#------------------------------------------------------------------------------
#$Date: 2016-03-25 15:37:48 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179928 $
#$URL: svn://www.crystallography.net/cod/cif/7/02/23/7022336.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_7022336
loop_
_publ_author_name
'Hou, Yin-Ling'
'Xiong, Gang'
'Shen, Bo'
'Zhao, Bin'
'Chen, Zhi'
'Cui, Jian-Zhong'
_publ_section_title
;
 Structures, luminescent and magnetic properties of six lanthanide-organic
 frameworks: observation of slow magnetic relaxation behavior in the DyIII
 compound.
;
_journal_issue                   10
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              3587
_journal_page_last               3596
_journal_paper_doi               10.1039/c2dt32390g
_journal_volume                  42
_journal_year                    2013
_chemical_formula_sum            'C45 H36 Eu2 O27 S3'
_chemical_formula_weight         1408.84
_chemical_name_systematic
;
?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                102.250(3)
_cell_angle_beta                 101.468(3)
_cell_angle_gamma                104.507(3)
_cell_formula_units_Z            2
_cell_length_a                   9.2706(3)
_cell_length_b                   15.6634(7)
_cell_length_c                   22.3100(8)
_cell_measurement_reflns_used    7045
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      29.1738
_cell_measurement_theta_min      2.4357
_cell_volume                     2954.2(2)
_computing_cell_refinement
;
CrysAlisPro, Oxford Diffraction Ltd.,
Version 1.171.34.44 (release 25-10-2010 CrysAlis171 .NET)
(compiled Oct 25 2010,18:11:34)
;
_computing_data_collection
;
CrysAlisPro, Oxford Diffraction Ltd.,
Version 1.171.34.44 (release 25-10-2010 CrysAlis171 .NET)
(compiled Oct 25 2010,18:11:34)
;
_computing_data_reduction
;
CrysAlisPro, Oxford Diffraction Ltd.,
Version 1.171.34.44 (release 25-10-2010 CrysAlis171 .NET)
(compiled Oct 25 2010,18:11:34)
;
_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      293(2)
_diffrn_detector_area_resol_mean 16.2116
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'SuperNova, Single source at offset), Eos'
_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  0.0474
_diffrn_reflns_av_sigmaI/netI    0.0937
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            19427
_diffrn_reflns_theta_full        25.01
_diffrn_reflns_theta_max         25.01
_diffrn_reflns_theta_min         2.44
_exptl_absorpt_coefficient_mu    2.289
_exptl_absorpt_correction_T_max  0.6574
_exptl_absorpt_correction_T_min  0.6574
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro, Oxford Diffraction Ltd.,
Version 1.171.34.44 (release 25-10-2010 CrysAlis171 .NET)
(compiled Oct 25 2010,18:11:34)
Empirical absorption correction using spherical harmonics,
implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.584
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       needle
_exptl_crystal_F_000             1392
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.20
_platon_squeeze_details
;
;
_refine_diff_density_max         1.971
_refine_diff_density_min         -0.883
_refine_diff_density_rms         0.132
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.987
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     700
_refine_ls_number_reflns         10382
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.987
_refine_ls_R_factor_all          0.0686
_refine_ls_R_factor_gt           0.0467
_refine_ls_shift/su_max          0.031
_refine_ls_shift/su_mean         0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0346P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0941
_refine_ls_wR_factor_ref         0.1013
_reflns_number_gt                7563
_reflns_number_total             10382
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c2dt32390g.txt
_cod_data_source_block           2
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'none' was changed to '?' - the
value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_original_cell_volume        2954.21(19)
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7022336
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
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 0.51437(4) 0.36033(2) 0.802130(15) 0.02194(10) Uani 1 1 d .
Eu2 Eu 0.02952(3) 0.41202(2) 0.856588(15) 0.01951(10) Uani 1 1 d .
C1 C 0.2065(7) 0.2422(5) 0.8548(3) 0.0220(15) Uani 1 1 d .
C2 C 0.1745(7) 0.1491(5) 0.8677(3) 0.0261(17) Uani 1 1 d .
C3 C 0.2574(8) 0.0910(5) 0.8504(3) 0.039(2) Uani 1 1 d .
