#------------------------------------------------------------------------------
#$Date: 2020-06-04 04:41:58 +0300 (Thu, 04 Jun 2020) $
#$Revision: 252627 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/24/05/7240598.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_7240598
loop_
_publ_author_name
'Bo, Qi-Bing'
'Wang, Jia-Yin'
'Shi, Yang'
'Tao, Dong-Liang'
'Yin, Guo-Yin'
_publ_section_title
;
 2D chain layer versus 1D chain: rigid aromatic benzoate disassembling
 flexible alicyclic dicarboxylate-based lanthanide coordination polymers
 with enhanced photoluminescence and characteristic behavior of
 single-molecule magnet.
;
_journal_name_full               CrystEngComm
_journal_paper_doi               10.1039/D0CE00583E
_journal_year                    2020
_chemical_formula_moiety         '0.5(C30 H36 Eu4 O30)'
_chemical_formula_sum            'C15 H18 Eu2 O15'
_chemical_formula_weight         742.21
_space_group_crystal_system      monoclinic
_space_group_IT_number           11
_space_group_name_Hall           '-P 2yb'
_space_group_name_H-M_alt        'P 1 21/m 1'
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     direct
_audit_creation_date             2019-11-02
_audit_creation_method
;
Olex2 1.2-alpha
(compiled 2016.11.07 svn.r3352 for OlexSys, GUI svn.r5261)
;
_audit_update_record
;
2019-11-02 deposited with the CCDC.	2020-06-03 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 106.11(2)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   9.7632(18)
_cell_length_b                   7.9567(15)
_cell_length_c                   12.920(3)
_cell_measurement_reflns_used    2287
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      29.1350
_cell_measurement_theta_min      4.8300
_cell_volume                     964.2(4)
_computing_cell_refinement
;
CrysAlisPro, Agilent Technologies,
Version 1.171.37.35 (release 13-08-2014 CrysAlis171 .NET)
(compiled Aug 13 2014,18:06:01)
;
_computing_data_collection
;
CrysAlisPro, Agilent Technologies,
Version 1.171.37.35 (release 13-08-2014 CrysAlis171 .NET)
(compiled Aug 13 2014,18:06:01)
;
_computing_data_reduction
;
CrysAlisPro, Agilent Technologies,
Version 1.171.37.35 (release 13-08-2014 CrysAlis171 .NET)
(compiled Aug 13 2014,18:06:01)
;
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'SIR2004 (Burla et al., 2007)'
_diffrn_ambient_temperature      293.15
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean 16.0355
_diffrn_detector_type            Eos
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_details
;
#__ type_ start__ end____ width___ exp.time_
  1 omega  -52.00   43.00   1.0000    1.1400
omega____ theta____ kappa____ phi______ frames
    -       15.8569  -77.0000    0.0000 95

#__ type_ start__ end____ width___ exp.time_
  2 omega  -51.00   33.00   1.0000    1.1400
omega____ theta____ kappa____ phi______ frames
    -       15.8569  -57.0000   60.0000 84

#__ type_ start__ end____ width___ exp.time_
  3 omega  -25.00   55.00   1.0000    1.1400
omega____ theta____ kappa____ phi______ frames
    -       15.8569  -99.0000  -90.0000 80

#__ type_ start__ end____ width___ exp.time_
  4 omega   -1.00   62.00   1.0000    1.1400
omega____ theta____ kappa____ phi______ frames
    -       15.8569   57.0000   30.0000 63
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'Xcalibur, Eos, Gemini'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_UB_11      -0.0104606000
_diffrn_orient_matrix_UB_12      -0.0088061000
_diffrn_orient_matrix_UB_13      -0.0562754000
_diffrn_orient_matrix_UB_21      0.0712282000
_diffrn_orient_matrix_UB_22      -0.0286182000
_diffrn_orient_matrix_UB_23      0.0094598000
_diffrn_orient_matrix_UB_31      -0.0231996000
_diffrn_orient_matrix_UB_32      -0.0840308000
_diffrn_orient_matrix_UB_33      0.0027095000
