#------------------------------------------------------------------------------
#$Date: 2016-08-07 11:11:55 +0300 (Sun, 07 Aug 2016) $
#$Revision: 185183 $
#$URL: svn://www.crystallography.net/cod/cif/7/22/54/7225479.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_7225479
loop_
_publ_author_name
'Wang, Haijun'
'Cheng, Fujun'
'Zou, Changchang'
'Li, Qianqian'
'Hua, Yinying'
'Duan, Jingui'
'Jin, Wanqin'
_publ_section_title
;
 Design and synthesis of luminescent porous coordination polymers for
 chromaticity modulation, sensing of nitrobenzene and iodine encapsulation
;
_journal_issue                   30
_journal_name_full               CrystEngComm
_journal_page_first              5639
_journal_paper_doi               10.1039/C6CE00960C
_journal_volume                  18
_journal_year                    2016
_chemical_formula_sum            'C21 H15 Eu O8'
_chemical_formula_weight         547.29
_chemical_name_systematic
;
 ?
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_Hall           '-C 2yc'
_space_group_name_H-M_alt        'C 1 2/c 1'
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   mixed
_audit_creation_method           SHELXL-2013
_audit_update_record
;
2016-02-18 deposited with the CCDC.
2016-06-03 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 101.739(15)
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   33.02(5)
_cell_length_b                   13.317(19)
_cell_length_c                   14.22(2)
_cell_measurement_temperature    296(2)
_cell_volume                     6122(15)
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2013)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.975
_diffrn_measured_fraction_theta_max 0.996
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0788
_diffrn_reflns_av_unetI/netI     0.0813
_diffrn_reflns_Laue_measured_fraction_full 0.975
_diffrn_reflns_Laue_measured_fraction_max 0.996
_diffrn_reflns_limit_h_max       39
_diffrn_reflns_limit_h_min       -33
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            18259
_diffrn_reflns_point_group_measured_fraction_full 0.975
_diffrn_reflns_point_group_measured_fraction_max 0.996
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.047
_diffrn_reflns_theta_min         1.260
_exptl_absorpt_coefficient_mu    2.079
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   sadabs
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.187
_exptl_crystal_description       block
_exptl_crystal_F_000             2144
_exptl_crystal_size_max          0.100
_exptl_crystal_size_mid          0.080
_exptl_crystal_size_min          0.060
_refine_diff_density_max         2.373
_refine_diff_density_min         -2.344
_refine_diff_density_rms         0.163
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.019
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     271
_refine_ls_number_reflns         5406
_refine_ls_number_restraints     437
_refine_ls_restrained_S_all      1.015
_refine_ls_R_factor_all          0.0886
_refine_ls_R_factor_gt           0.0651
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
;
 w=1/[σ²(Fo²)+(0.1105P)²]
 where P=(Fo²+2Fc²)/3
;
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1721
_refine_ls_wR_factor_ref         0.1891
_reflns_Friedel_coverage         0.000
_reflns_number_gt                3539
_reflns_number_total             5406
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c6ce00960c2.cif
_cod_data_source_block           as
_cod_depositor_comments