H3 H 0.3378 0.1096 0.8322 0.046 Uiso 1 1 calc R
C4 C 0.2205(9) 0.0045(6) 0.8601(4) 0.047(2) Uani 1 1 d .
H4 H 0.2740 -0.0359 0.8474 0.056 Uiso 1 1 calc R
C5 C 0.1037(8) -0.0215(5) 0.8890(3) 0.0353(19) Uani 1 1 d .
C6 C 0.0214(8) 0.0368(5) 0.9070(3) 0.0353(19) Uani 1 1 d .
H6 H -0.0575 0.0190 0.9261 0.042 Uiso 1 1 calc R
C7 C 0.0586(8) 0.1221(5) 0.8962(3) 0.0341(19) Uani 1 1 d .
H7 H 0.0042 0.1622 0.9084 0.041 Uiso 1 1 calc R
C8 C 0.2718(8) -0.1672(5) 0.9806(3) 0.0360(19) Uani 1 1 d .
C9 C 0.4121(9) -0.1566(6) 0.9654(3) 0.044(2) Uani 1 1 d .
C10 C 0.5000(8) -0.2114(6) 0.9844(3) 0.041(2) Uani 1 1 d .
H10 H 0.5940 -0.2067 0.9746 0.049 Uiso 1 1 calc R
C11 C 0.4484(7) -0.2730(5) 1.0181(3) 0.0337(19) Uani 1 1 d .
H11 H 0.5092 -0.3082 1.0311 0.040 Uiso 1 1 calc R
C12 C 0.3084(7) -0.2822(5) 1.0321(3) 0.0228(15) Uani 1 1 d .
C13 C 0.2219(7) -0.2277(5) 1.0126(3) 0.0306(18) Uani 1 1 d .
H13 H 0.1270 -0.2330 1.0218 0.037 Uiso 1 1 calc R
C14 C 0.6049(10) -0.0763(8) 0.9236(4) 0.089(4) Uani 1 1 d .
H14A H 0.6135 -0.1319 0.8986 0.134 Uiso 1 1 calc R
H14B H 0.6822 -0.0555 0.9637 0.134 Uiso 1 1 calc R
H14C H 0.6199 -0.0301 0.9013 0.134 Uiso 1 1 calc R
C15 C 0.2513(7) -0.3458(5) 1.0694(3) 0.0261(16) Uani 1 1 d .
C16 C -0.2992(8) 0.2269(5) 0.7884(3) 0.0293(17) Uani 1 1 d .
C17 C -0.2495(7) 0.1431(5) 0.7708(3) 0.0254(16) Uani 1 1 d .
C18 C -0.1297(7) 0.1411(5) 0.7416(3) 0.0297(17) Uani 1 1 d .
H18 H -0.0768 0.1939 0.7330 0.036 Uiso 1 1 calc R
C19 C -0.0888(8) 0.0635(5) 0.7257(3) 0.0369(19) Uani 1 1 d .
H19 H -0.0078 0.0640 0.7068 0.044 Uiso 1 1 calc R
C20 C -0.1677(8) -0.0165(5) 0.7373(3) 0.0349(18) Uani 1 1 d .
C21 C -0.2868(7) -0.0143(5) 0.7659(3) 0.0295(17) Uani 1 1 d .
C22 C -0.3283(7) 0.0633(5) 0.7826(3) 0.0281(17) Uani 1 1 d .
H22 H -0.4088 0.0626 0.8017 0.034 Uiso 1 1 calc R
C23 C -0.0188(10) -0.1051(6) 0.6928(5) 0.073(3) Uani 1 1 d .
H23A H -0.0662 -0.1424 0.6498 0.109 Uiso 1 1 calc R
H23B H 0.0488 -0.1329 0.7145 0.109 Uiso 1 1 calc R
H23C H 0.0396 -0.0452 0.6927 0.109 Uiso 1 1 calc R
C24 C -0.5530(8) -0.2479(5) 0.7626(3) 0.0340(18) Uani 1 1 d .
C25 C -0.4549(8) -0.3005(6) 0.7606(4) 0.049(2) Uani 1 1 d .
H25 H -0.3770 -0.2900 0.7400 0.059 Uiso 1 1 calc R
C26 C -0.4765(8) -0.3699(5) 0.7907(4) 0.039(2) Uani 1 1 d .