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0385
_diffrn_reflns_av_unetI/netI     0.0419
_diffrn_reflns_Laue_measured_fraction_full 0.996
_diffrn_reflns_Laue_measured_fraction_max 0.997
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       9
_diffrn_reflns_limit_k_min       -9
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            6352
_diffrn_reflns_point_group_measured_fraction_full 0.996
_diffrn_reflns_point_group_measured_fraction_max 0.997
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         26.371
_diffrn_reflns_theta_min         3.064
_diffrn_source                   'Enhance (Mo) X-ray Source'
_exptl_absorpt_coefficient_mu    6.528
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.39542
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro, Agilent Technologies,
Version 1.171.37.35 (release 13-08-2014 CrysAlis171 .NET)
(compiled Aug 13 2014,18:06:01)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            'clear whiteish colourless'
_exptl_crystal_colour_lustre     clear
_exptl_crystal_colour_modifier   whiteish
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    2.556
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             708
_exptl_crystal_size_max          0.43
_exptl_crystal_size_mid          0.12
_exptl_crystal_size_min          0.026
_refine_diff_density_max         0.639
_refine_diff_density_min         -0.835
_refine_diff_density_rms         0.155
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.071
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     160
_refine_ls_number_reflns         2103
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.071
_refine_ls_R_factor_all          0.0328
_refine_ls_R_factor_gt           0.0251
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
;
 w=1/[σ²(Fo²)+(0.0232P)²]
 where P=(Fo²+2Fc²)/3
;
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0550
_refine_ls_wR_factor_ref         0.0595
_reflns_Friedel_coverage         0.000
_reflns_number_gt                1808
_reflns_number_total             2103
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d0ce00583e2.cif
_cod_data_source_block           cpdc-Eu
_cod_original_cell_volume        964.3(3)
_cod_database_code               7240598
_shelxl_version_number           2013-2
_chemical_oxdiff_formula         'C H N O Eu'
_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_max   0.849
_shelx_estimated_absorpt_t_min   0.166
_reflns_odcompleteness_completeness 99.57
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     26.32
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All O(H,H) groups
2. Others
 Fixed Sof: H7A(0.5) H7B(0.5) H8A(0.5) H8B(0.5) H9A(0.5) H9B(0.5)
3.a Rotating group:
 O7(H7A,H7B), O8(H8A,H8B), O9(H9A,H9B)
3.b Ternary CH refined with riding coordinates:
 C5(H5), C2(H2), C8(H8)
3.c Secondary CH2 refined with riding coordinates:
 C6(H6A,H6B), C3(H3A,H3B), C9(H9C,H9D)
;
_olex2_date_sample_data_collection 2015-06-15
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z'
'-x, -y, -z'
'x, -y-1/2, 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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Eu1 Eu 0.49096(3) 0.7500 0.13280(2) 0.01269(10) Uani 1 2 d S T P . .
Eu2 Eu 0.89865(3) 0.2500 0.50740(2) 0.01497(10) Uani 1 2 d S T P . .
O1 O 0.5840(4) 0.5625(4) 0.2764(3) 0.0332(9) Uani 1 1 d . . . . .
O2 O 0.7199(4) 0.4253(5) 0.4112(3) 0.0443(11) Uani 1 1 d . . . . .
O3 O 0.6592(3) 0.5695(4) 0.0876(2) 0.0198(7) Uani 1 1 d . . . . .
O4 O 0.6845(3) 0.4608(4) -0.0653(2) 0.0257(8) Uani 1 1 d . . . . .
O5 O 0.9898(4) 0.5735(4) 0.5945(3) 0.0313(8) Uani 1 1 d . . . . .
O6 O 0.8377(4) 0.4210(4) 0.6472(3) 0.0319(9) Uani 1 1 d . . . . .
O7 O 0.4483(5) 0.7500 -0.0676(3) 0.0253(11) Uani 1 2 d S T P . .
