Eu2 N1 C4 -81.0(3) . .
O6 Eu2 N1 C4 94.3(3) 2_655 .
N4 Eu2 N1 C4 -61.8(4) . .
C10 Eu2 N1 C4 32.5(4) . .
Eu1 Eu2 N1 C4 178.9(3) . .
O9 Eu2 N4 C9 -126.0(3) . .
O10 Eu2 N4 C9 -63.2(3) . .
O1 Eu2 N4 C9 88.6(3) . .
O3 Eu2 N4 C9 25.0(3) . .
O1W Eu2 N4 C9 161.4(3) . .
O6 Eu2 N4 C9 -4.4(4) 2_655 .
N1 Eu2 N4 C9 141.5(3) . .
C10 Eu2 N4 C9 11.8(3) . .
Eu1 Eu2 N4 C9 -94.4(3) . .
O9 Eu2 N4 C6 31.3(4) . .
O10 Eu2 N4 C6 94.1(4) . .
O1 Eu2 N4 C6 -114.1(4) . .
O3 Eu2 N4 C6 -177.8(4) . .
O1W Eu2 N4 C6 -41.4(4) . .
O6 Eu2 N4 C6 152.8(3) 2_655 .
N1 Eu2 N4 C6 -61.2(5) . .
C10 Eu2 N4 C6 169.1(4) . .
Eu1 Eu2 N4 C6 62.8(4) . .
O10 Eu1 N7 C11 -23.0(4) . .
O9 Eu1 N7 C11 25.0(4) . .
O5 Eu1 N7 C11 174.8(4) . .
O2 Eu1 N7 C11 80.4(4) 2_545 .
O7 Eu1 N7 C11 140.8(3) . .
O2W Eu1 N7 C11 -104.5(4) . .
N10 Eu1 N7 C11 -122.4(4) . .
Eu2 Eu1 N7 C11 -2.7(4) . .
O10 Eu1 N7 C14 158.1(3) . .
O9 Eu1 N7 C14 -153.9(3) . .
O5 Eu1 N7 C14 -4.1(3) . .
O2 Eu1 N7 C14 -98.5(3) 2_545 .
O7 Eu1 N7 C14 -38.1(3) . .
O2W Eu1 N7 C14 76.6(3) . .
N10 Eu1 N7 C14 58.6(4) . .
Eu2 Eu1 N7 C14 178.4(3) . .
O10 Eu1 N10 C16 -29.3(4) . .
O9 Eu1 N10 C16 -93.0(4) . .
O5 Eu1 N10 C16 116.7(3) . .
O2 Eu1 N10 C16 -148.2(3) 2_545 .
O7 Eu1 N10 C16 179.2(4) . .
O2W Eu1 N10 C16 45.2(3) . .
N7 Eu1 N10 C16 63.7(4) . .
Eu2 Eu1 N10 C16 -61.6(3) . .
O10 Eu1 N10 C19 128.1(3) . .
O9 Eu1 N10 C19 64.4(3) . .
O5 Eu1 N10 C19 -85.9(3) . .
O2 Eu1 N10 C19 9.1(4) 2_545 .
O7 Eu1 N10 C19 -23.5(3) . .
O2W Eu1 N10 C19 -157.5(3) . .
N7 Eu1 N10 C19 -138.9(3) . .
Eu2 Eu1 N10 C19 95.8(3) . .
C4 N1 C1 C2 -0.9(7) . .
Eu2 N1 C1 C2 176.1(3) . .
C3 N2 C2 C1 1.3(7) . .
N1 C1 C2 N2 0.8(8) . .
C2 N2 C3 N3 178.9(5) . .
C2 N2 C3 C4 -3.0(7) . .
C1 N1 C4 C3 -0.8(6) . .
Eu2 N1 C4 C3 -178.1(3) . .
C1 N1 C4 C5 -178.9(4) . .
Eu2 N1 C4 C5 3.9(5) . .
N3 C3 C4 N1 -179.1(4) . .
N2 C3 C4 N1 2.9(7) . .
N3 C3 C4 C5 -1.3(7) . .
N2 C3 C4 C5 -179.2(4) . .
Eu2 O1 C5 O2 -169.5(3) . .
Eu2 O1 C5 C4 11.2(6) . .
Eu1 O2 C5 O1 20.0(6) 2 .
Eu1 O2 C5 C4 -160.8(3) 2 .
N1 C4 C5 O1 -9.1(6) . .
C3 C4 C5 O1 172.9(4) . .
N1 C4 C5 O2 171.6(4) . .
C3 C4 C5 O2 -6.4(6) . .
C9 N4 C6 C7 0.8(7) . .
Eu2 N4 C6 C7 -155.1(4) . .
C8 N5 C7 C6 -0.6(8) . .
N4 C6 C7 N5 1.4(8) . .
C7 N5 C8 N6 175.8(5) . .