H26 H -0.4109 -0.4062 0.7904 0.047 Uiso 1 1 calc R
C27 C -0.5924(7) -0.3866(5) 0.8209(3) 0.0240(15) Uani 1 1 d .
C28 C -0.6900(7) -0.3326(5) 0.8212(3) 0.0326(18) Uani 1 1 d .
H28 H -0.7678 -0.3431 0.8419 0.039 Uiso 1 1 calc R
C29 C -0.6735(7) -0.2637(5) 0.7914(4) 0.0368(19) Uani 1 1 d .
H29 H -0.7408 -0.2285 0.7906 0.044 Uiso 1 1 calc R
C30 C -0.6112(7) -0.4617(5) 0.8538(3) 0.0257(16) Uani 1 1 d .
C31 C 0.1697(7) 0.3764(5) 0.7229(3) 0.0225(15) Uani 1 1 d .
C32 C 0.0903(7) 0.3764(5) 0.6585(3) 0.0243(16) Uani 1 1 d .
C33 C -0.0724(7) 0.3514(5) 0.6377(3) 0.0368(19) Uani 1 1 d .
H33 H -0.1306 0.3350 0.6653 0.044 Uiso 1 1 calc R
C34 C -0.1458(8) 0.3510(6) 0.5788(3) 0.042(2) Uani 1 1 d .
H34 H -0.2531 0.3347 0.5668 0.050 Uiso 1 1 calc R
C35 C -0.0640(8) 0.3742(5) 0.5361(3) 0.039(2) Uani 1 1 d .
C36 C 0.0939(8) 0.3981(5) 0.5560(3) 0.0342(18) Uani 1 1 d .
C37 C 0.1736(7) 0.3991(5) 0.6157(3) 0.0297(17) Uani 1 1 d .
H37 H 0.2809 0.4146 0.6270 0.036 Uiso 1 1 calc R
C38 C -0.2901(10) 0.3498(7) 0.4528(4) 0.081(3) Uani 1 1 d .
H38A H -0.3178 0.3572 0.4109 0.121 Uiso 1 1 calc R
H38B H -0.3318 0.3866 0.4806 0.121 Uiso 1 1 calc R
H38C H -0.3314 0.2865 0.4513 0.121 Uiso 1 1 calc R
C39 C 0.2150(8) 0.3929(6) 0.4013(3) 0.0347(19) Uani 1 1 d .
C40 C 0.3473(8) 0.4429(6) 0.3919(3) 0.048(2) Uani 1 1 d .
H40 H 0.4423 0.4532 0.4202 0.057 Uiso 1 1 calc R
C41 C 0.3395(8) 0.4790(6) 0.3391(3) 0.038(2) Uani 1 1 d .
H41 H 0.4297 0.5127 0.3323 0.046 Uiso 1 1 calc R
C42 C 0.1992(7) 0.4645(5) 0.2979(3) 0.0225(15) Uani 1 1 d .
C43 C 0.0666(8) 0.4152(6) 0.3093(3) 0.041(2) Uani 1 1 d .
H43 H -0.0290 0.4050 0.2814 0.049 Uiso 1 1 calc R
C44 C 0.0742(8) 0.3806(6) 0.3620(3) 0.045(2) Uani 1 1 d .
H44 H -0.0158 0.3495 0.3703 0.054 Uiso 1 1 calc R
C45 C 0.1899(8) 0.5048(5) 0.2418(3) 0.0274(16) Uani 1 1 d .
O1 O 0.3085(5) 0.2629(4) 0.8251(2) 0.0395(13) Uani 1 1 d .
O2 O 0.1300(5) 0.2925(3) 0.8732(2) 0.0345(12) Uani 1 1 d .
O3 O 0.0865(6) -0.1965(4) 0.8557(2) 0.0477(14) Uani 1 1 d .
O4 O -0.0868(6) -0.1514(4) 0.9171(3) 0.0700(19) Uani 1 1 d .
O5 O 0.1915(7) -0.1051(4) 0.9683(2) 0.0587(17) Uani 1 1 d .
O6 O 0.4544(7) -0.0934(4) 0.9347(3) 0.0624(17) Uani 1 1 d .
O7 O 0.3411(5) -0.3854(3) 1.0940(2) 0.0338(12) Uani 1 1 d .