'Adding full bibliography for 7225479--7225485.cif.'
_cod_original_cell_volume        6123(15)
_cod_database_code               7225479
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_min   0.819
_shelx_estimated_absorpt_t_max   0.885
_shelxl_version_number           2013-2
loop_
_space_group_symop_operation_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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
C1 C 1.1168(3) 0.7505(10) 0.5039(7) 0.0588(19) Uani 1 1 d . U
C2 C 1.0781(3) 0.7739(8) 0.5405(8) 0.063(2) Uani 1 1 d . U
C3 C 1.0697(3) 0.8712(9) 0.5654(7) 0.065(2) Uani 1 1 d . U
H3 H 1.0882 0.9228 0.5608 0.079 Uiso 1 1 calc R U
C4 C 1.0336(3) 0.8910(9) 0.5974(7) 0.066(2) Uani 1 1 d . U
H4 H 1.0293 0.9559 0.6175 0.080 Uiso 1 1 calc R U
C5 C 1.0043(3) 0.8219(8) 0.6010(7) 0.061(2) Uani 1 1 d . U
C6 C 1.0128(4) 0.7297(10) 0.5786(10) 0.086(3) Uani 1 1 d . U
H6 H 0.9932 0.6805 0.5826 0.103 Uiso 1 1 calc R U
C7 C 1.0495(4) 0.6988(10) 0.5488(10) 0.085(3) Uani 1 1 d . U
H7 H 1.0542 0.6319 0.5355 0.102 Uiso 1 1 calc R U
C8 C 0.9649(3) 0.8490(9) 0.6291(7) 0.059(2) Uani 1 1 d . U
C9 C 0.9492(3) 0.9440(9) 0.6202(7) 0.063(2) Uani 1 1 d . U
H9 H 0.9649 0.9955 0.6016 0.076 Uiso 1 1 calc R U
C10 C 0.9106(3) 0.9655(8) 0.6382(6) 0.056(2) Uani 1 1 d . U
H10 H 0.9004 1.0307 0.6291 0.067 Uiso 1 1 calc R U
C11 C 0.8869(3) 0.8932(8) 0.6693(6) 0.0499(18) Uani 1 1 d . U
C12 C 0.9033(3) 0.7976(8) 0.6814(7) 0.059(2) Uani 1 1 d . U
H12 H 0.8882 0.7477 0.7046 0.071 Uiso 1 1 calc R U
C13 C 0.9408(3) 0.7734(9) 0.6606(8) 0.066(2) Uani 1 1 d . U
H13 H 0.9504 0.7076 0.6672 0.079 Uiso 1 1 calc R U
C14 C 0.8444(3) 0.9136(7) 0.6827(6) 0.0457(17) Uani 1 1 d . U
C15 C 0.8200(2) 0.9853(7) 0.6277(6) 0.0450(18) Uani 1 1 d . U
H15 H 0.8311 1.0253 0.5857 0.054 Uiso 1 1 calc R U
C16 C 0.7791(2) 0.9980(7) 0.6346(6) 0.0451(17) Uani 1 1 d . U
C17 C 0.7633(3) 0.9420(7) 0.7014(6) 0.0475(18) Uani 1 1 d . U
H17 H 0.7357 0.9491 0.7055 0.057 Uiso 1 1 calc R U
C18 C 0.7879(3) 0.8775(7) 0.7604(5) 0.0477(18) Uani 1 1 d . U
C19 C 0.8278(3) 0.8593(7) 0.7500(6) 0.0482(19) Uani 1 1 d . U
H19 H 0.8437 0.8109 0.7878 0.058 Uiso 1 1 calc R U
C20 C 0.7530(2) 1.0709(7) 0.5715(6) 0.0435(17) Uani 1 1 d . U
C21 C 0.7706(3) 0.8157(7) 0.8356(6) 0.0487(18) Uani 1 1 d . U
Eu1 Eu 1.19208(2) 0.70332(4) 0.45242(3) 0.0410(2) Uani 1 1 d . U
O1 O 1.1605(2) 0.5566(7) 0.3620(6) 0.091(3) Uani 1 1 d . U
H1A H 1.1785 0.5265 0.3371 0.137 Uiso 1 1 d R U
H1B H 1.1359 0.5368 0.3595 0.137 Uiso 1 1 d R U
O2 O 1.1572(3) 0.7725(7) 0.3004(5) 0.089(3) Uani 1 1 d . U
H2A H 1.1732 0.7702 0.2607 0.133 Uiso 1 1 d R U
H2B H 1.1319 0.7891 0.2926 0.133 Uiso 1 1 d R U
O3 O 1.1376(2) 0.8211(6) 0.4812(5) 0.0648(18) Uani 1 1 d . U
O4 O 1.1274(2) 0.6595(6) 0.5036(5) 0.0718(19) Uani 1 1 d . U
O5 O 0.7944(2) 0.7544(6) 0.8844(4) 0.0534(15) Uani 1 1 d . U
O6 O 0.73498(18) 0.8390(5) 0.8436(4) 0.0583(16) Uani 1 1 d . U
O7 O 0.71548(18) 1.0538(5) 0.5496(4) 0.0535(15) Uani 1 1 d . U
O8 O 0.76868(17) 1.1495(5) 0.5422(4) 0.0472(14) Uani 1 1 d . U
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'
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
O3 C1 O4 123.8(9) . .
O3 C1 C2 119.0(11) . .
O4 C1 C2 117.1(10) . .
O3 C1 Eu1 62.4(5) . .
O4 C1 Eu1 61.5(5) . .
C2 C1 Eu1 175.0(7) . .
C3 C2 C7 118.3(10) . .
C3 C2 C1 120.6(10) . .
C7 C2 C1 121.1(11) . .
C2 C3 C4 119.4(10) . .
C2 C3 H3 120.3 . .
C4 C3 H3 120.3 . .
C5 C4 C3 123.8(11) . .
C5 C4 H4 118.1 . .
C3 C4 H4 118.1 . .
C6 C5 C4 116.1(10) . .
C6 C5 C8 122.4(11) . .
C4 C5 C8 121.4(10) . .