H7A H 0.4103 0.6425 -0.1065 0.038 Uiso 0.5 1 d GR . . . .
H7B H 0.5320 0.7769 -0.0950 0.038 Uiso 0.5 1 d GR . . . .
O8 O 0.3212(5) 0.7500 0.2426(4) 0.0286(11) Uani 1 2 d S T P . .
H8A H 0.3168 0.8339 0.2970 0.043 Uiso 0.5 1 d GR . . . .
H8B H 0.2496 0.6577 0.2447 0.043 Uiso 0.5 1 d GR . . . .
O9 O 1.1381(5) 0.2500 0.6231(4) 0.0300(12) Uani 1 2 d S T P . .
H9A H 1.1837 0.3570 0.6306 0.045 Uiso 0.5 1 d GR . . . .
H9B H 1.2026 0.1844 0.5970 0.045 Uiso 0.5 1 d GR . . . .
C5 C 0.8557(4) 0.6529(5) 0.0237(3) 0.0175(10) Uani 1 1 d . . . . .
H5 H 0.9198 0.6019 -0.0138 0.021 Uiso 1 1 calc R . . . .
C6 C 0.9291(7) 0.7500 0.1217(5) 0.0255(16) Uani 1 2 d S T P . .
H6A H 1.0325 0.7500 0.1433 0.031 Uiso 1 2 calc RS T P . .
H6B H 0.8862 0.7500 0.1811 0.031 Uiso 1 2 calc RS T P . .
C4 C 0.7231(5) 0.5565(5) 0.0151(3) 0.0176(10) Uani 1 1 d . . . . .
C2 C 0.4768(5) 0.3465(6) 0.3467(5) 0.0358(14) Uani 1 1 d . . . . .
H2 H 0.3859 0.3957 0.3058 0.043 Uiso 1 1 calc R . . . .
C3 C 0.4673(10) 0.2500 0.4434(8) 0.051(2) Uani 1 2 d S T P . .
H3A H 0.5502 0.2500 0.5056 0.061 Uiso 1 2 calc RS T P . .
H3B H 0.3766 0.2500 0.4604 0.061 Uiso 1 2 calc RS T P . .
C1 C 0.6016(5) 0.4486(6) 0.3441(4) 0.0208(10) Uani 1 1 d . . . . .
C8 C 0.9269(5) 0.6542(5) 0.7545(3) 0.0210(11) Uani 1 1 d . . . . .
H8 H 0.8812 0.6051 0.8061 0.025 Uiso 1 1 calc R . . . .
C9 C 1.0590(8) 0.7500 0.8064(6) 0.0315(18) Uani 1 2 d S T P . .
H9C H 1.1344 0.7500 0.7709 0.038 Uiso 1 2 calc RS T P . .
H9D H 1.0918 0.7500 0.8845 0.038 Uiso 1 2 calc RS T P . .
C7 C 0.9171(5) 0.5461(6) 0.6585(3) 0.0185(10) 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'
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
O1 Eu1 O1 78.53(17) 4_575 . ?
O1 Eu1 O3 70.66(12) . . ?
O1 Eu1 O3 70.66(12) 4_575 4_575 ?
O1 Eu1 O3 115.76(11) . 4_575 ?
O1 Eu1 O3 115.76(11) 4_575 . ?
O1 Eu1 O4 144.51(12) 4_575 3_665 ?
O1 Eu1 O4 85.61(12) 4_575 2_655 ?
O1 Eu1 O4 144.51(12) . 2_655 ?
O1 Eu1 O4 85.61(12) . 3_665 ?
O1 Eu1 O7 136.92(10) . . ?
O1 Eu1 O7 136.92(10) 4_575 . ?
O1 Eu1 O8 73.78(12) . . ?
O1 Eu1 O8 73.78(12) 4_575 . ?
O3 Eu1 O3 74.45(15) 4_575 . ?