O8 O 0.1203(5) -0.3541(4) 1.0757(2) 0.0451(15) Uani 1 1 d .
O9 O -0.2142(5) 0.3052(3) 0.7896(2) 0.0346(12) Uani 1 1 d .
O10 O -0.4283(5) 0.2169(3) 0.8011(2) 0.0413(13) Uani 1 1 d .
O11 O -0.1361(6) -0.0973(4) 0.7249(3) 0.0552(16) Uani 1 1 d .
O12 O -0.3646(5) -0.0949(3) 0.7788(2) 0.0365(12) Uani 1 1 d .
O13 O -0.4990(7) -0.1805(4) 0.6680(3) 0.0696(19) Uani 1 1 d .
O14 O -0.6360(6) -0.1089(4) 0.7362(3) 0.076(2) Uani 1 1 d .
O15 O -0.5030(5) -0.4984(3) 0.8622(2) 0.0273(11) Uani 1 1 d .
O16 O -0.7301(5) -0.4824(3) 0.8722(2) 0.0338(12) Uani 1 1 d .
O17 O 0.3121(5) 0.3895(4) 0.7355(2) 0.0374(13) Uani 1 1 d .
O18 O 0.0897(5) 0.3611(4) 0.7615(2) 0.0359(13) Uani 1 1 d .
O19 O -0.1242(6) 0.3784(4) 0.4764(2) 0.0541(16) Uani 1 1 d .
O21 O 0.1824(6) 0.4254(4) 0.5139(2) 0.0479(14) Uani 1 1 d .
O22 O 0.3835(7) 0.3566(5) 0.4947(3) 0.081(2) Uani 1 1 d .
O23 O 0.1095(7) 0.2637(4) 0.4526(2) 0.0607(17) Uani 1 1 d .
O24 O 0.0597(5) 0.5009(3) 0.2107(2) 0.0313(12) Uani 1 1 d .
O25 O 0.3158(5) 0.5366(3) 0.2293(2) 0.0355(13) Uani 1 1 d .
O26 O 0.1845(6) 0.4490(4) 0.9722(2) 0.0553(16) Uani 1 1 d .
H26A H 0.1587 0.4020 0.9857 0.083 Uiso 1 1 d R
H26B H 0.2806 0.4630 0.9743 0.083 Uiso 1 1 d R
O27 O 0.0013(6) 0.5504(4) 0.9235(2) 0.0511(15) Uani 1 1 d .
H27A H -0.0210 0.5849 0.9001 0.077 Uiso 1 1 d R
H27B H -0.0719 0.5352 0.9412 0.077 Uiso 1 1 d R
O28 O 0.4486(7) 0.2619(5) 0.6913(2) 0.070(2) Uani 1 1 d .
H28A H 0.3651 0.2134 0.6830 0.105 Uiso 1 1 d R
H28B H 0.4284 0.2933 0.6632 0.105 Uiso 1 1 d R
S1 S -0.5254(2) -0.15584(15) 0.72837(11) 0.0461(6) Uani 1 1 d .
S2 S 0.0599(2) -0.13065(15) 0.90260(10) 0.0420(5) Uani 1 1 d .
S3 S 0.2259(3) 0.34882(18) 0.46750(9) 0.0478(6) Uani 1 1 d .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Eu Eu -0.1578 3.6682 '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'
S S 0.1246 0.1234 '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
O25 Eu1 O7 99.23(16) 2_666 2_657
O25 Eu1 O1 170.47(14) 2_666 .
O7 Eu1 O1 88.08(17) 2_657 .
O25 Eu1 O17 88.01(15) 2_666 .
O7 Eu1 O17 146.69(17) 2_657 .
O1 Eu1 O17 82.54(15) . .
O25 Eu1 O15 79.50(16) 2_666 1_665
O7 Eu1 O15 73.88(15) 2_657 1_665
O1 Eu1 O15 96.84(16) . 1_665
O17 Eu1 O15 75.61(16) . 1_665
O25 Eu1 O10 114.99(16) 2_666 1_655
O7 Eu1 O10 76.24(16) 2_657 1_655
O1 Eu1 O10 72.56(16) . 1_655
O17 Eu1 O10 129.80(17) . 1_655
O15 Eu1 O10 148.59(15) 1_665 1_655
O25 Eu1 O28 85.5(2) 2_666 .