C5 C6 C7 125.4(12) . .
C5 C6 H6 117.3 . .
C7 C6 H6 117.3 . .
C2 C7 C6 116.8(12) . .
C2 C7 H7 121.6 . .
C6 C7 H7 121.6 . .
C9 C8 C13 117.7(9) . .
C9 C8 C5 122.6(9) . .
C13 C8 C5 119.5(10) . .
C8 C9 C10 121.5(10) . .
C8 C9 H9 119.2 . .
C10 C9 H9 119.2 . .
C11 C10 C9 121.6(10) . .
C11 C10 H10 119.2 . .
C9 C10 H10 119.2 . .
C10 C11 C12 117.1(8) . .
C10 C11 C14 122.1(9) . .
C12 C11 C14 120.6(8) . .
C13 C12 C11 122.5(10) . .
C13 C12 H12 118.8 . .
C11 C12 H12 118.8 . .
C12 C13 C8 119.5(10) . .
C12 C13 H13 120.2 . .
C8 C13 H13 120.2 . .
C15 C14 C19 118.7(8) . .
C15 C14 C11 120.8(7) . .
C19 C14 C11 120.5(8) . .
C16 C15 C14 120.5(8) . .
C16 C15 H15 119.7 . .
C14 C15 H15 119.7 . .
C15 C16 C17 119.4(8) . .
C15 C16 C20 119.6(7) . .
C17 C16 C20 121.0(8) . .
C18 C17 C16 120.3(8) . .
C18 C17 H17 119.8 . .
C16 C17 H17 119.8 . .
C17 C18 C19 120.8(8) . .
C17 C18 C21 120.6(7) . .
C19 C18 C21 118.4(8) . .
C18 C19 C14 120.0(8) . .
C18 C19 H19 120.0 . .
C14 C19 H19 120.0 . .
O7 C20 O8 121.4(8) . .
O7 C20 C16 117.6(8) . .
O8 C20 C16 121.0(7) . .
O7 C20 Eu1 55.4(4) . 3_455
O8 C20 Eu1 66.0(4) . 3_455
C16 C20 Eu1 172.8(6) . 3_455
O5 C21 O6 128.0(8) . .
O5 C21 C18 117.0(8) . .
O6 C21 C18 114.8(8) . .
O8 Eu1 O6 79.6(2) 5_776 8_565
O8 Eu1 O5 74.6(2) 5_776 2_756
O6 Eu1 O5 133.5(2) 8_565 2_756
O8 Eu1 O2 82.5(3) 5_776 .
O6 Eu1 O2 75.3(3) 8_565 .
O5 Eu1 O2 136.6(3) 2_756 .
O8 Eu1 O1 149.0(2) 5_776 .
O6 Eu1 O1 73.4(3) 8_565 .
O5 Eu1 O1 135.8(3) 2_756 .
O2 Eu1 O1 76.1(3) . .
O8 Eu1 O7 123.4(2) 5_776 3_545
O6 Eu1 O7 90.8(2) 8_565 3_545
O5 Eu1 O7 73.0(3) 2_756 3_545
O2 Eu1 O7 148.3(3) . 3_545
O1 Eu1 O7 72.6(3) . 3_545
O8 Eu1 O4 134.1(2) 5_776 .
O6 Eu1 O4 143.8(3) 8_565 .
O5 Eu1 O4 77.3(2) 2_756 .
O2 Eu1 O4 94.1(3) . .
O1 Eu1 O4 70.4(3) . .
O7 Eu1 O4 80.4(2) 3_545 .
O8 Eu1 O3 83.1(2) 5_776 .
O6 Eu1 O3 143.9(2) 8_565 .
O5 Eu1 O3 69.9(2) 2_756 .
O2 Eu1 O3 71.2(3) . .
O1 Eu1 O3 110.2(3) . .
O7 Eu1 O3 125.1(2) 3_545 .
O4 Eu1 O3 53.1(2) . .
O8 Eu1 O8 75.3(2) 5_776 3_545
O6 Eu1 O8 67.5(2) 8_565 3_545
O5 Eu1 O8 68.9(2) 2_756 3_545
O2 Eu1 O8 139.2(2) . 3_545
O1 Eu1 O8 107.2(3) . 3_545
O7 Eu1 O8 50.15(19) 3_545 3_545
O4 Eu1 O8 125.8(2) . 3_545
O3 Eu1 O8 137.2(2) . 3_545
O8 Eu1 C1 108.6(3) 5_776 .
O6 Eu1 C1 154.7(3) 8_565 .
O5 Eu1 C1 71.4(3) 2_756 .
O2 Eu1 C1 82.1(3) . .