O3 Eu1 O4 87.74(11) . 3_665 ?
O3 Eu1 O4 87.74(11) 4_575 2_655 ?
O3 Eu1 O4 144.30(11) 4_575 3_665 ?
O3 Eu1 O4 144.30(11) . 2_655 ?
O3 Eu1 O7 70.96(11) 4_575 . ?
O3 Eu1 O7 70.96(11) . . ?
O3 Eu1 O8 139.83(8) . . ?
O3 Eu1 O8 139.83(8) 4_575 . ?
O4 Eu1 O4 89.46(16) 3_665 2_655 ?
O4 Eu1 O7 74.06(11) 3_665 . ?
O4 Eu1 O7 74.06(11) 2_655 . ?
O4 Eu1 O8 71.35(11) 3_665 . ?
O4 Eu1 O8 71.35(11) 2_655 . ?
O8 Eu1 O7 130.52(15) . . ?
O2 Eu2 Eu2 73.56(9) . 3_766 ?
O2 Eu2 Eu2 142.34(10) 4_565 3_766 ?
O2 Eu2 O2 74.30(18) 4_565 . ?
O2 Eu2 O5 76.93(12) . . ?
O2 Eu2 O5 74.91(13) 4_565 2_746 ?
O2 Eu2 O5 116.81(14) 4_565 3_766 ?
O2 Eu2 O5 149.80(11) 4_565 . ?
O2 Eu2 O5 76.93(12) 4_565 4_565 ?
O2 Eu2 O5 116.81(14) . 2_746 ?
O2 Eu2 O5 149.80(11) . 4_565 ?
O2 Eu2 O5 74.92(13) . 3_766 ?
O2 Eu2 O6 115.36(13) 4_565 . ?
O2 Eu2 O6 76.18(14) . . ?
O2 Eu2 O6 115.36(13) . 4_565 ?
O2 Eu2 O6 76.18(14) 4_565 4_565 ?
O2 Eu2 O9 142.69(9) 4_565 . ?
O2 Eu2 O9 142.69(9) . . ?
O2 Eu2 C7 77.20(13) . . ?
O2 Eu2 C7 135.79(13) . 4_565 ?
O2 Eu2 C7 135.79(13) 4_565 . ?
O2 Eu2 C7 77.20(13) 4_565 4_565 ?
O5 Eu2 Eu2 34.62(8) 3_766 3_766 ?
O5 Eu2 Eu2 136.62(7) 4_565 3_766 ?
O5 Eu2 Eu2 28.37(7) . 3_766 ?
O5 Eu2 Eu2 103.01(9) 2_746 3_766 ?
O5 Eu2 O5 62.99(12) 3_766 . ?
O5 Eu2 O5 62.99(12) 2_746 4_565 ?
O5 Eu2 O5 72.16(17) 2_746 3_766 ?
O5 Eu2 O5 129.06(14) . 4_565 ?
O5 Eu2 O5 127.54(6) 2_746 . ?
O5 Eu2 O5 127.54(6) 3_766 4_565 ?
O5 Eu2 O6 166.06(11) 2_746 . ?
O5 Eu2 O6 108.66(11) 3_766 . ?
O5 Eu2 O6 108.66(11) 2_746 4_565 ?
O5 Eu2 O6 166.06(11) 3_766 4_565 ?
O5 Eu2 O9 80.13(13) 3_766 . ?
O5 Eu2 O9 80.13(13) 2_746 . ?
O5 Eu2 C7 149.11(12) 2_746 . ?
O5 Eu2 C7 24.26(10) . . ?
O5 Eu2 C7 24.26(10) 4_565 4_565 ?
O5 Eu2 C7 119.40(11) 4_565 . ?
O5 Eu2 C7 86.74(12) 2_746 4_565 ?
O5 Eu2 C7 119.40(11) . 4_565 ?
O5 Eu2 C7 149.11(12) 3_766 4_565 ?
O5 Eu2 C7 86.74(12) 3_766 . ?