O7 Eu1 O28 143.72(17) 2_657 .
O1 Eu1 O28 92.3(2) . .
O17 Eu1 O28 68.86(17) . .
O15 Eu1 O28 141.76(17) 1_665 .
O10 Eu1 O28 69.35(19) 1_655 .
O25 Eu1 O9 67.93(14) 2_666 1_655
O7 Eu1 O9 74.64(14) 2_657 1_655
O1 Eu1 O9 120.33(14) . 1_655
O17 Eu1 O9 137.02(14) . 1_655
O15 Eu1 O9 129.58(14) 1_665 1_655
O10 Eu1 O9 48.03(14) 1_655 1_655
O28 Eu1 O9 74.01(15) . 1_655
O25 Eu1 C16 91.47(18) 2_666 1_655
O7 Eu1 C16 76.46(17) 2_657 1_655
O1 Eu1 C16 96.21(18) . 1_655
O17 Eu1 C16 136.19(18) . 1_655
O15 Eu1 C16 147.05(16) 1_665 1_655
O10 Eu1 C16 23.64(16) 1_655 1_655
O28 Eu1 C16 67.43(17) . 1_655
O9 Eu1 C16 24.62(15) 1_655 1_655
O16 Eu2 O18 78.28(17) 1_665 .
O16 Eu2 O2 94.76(16) 1_665 .
O18 Eu2 O2 76.89(16) . .
O16 Eu2 O24 83.62(15) 1_665 2_566
O18 Eu2 O24 74.85(16) . 2_566
O2 Eu2 O24 151.43(16) . 2_566
O16 Eu2 O8 135.75(17) 1_665 2_557
O18 Eu2 O8 140.13(19) . 2_557
O2 Eu2 O8 79.63(16) . 2_557
O24 Eu2 O8 120.84(15) 2_566 2_557
O16 Eu2 O9 152.41(16) 1_665 .
O18 Eu2 O9 77.35(16) . .
O2 Eu2 O9 92.14(16) . .
O24 Eu2 O9 77.70(15) 2_566 .
O8 Eu2 O9 71.80(16) 2_557 .
O16 Eu2 O27 78.99(18) 1_665 .
O18 Eu2 O27 140.80(18) . .
O2 Eu2 O27 136.61(16) . .
O24 Eu2 O27 71.23(16) 2_566 .
O8 Eu2 O27 76.10(19) 2_557 .
O9 Eu2 O27 113.15(16) . .
O16 Eu2 O26 70.87(18) 1_665 .
O18 Eu2 O26 131.07(16) . .
O2 Eu2 O26 69.10(17) . .
O24 Eu2 O26 135.30(17) 2_566 .
O8 Eu2 O26 66.13(17) 2_557 .
O9 Eu2 O26 136.16(17) . .
O27 Eu2 O26 68.32(17) . .
O2 C1 O1 124.8(6) . .
O2 C1 C2 117.6(6) . .
O1 C1 C2 117.5(6) . .
C3 C2 C7 119.9(6) . .
C3 C2 C1 120.9(6) . .
C7 C2 C1 119.2(6) . .
C2 C3 C4 119.6(7) . .
C2 C3 H3 120.2 . .
C4 C3 H3 120.2 . .
C5 C4 C3 119.7(7) . .
C5 C4 H4 120.1 . .
C3 C4 H4 120.1 . .
C6 C5 C4 120.9(7) . .
C6 C5 S2 119.6(6) . .
C4 C5 S2 119.5(6) . .
C5 C6 C7 118.5(6) . .
C5 C6 H6 120.8 . .
C7 C6 H6 120.8 . .
C2 C7 C6 121.4(6) . .
C2 C7 H7 119.3 . .
C6 C7 H7 119.3 . .
C13 C8 C9 121.6(6) . .
C13 C8 O5 120.4(6) . .
C9 C8 O5 117.5(6) . .
O6 C9 C8 117.7(7) . .
O6 C9 C10 125.0(7) . .
C8 C9 C10 117.3(7) . .
C11 C10 C9 120.7(6) . .
C11 C10 H10 119.7 . .
C9 C10 H10 119.7 . .
C12 C11 C10 120.6(6) . .
C12 C11 H11 119.7 . .
C10 C11 H11 119.7 . .