O1 Eu1 C1 90.6(3) . .
O7 Eu1 C1 103.2(3) 3_545 .
O4 Eu1 C1 26.7(3) . .
O3 Eu1 C1 26.4(3) . .
O8 Eu1 C1 137.3(3) 3_545 .
O8 Eu1 C20 100.0(2) 5_776 3_545
O6 Eu1 C20 78.7(2) 8_565 3_545
O5 Eu1 C20 68.8(2) 2_756 3_545
O2 Eu1 C20 152.9(3) . 3_545
O1 Eu1 C20 89.6(3) . 3_545
O7 Eu1 C20 24.5(2) 3_545 3_545
O4 Eu1 C20 102.8(3) . 3_545
O3 Eu1 C20 135.9(2) . 3_545
O8 Eu1 C20 25.7(2) 3_545 3_545
C1 Eu1 C20 121.6(3) . 3_545
O8 Eu1 Eu1 40.70(14) 5_776 7_766
O6 Eu1 Eu1 68.67(17) 8_565 7_766
O5 Eu1 Eu1 66.54(16) 2_756 7_766
O2 Eu1 Eu1 115.7(2) . 7_766
O1 Eu1 Eu1 134.61(19) . 7_766
O7 Eu1 Eu1 83.78(15) 3_545 7_766
O4 Eu1 Eu1 143.43(19) . 7_766
O3 Eu1 Eu1 115.1(2) . 7_766
O8 Eu1 Eu1 34.61(15) 3_545 7_766
C1 Eu1 Eu1 133.0(2) . 7_766
C20 Eu1 Eu1 59.62(19) 3_545 7_766
O8 Eu1 H2A 77.2 5_776 .
O6 Eu1 H2A 59.1 8_565 .
O5 Eu1 H2A 144.8 2_756 .
O2 Eu1 H2A 16.5 . .
O1 Eu1 H2A 76.0 . .
O7 Eu1 H2A 141.6 3_545 .
O4 Eu1 H2A 109.1 . .
O3 Eu1 H2A 86.3 . .
O8 Eu1 H2A 123.0 3_545 .
C1 Eu1 H2A 98.6 . .
C20 Eu1 H2A 137.6 3_545 .
Eu1 Eu1 H2A 103.8 7_766 .
Eu1 O1 H1A 109.7 . .
Eu1 O1 H1B 124.8 . .
H1A O1 H1B 125.3 . .
Eu1 O2 H2A 109.5 . .
Eu1 O2 H2B 119.5 . .
H2A O2 H2B 130.6 . .
C1 O3 Eu1 91.2(7) . .
C1 O4 Eu1 91.8(6) . .
C21 O5 Eu1 135.0(6) . 2_756
C21 O6 Eu1 134.6(6) . 8_466
C20 O7 Eu1 100.2(5) . 3_455
C20 O8 Eu1 159.2(5) . 5_776
C20 O8 Eu1 88.3(5) . 3_455
Eu1 O8 Eu1 104.7(2) 5_776 3_455
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 O3 1.246(13) .
C1 O4 1.261(14) .
C1 C2 1.506(14) .
C1 Eu1 2.802(10) .
C2 C3 1.387(14) .
C2 C7 1.397(16) .
C3 C4 1.387(13) .
C3 H3 0.9300 .
C4 C5 1.343(14) .
C4 H4 0.9300 .
C5 C6 1.313(15) .
C5 C8 1.482(13) .
C6 C7 1.423(16) .
C6 H6 0.9300 .
C7 H7 0.9300 .
C8 C9 1.362(14) .
C8 C13 1.410(14) .
C9 C10 1.380(12) .
C9 H9 0.9300 .
C10 C11 1.368(13) .
C10 H10 0.9300 .
C11 C12 1.380(13) .
C11 C14 1.482(11) .
C12 C13 1.372(14) .
C12 H12 0.9300 .
C13 H13 0.9300 .
C14 C15 1.385(12) .
C14 C19 1.398(11) .
C15 C16 1.382(11) .
C15 H15 0.9300 .
C16 C17 1.390(11) .
C16 C20 1.475(12) .
C17 C18 1.350(12) .
C17 H17 0.9300 .
C18 C19 1.376(11) .
C18 C21 1.548(11) .
C19 H19 0.9300 .
C20 O7 1.237(10) .
C20 O8 1.275(10) .
C20 Eu1 2.940(9) 3_455
C21 O5 1.242(11) .
C21 O6 1.244(10) .
Eu1 O8 2.342(7) 5_776
Eu1 O6 2.369(6) 8_565
Eu1 O5 2.372(6) 2_756
Eu1 O2 2.415(7) .