O6 Eu2 Eu2 136.28(8) 4_565 3_766 ?
O6 Eu2 Eu2 74.92(8) . 3_766 ?
O6 Eu2 O5 47.48(10) 4_565 4_565 ?
O6 Eu2 O5 108.75(10) . 4_565 ?
O6 Eu2 O5 108.76(10) 4_565 . ?
O6 Eu2 O5 47.49(10) . . ?
O6 Eu2 O6 67.05(15) . 4_565 ?
O6 Eu2 C7 23.37(11) . . ?
O6 Eu2 C7 86.57(12) . 4_565 ?
O6 Eu2 C7 23.37(11) 4_565 4_565 ?
O6 Eu2 C7 86.57(12) 4_565 . ?
O9 Eu2 Eu2 70.15(4) . 3_766 ?
O9 Eu2 O5 67.09(7) . 4_565 ?
O9 Eu2 O5 67.09(7) . . ?
O9 Eu2 O6 86.27(13) . 4_565 ?
O9 Eu2 O6 86.27(13) . . ?
O9 Eu2 C7 74.07(11) . . ?
O9 Eu2 C7 74.07(11) . 4_565 ?
C7 Eu2 Eu2 52.29(9) . 3_766 ?
C7 Eu2 Eu2 140.42(8) 4_565 3_766 ?
C7 Eu2 C7 101.94(16) . 4_565 ?
C1 O1 Eu1 165.2(3) . . ?
C1 O2 Eu2 151.3(3) . . ?
C4 O3 Eu1 138.5(3) . . ?
C4 O4 Eu1 138.4(3) . 3_665 ?
Eu2 O5 Eu2 117.01(12) 3_766 . ?
C7 O5 Eu2 86.1(3) . . ?
C7 O5 Eu2 153.9(3) . 3_766 ?
C7 O6 Eu2 105.0(3) . . ?
Eu1 O7 H7A 116.6 . . ?
Eu1 O7 H7B 116.7 . . ?
H7A O7 H7B 103.2 . . ?
Eu1 O8 H8A 125.8 . . ?
Eu1 O8 H8B 126.3 . . ?
H8A O8 H8B 107.8 . . ?
Eu2 O9 H9A 114.2 . . ?
Eu2 O9 H9B 114.0 . . ?
H9A O9 H9B 101.0 . . ?
C5 C5 H5 114.4 4_575 . ?
C6 C5 C5 58.7(2) . 4_575 ?
C6 C5 H5 114.4 . . ?
C4 C5 C5 121.2(2) . 4_575 ?
C4 C5 H5 114.4 . . ?
C4 C5 C6 122.5(4) . . ?
C5 C6 C5 62.6(4) . 4_575 ?
C5 C6 H6A 117.5 4_575 . ?
C5 C6 H6A 117.5 . . ?
C5 C6 H6B 117.5 . . ?
C5 C6 H6B 117.5 4_575 . ?
H6A C6 H6B 114.6 . . ?
O3 C4 C5 120.1(4) . . ?
O4 C4 O3 124.4(4) . . ?
O4 C4 C5 115.5(4) . . ?
C2 C2 H2 113.5 4_565 . ?
C3 C2 C2 59.0(3) . 4_565 ?
C3 C2 H2 113.5 . . ?
C1 C2 C2 123.5(3) . 4_565 ?
C1 C2 H2 113.5 . . ?
C1 C2 C3 123.2(5) . . ?
C2 C3 C2 62.0(5) 4_565 . ?
C2 C3 H3A 117.6 4_565 . ?
C2 C3 H3A 117.6 . . ?
C2 C3 H3B 117.6 4_565 . ?
C2 C3 H3B 117.6 . . ?
H3A C3 H3B 114.7 . . ?
O1 C1 O2 121.2(4) . . ?
O1 C1 C2 117.8(4) . . ?
O2 C1 C2 120.9(4) . . ?
C8 C8 H8 113.5 4_575 . ?