C11 C12 C13 118.1(6) . .
C11 C12 C15 122.0(6) . .
C13 C12 C15 119.9(6) . .
C8 C13 C12 121.7(6) . .
C8 C13 H13 119.2 . .
C12 C13 H13 119.1 . .
O6 C14 H14A 109.5 . .
O6 C14 H14B 109.5 . .
H14A C14 H14B 109.5 . .
O6 C14 H14C 109.5 . .
H14A C14 H14C 109.5 . .
H14B C14 H14C 109.5 . .
O8 C15 O7 124.1(6) . .
O8 C15 C12 117.2(6) . .
O7 C15 C12 118.6(6) . .
O10 C16 O9 121.5(6) . .
O10 C16 C17 117.8(6) . .
O9 C16 C17 120.6(6) . .
O10 C16 Eu1 50.5(3) . 1_455
O9 C16 Eu1 71.9(4) . 1_455
C17 C16 Eu1 164.2(5) . 1_455
C22 C17 C18 118.5(6) . .
C22 C17 C16 118.6(6) . .
C18 C17 C16 122.9(6) . .
C19 C18 C17 121.4(7) . .
C19 C18 H18 119.3 . .
C17 C18 H18 119.3 . .
C18 C19 C20 120.2(7) . .
C18 C19 H19 119.9 . .
C20 C19 H19 119.9 . .
O11 C20 C21 116.0(7) . .
O11 C20 C19 125.8(7) . .
C21 C20 C19 118.2(7) . .
C22 C21 C20 122.2(7) . .
C22 C21 O12 119.6(6) . .
C20 C21 O12 118.1(6) . .
C21 C22 C17 119.5(6) . .
C21 C22 H22 120.2 . .
C17 C22 H22 120.2 . .
O11 C23 H23A 109.5 . .
O11 C23 H23B 109.5 . .
H23A C23 H23B 109.5 . .
O11 C23 H23C 109.5 . .
H23A C23 H23C 109.5 . .
H23B C23 H23C 109.5 . .
C25 C24 C29 122.6(7) . .
C25 C24 S1 119.3(6) . .
C29 C24 S1 118.1(5) . .
C24 C25 C26 117.4(7) . .
C24 C25 H25 121.3 . .
C26 C25 H25 121.3 . .
C27 C26 C25 121.8(6) . .
C27 C26 H26 119.1 . .
C25 C26 H26 119.1 . .
C26 C27 C28 119.1(6) . .
C26 C27 C30 120.4(6) . .
C28 C27 C30 120.5(6) . .
C29 C28 C27 121.0(6) . .
C29 C28 H28 119.5 . .
C27 C28 H28 119.5 . .
C28 C29 C24 118.1(6) . .
C28 C29 H29 120.9 . .
C24 C29 H29 120.9 . .
O16 C30 O15 124.5(6) . .
O16 C30 C27 117.4(6) . .
O15 C30 C27 118.1(6) . .
O17 C31 O18 123.7(6) . .
O17 C31 C32 117.7(6) . .
O18 C31 C32 118.5(5) . .
C37 C32 C33 117.7(6) . .
C37 C32 C31 121.0(5) . .
C33 C32 C31 121.3(6) . .
C34 C33 C32 121.6(6) . .
C34 C33 H33 119.2 . .
C32 C33 H33 119.2 . .
C33 C34 C35 121.1(6) . .
C33 C34 H34 119.4 . .
C35 C34 H34 119.4 . .
O19 C35 C36 116.0(7) . .
O19 C35 C34 126.5(6) . .
C36 C35 C34 117.4(6) . .
C35 C36 C37 123.4(6) . .
C35 C36 O21 119.0(6) . .
C37 C36 O21 117.6(6) . .
C36 C37 C32 118.8(6) . .
C36 C37 H37 120.6 . .
C32 C37 H37 120.6 . .
O19 C38 H38A 109.5 . .
O19 C38 H38B 109.5 . .
H38A C38 H38B 109.5 . .
O19 C38 H38C 109.5 . .
H38A C38 H38C 109.5 . .
H38B C38 H38C 109.5 . .
C40 C39 C44 121.0(6) . .
C40 C39 S3 119.2(5) . .
C44 C39 S3 119.6(5) . .
C39 C40 C41 119.6(6) . .