Eu1 O1 2.451(8) .
Eu1 O7 2.458(7) 3_545
Eu1 O4 2.463(7) .
Eu1 O3 2.484(7) .
Eu1 O8 2.688(6) 3_545
Eu1 C20 2.940(9) 3_545
Eu1 Eu1 3.988(5) 7_766
Eu1 H2A 2.8160 .
O1 H1A 0.8500 .
O1 H1B 0.8478 .
O2 H2A 0.8500 .
O2 H2B 0.8493 .
O5 Eu1 2.372(6) 2_756
O6 Eu1 2.369(6) 8_466
O7 Eu1 2.458(7) 3_455
O8 Eu1 2.342(7) 5_776
O8 Eu1 2.688(6) 3_455
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
O3 C1 C2 C3 -11.9(15) . .
O4 C1 C2 C3 164.1(10) . .
O3 C1 C2 C7 167.1(11) . .
O4 C1 C2 C7 -16.9(16) . .
C7 C2 C3 C4 -0.1(16) . .
C1 C2 C3 C4 178.9(9) . .
C2 C3 C4 C5 -3.9(16) . .
C3 C4 C5 C6 4.7(17) . .
C3 C4 C5 C8 -175.4(9) . .
C4 C5 C6 C7 -2(2) . .
C8 C5 C6 C7 178.3(12) . .
C3 C2 C7 C6 2.6(18) . .
C1 C2 C7 C6 -176.4(11) . .
C5 C6 C7 C2 -2(2) . .
C6 C5 C8 C9 -156.5(12) . .
C4 C5 C8 C9 23.6(16) . .
C6 C5 C8 C13 19.3(16) . .
C4 C5 C8 C13 -160.5(10) . .
C13 C8 C9 C10 -2.1(15) . .
C5 C8 C9 C10 173.8(9) . .
C8 C9 C10 C11 2.5(15) . .
C9 C10 C11 C12 -0.3(14) . .
C9 C10 C11 C14 -175.9(8) . .
C10 C11 C12 C13 -2.2(15) . .
C14 C11 C12 C13 173.4(9) . .
C11 C12 C13 C8 2.6(16) . .
C9 C8 C13 C12 -0.3(15) . .
C5 C8 C13 C12 -176.4(10) . .
C10 C11 C14 C15 29.3(13) . .
C12 C11 C14 C15 -146.2(9) . .
C10 C11 C14 C19 -152.0(9) . .
C12 C11 C14 C19 32.5(13) . .
C19 C14 C15 C16 -4.4(13) . .
C11 C14 C15 C16 174.3(8) . .
C14 C15 C16 C17 3.6(13) . .
C14 C15 C16 C20 -176.7(8) . .
C15 C16 C17 C18 1.4(13) . .
C20 C16 C17 C18 -178.3(8) . .
C16 C17 C18 C19 -5.7(14) . .
C16 C17 C18 C21 179.4(8) . .
C17 C18 C19 C14 4.9(14) . .
C21 C18 C19 C14 179.9(8) . .
C15 C14 C19 C18 0.1(13) . .
C11 C14 C19 C18 -178.6(9) . .
C15 C16 C20 O7 150.9(8) . .
C17 C16 C20 O7 -29.4(13) . .
C15 C16 C20 O8 -30.3(12) . .
C17 C16 C20 O8 149.4(8) . .
C17 C18 C21 O5 176.8(9) . .
C19 C18 C21 O5 1.8(13) . .
C17 C18 C21 O6 -7.7(13) . .
C19 C18 C21 O6 177.2(9) . .
O4 C1 O3 Eu1 -1.1(10) . .
C2 C1 O3 Eu1 174.5(8) . .
O3 C1 O4 Eu1 1.1(10) . .
C2 C1 O4 Eu1 -174.6(8) . .
O6 C21 O5 Eu1 -34.4(17) . 2_756
C18 C21 O5 Eu1 140.3(7) . 2_756
O5 C21 O6 Eu1 4.3(17) . 8_466
C18 C21 O6 Eu1 -170.6(6) . 8_466
O8 C20 O7 Eu1 -0.8(9) . 3_455
C16 C20 O7 Eu1 178.0(6) . 3_455
O7 C20 O8 Eu1 130.1(13) . 5_776
C16 C20 O8 Eu1 -48.7(19) . 5_776
Eu1 C20 O8 Eu1 129.4(15) 3_455 5_776
O7 C20 O8 Eu1 0.7(8) . 3_455
C16 C20 O8 Eu1 -178.1(7) . 3_455
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 0.184 -0.290 0.110 3074 949 ' '