C7 N5 C8 C9 -2.3(7) . .
C6 N4 C9 C8 -3.7(6) . .
Eu2 N4 C9 C8 155.1(3) . .
C6 N4 C9 C10 -179.8(4) . .
Eu2 N4 C9 C10 -21.0(4) . .
N6 C8 C9 N4 -173.4(4) . .
N5 C8 C9 N4 4.6(7) . .
N6 C8 C9 C10 2.3(7) . .
N5 C8 C9 C10 -179.6(4) . .
Eu2 O3 C10 O4 -149.8(3) . .
Eu2 O3 C10 C9 30.8(5) . .
N4 C9 C10 O4 177.4(4) . .
C8 C9 C10 O4 1.4(6) . .
N4 C9 C10 O3 -3.2(6) . .
C8 C9 C10 O3 -179.2(4) . .
N4 C9 C10 Eu2 15.8(3) . .
C8 C9 C10 Eu2 -160.1(4) . .
O9 Eu2 C10 O4 -87.1(6) . .
O10 Eu2 C10 O4 -66.0(6) . .
O1 Eu2 C10 O4 100.4(6) . .
O3 Eu2 C10 O4 64.6(6) . .
O1W Eu2 C10 O4 175.8(6) . .
O6 Eu2 C10 O4 16.2(6) 2_655 .
N4 Eu2 C10 O4 -152.8(7) . .
N1 Eu2 C10 O4 72.4(7) . .
Eu1 Eu2 C10 O4 -75.3(6) . .
O9 Eu2 C10 O3 -151.7(3) . .
O10 Eu2 C10 O3 -130.6(3) . .
O1 Eu2 C10 O3 35.8(3) . .
O1W Eu2 C10 O3 111.2(3) . .
O6 Eu2 C10 O3 -48.4(3) 2_655 .
N4 Eu2 C10 O3 142.6(4) . .
N1 Eu2 C10 O3 7.8(4) . .
Eu1 Eu2 C10 O3 -139.8(3) . .
O9 Eu2 C10 C9 55.9(3) . .
O10 Eu2 C10 C9 77.1(2) . .
O1 Eu2 C10 C9 -116.6(2) . .
O3 Eu2 C10 C9 -152.4(4) . .
O1W Eu2 C10 C9 -41.1(2) . .
O6 Eu2 C10 C9 159.2(2) 2_655 .
N4 Eu2 C10 C9 -9.7(2) . .
N1 Eu2 C10 C9 -144.5(2) . .
Eu1 Eu2 C10 C9 67.8(2) . .
C14 N7 C11 C12 1.2(7) . .
Eu1 N7 C11 C12 -177.7(4) . .
C13 N8 C12 C11 -1.2(8) . .
N7 C11 C12 N8 -0.7(8) . .
C12 N8 C13 N9 -179.0(5) . .
C12 N8 C13 C14 2.6(7) . .
C11 N7 C14 C13 0.2(6) . .
Eu1 N7 C14 C13 179.2(3) . .
C11 N7 C14 C15 179.6(4) . .
Eu1 N7 C14 C15 -1.4(4) . .
N8 C13 C14 N7 -2.2(7) . .
N9 C13 C14 N7 179.5(5) . .
N8 C13 C14 C15 178.5(4) . .
N9 C13 C14 C15 0.2(8) . .
Eu1 O5 C15 O6 163.6(3) . .
Eu1 O5 C15 C14 -17.4(6) . .
Eu2 O6 C15 O5 -17.6(6) 2_645 .
Eu2 O6 C15 C14 163.4(3) 2_645 .
N7 C14 C15 O5 10.8(6) . .
C13 C14 C15 O5 -169.9(4) . .
N7 C14 C15 O6 -170.1(4) . .
C13 C14 C15 O6 9.3(7) . .
C19 N10 C16 C17 -1.2(7) . .
Eu1 N10 C16 C17 155.0(4) . .
C18 N11 C17 C16 0.6(8) . .
N10 C16 C17 N11 -0.4(8) . .
C17 N11 C18 N12 -178.4(5) . .
C17 N11 C18 C19 0.5(7) . .
C16 N10 C19 C18 2.3(6) . .
Eu1 N10 C19 C18 -156.3(3) . .
C16 N10 C19 C20 178.8(4) . .
Eu1 N10 C19 C20 20.3(4) . .
N12 C18 C19 N10 176.9(4) . .
N11 C18 C19 N10 -2.0(7) . .
N12 C18 C19 C20 0.6(7) . .
N11 C18 C19 C20 -178.3(4) . .
Eu1 O7 C20 O8 151.8(3) . .
Eu1 O7 C20 C19 -28.0(5) . .
N10 C19 C20 O8 -177.4(4) . .
C18 C19 C20 O8 -0.9(7) . .
N10 C19 C20 O7 2.4(6) . .
C18 C19 C20 O7 178.8(4) . .