C39 C40 H40 120.2 . .
C41 C40 H40 120.2 . .
C42 C41 C40 120.0(7) . .
C42 C41 H41 120.0 . .
C40 C41 H41 120.0 . .
C41 C42 C43 119.1(6) . .
C41 C42 C45 120.3(6) . .
C43 C42 C45 120.6(6) . .
C42 C43 C44 120.8(6) . .
C42 C43 H43 119.6 . .
C44 C43 H43 119.6 . .
C39 C44 C43 119.3(7) . .
C39 C44 H44 120.4 . .
C43 C44 H44 120.4 . .
O24 C45 O25 125.5(6) . .
O24 C45 C42 118.1(6) . .
O25 C45 C42 116.3(6) . .
C1 O1 Eu1 155.5(5) . .
C1 O2 Eu2 145.6(4) . .
C8 O5 S2 120.2(5) . .
C9 O6 C14 118.1(7) . .
C15 O7 Eu1 132.7(4) . 2_657
C15 O8 Eu2 137.1(4) . 2_557
C16 O9 Eu2 135.9(4) . .
C16 O9 Eu1 83.5(4) . 1_455
Eu2 O9 Eu1 115.40(18) . 1_455
C16 O10 Eu1 105.9(4) . 1_455
C20 O11 C23 118.6(6) . .
C21 O12 S1 116.2(4) . .
C30 O15 Eu1 129.6(4) . 1_445
C30 O16 Eu2 147.3(5) . 1_445
C31 O17 Eu1 142.2(4) . .
C31 O18 Eu2 149.3(5) . .
C35 O19 C38 117.6(6) . .
C36 O21 S3 118.6(5) . .
C45 O24 Eu2 133.7(4) . 2_566
C45 O25 Eu1 154.1(4) . 2_666
Eu2 O26 H26A 109.0 . .
Eu2 O26 H26B 109.4 . .
H26A O26 H26B 109.5 . .
Eu2 O27 H27A 109.3 . .
Eu2 O27 H27B 109.9 . .
H27A O27 H27B 109.0 . .
Eu1 O28 H28A 111.8 . .
Eu1 O28 H28B 110.9 . .
H28A O28 H28B 107.3 . .
O13 S1 O14 119.1(4) . .
O13 S1 O12 108.7(3) . .
O14 S1 O12 107.7(4) . .
O13 S1 C24 111.9(4) . .
O14 S1 C24 110.9(4) . .
O12 S1 C24 95.7(3) . .
O3 S2 O4 118.6(4) . .
O3 S2 O5 109.7(3) . .
O4 S2 O5 107.3(4) . .
O3 S2 C5 112.1(3) . .
O4 S2 C5 109.3(3) . .
O5 S2 C5 97.7(3) . .
O23 S3 O22 120.0(4) . .
O23 S3 O21 109.3(3) . .
O22 S3 O21 107.2(4) . .
O23 S3 C39 110.3(4) . .
O22 S3 C39 109.0(3) . .
O21 S3 C39 98.9(3) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Eu1 O25 2.286(4) 2_666
Eu1 O7 2.332(4) 2_657
Eu1 O1 2.345(5) .
Eu1 O17 2.354(4) .
Eu1 O15 2.393(5) 1_665
Eu1 O10 2.432(5) 1_655
Eu1 O28 2.485(5) .
Eu1 O9 2.902(4) 1_655
Eu1 C16 3.033(7) 1_655
Eu2 O16 2.329(4) 1_665
Eu2 O18 2.329(4) .
Eu2 O2 2.354(4) .
Eu2 O24 2.395(4) 2_566
Eu2 O8 2.411(5) 2_557
Eu2 O9 2.417(5) .
Eu2 O27 2.461(5) .
Eu2 O26 2.555(5) .
C1 O2 1.246(7) .
C1 O1 1.274(7) .
C1 C2 1.516(9) .
C2 C3 1.373(9) .
C2 C7 1.377(8) .
C3 C4 1.387(10) .
C3 H3 0.9300 .
C4 C5 1.385(9) .
C4 H4 0.9300 .
C5 C6 1.375(9) .
C5 S2 1.762(7) .
C6 C7 1.378(9) .
C6 H6 0.9300 .
C7 H7 0.9300 .
C8 C13 1.350(9) .
C8 C9 1.387(9) .
C8 O5 1.405(8) .
C9 O6 1.344(8) .
C9 C10 1.395(10) .
C10 C11 1.393(9) .
C10 H10 0.9300 .
C11 C12 1.375(8) .
C11 H11 0.9300 .
C12 C13 1.386(8) .
C12 C15 1.492(9) .
C13 H13 0.9300 .
C14 O6 1.435(9) .
C14 H14A 0.9600 .
C14 H14B 0.9600 .
C14 H14C 0.9600 .
C15 O8 1.229(7) .
C15 O7 1.265(7) .
C16 O10 1.264(7) .
C16 O9 1.271(8) .
C16 C17 1.499(9) .
C16 Eu1 3.033(7) 1_455
C17 C22 1.387(9) .
C17 C18 1.398(8) .
C18 C19 1.360(9) .
C18 H18 0.9300 .
C19 C20 1.388(10) .
C19 H19 0.9300 .
C20 O11 1.354(8) .
C20 C21 1.383(9) .
C21 C22 1.365(9) .
C21 O12 1.406(8) .
C22 H22 0.9300 .
C23 O11 1.431(9) .
C23 H23A 0.9600 .
C23 H23B 0.9600 .
C23 H23C 0.9600 .
C24 C25 1.372(9) .
C24 C29 1.393(9) .
C24 S1 1.757(7) .
C25 C26 1.387(9) .
C25 H25 0.9300 .
C26 C27 1.378(8) .
C26 H26 0.9300 .
C27 C28 1.384(8) .
C27 C30 1.507(9) .
C28 C29 1.376(9) .
C28 H28 0.9300 .
C29 H29 0.9300 .
C30 O16 1.244(7) .
C30 O15 1.276(7) .
C31 O17 1.247(7) .
C31 O18 1.266(7) .
C31 C32 1.479(8) .
C32 C37 1.390(8) .
C32 C33 1.412(8) .
C33 C34 1.353(9) .
C33 H33 0.9300 .
C34 C35 1.381(10) .
C34 H34 0.9300 .
C35 O19 1.360(8) .
C35 C36 1.370(9) .
C36 C37 1.384(8) .
C36 O21 1.427(8) .
C37 H37 0.9300 .
C38 O19 1.440(9) .
C38 H38A 0.9600 .
C38 H38B 0.9600 .
C38 H38C 0.9600 .
C39 C40 1.361(9) .
C39 C44 1.362(9) .
C39 S3 1.755(6) .
C40 C41 1.406(9) .
C40 H40 0.9300 .
C41 C42 1.370(8) .
C41 H41 0.9300 .
C42 C43 1.380(9) .
C42 C45 1.513(8) .
C43 C44 1.392(8) .
C43 H43 0.9300 .
C44 H44 0.9300 .
C45 O24 1.247(7) .
C45 O25 1.259(7) .
O3 S2 1.410(5) .
O4 S2 1.434(5) .
O5 S2 1.610(5) .
O7 Eu1 2.332(4) 2_657
O8 Eu2 2.411(5) 2_557
O9 Eu1 2.902(4) 1_455
O10 Eu1 2.432(5) 1_455
O12 S1 1.601(5) .
O13 S1 1.407(6) .
O14 S1 1.420(6) .
O15 Eu1 2.393(4) 1_445
O16 Eu2 2.329(4) 1_445
O21 S3 1.598(6) .
O22 S3 1.430(5) .
O23 S3 1.415(6) .
O24 Eu2 2.395(4) 2_566
O25 Eu1 2.286(4) 2_666
O26 H26A 0.8514 .
O26 H26B 0.8515 .
O27 H27A 0.8599 .
O27 H27B 0.8598 .
O28 H28A 0.8938 .
O28 H28B 0.8934 .
loop_
_platon_squeeze_void_nr
_platon_squeeze_void_average_x
_platon_squeeze_void_average_y
_platon_squeeze_void_average_z
_platon_squeeze_void_volume
_platon_squeeze_void_count_electrons
_platon_squeeze_void_content
1 0.020 0.000 0.500 514 52 ' '
2 0.214 0.320 0.058 33 1 ' '
3 0.500 0.500 0.000 18 8 ' '
4 0.786 0.680 0.941 33 1 ' '