C9 C8 C8 59.2(2) . 4_575 ?
C9 C8 H8 113.5 . . ?
C9 C8 C7 121.2(5) . . ?
C7 C8 C8 125.2(2) . 4_575 ?
C7 C8 H8 113.5 . . ?
C8 C9 C8 61.6(4) . 4_575 ?
C8 C9 H9C 117.6 . . ?
C8 C9 H9C 117.6 4_575 . ?
C8 C9 H9D 117.6 . . ?
C8 C9 H9D 117.6 4_575 . ?
H9C C9 H9D 114.7 . . ?
O5 C7 Eu2 69.7(3) . . ?
O5 C7 C8 122.2(4) . . ?
O6 C7 Eu2 51.7(2) . . ?
O6 C7 O5 120.8(4) . . ?
O6 C7 C8 116.9(4) . . ?
C8 C7 Eu2 164.3(3) . . ?
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 O1 2.357(3) 4_575 ?
Eu1 O1 2.357(3) . ?
Eu1 O3 2.374(3) 4_575 ?
Eu1 O3 2.374(3) . ?
Eu1 O4 2.383(3) 3_665 ?
Eu1 O4 2.383(3) 2_655 ?
Eu1 O7 2.506(4) . ?
Eu1 O8 2.463(5) . ?
Eu2 Eu2 4.4711(7) 3_766 ?
Eu2 O2 2.309(3) 4_565 ?
Eu2 O2 2.309(3) . ?
Eu2 O5 2.851(3) . ?
Eu2 O5 2.385(3) 3_766 ?
Eu2 O5 2.851(3) 4_565 ?
Eu2 O5 2.385(3) 2_746 ?
Eu2 O6 2.463(3) 4_565 ?
Eu2 O6 2.463(3) . ?
Eu2 O9 2.400(4) . ?
Eu2 C7 3.033(5) . ?
Eu2 C7 3.033(5) 4_565 ?
O1 C1 1.238(5) . ?
O2 C1 1.250(5) . ?
O3 C4 1.266(5) . ?
O4 Eu1 2.383(3) 3_665 ?
O4 C4 1.259(5) . ?
O5 Eu2 2.385(3) 3_766 ?
O5 C7 1.249(5) . ?
O6 C7 1.246(5) . ?
O7 H7A 1.0090 . ?
O7 H7B 1.0000 . ?
O8 H8A 0.9787 . ?
O8 H8B 1.0192 . ?
O9 H9A 0.9529 . ?
O9 H9B 0.9479 . ?
C5 C5 1.545(8) 4_575 ?
C5 H5 0.9800 . ?
C5 C6 1.487(6) . ?
C5 C4 1.482(6) . ?
C6 C5 1.487(6) 4_575 ?
C6 H6A 0.9700 . ?
C6 H6B 0.9700 . ?
C2 C2 1.536(9) 4_565 ?
C2 H2 0.9800 . ?
C2 C3 1.491(9) . ?
C2 C1 1.472(6) . ?
C3 C2 1.491(9) 4_565 ?
C3 H3A 0.9700 . ?
C3 H3B 0.9700 . ?
C8 C8 1.524(8) 4_575 ?
C8 H8 0.9800 . ?
C8 C9 1.488(7) . ?
C8 C7 1.491(6) . ?
C9 C8 1.488(7) 4_575 ?
C9 H9C 0.9700 . ?
C9 H9D 0.9700 . ?
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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
Eu1 O1 C1 O2 177.9(10) . . . . ?
Eu1 O1 C1 C2 -5.0(16) . . . . ?
Eu1 O3 C4 O4 -98.1(5) . . . . ?
Eu1 O3 C4 C5 84.3(5) . . . . ?
Eu1 O4 C4 O3 -5.1(7) 3_665 . . . ?
Eu1 O4 C4 C5 172.6(3) 3_665 . . . ?
Eu2 O2 C1 O1 -137.7(6) . . . . ?
Eu2 O2 C1 C2 45.3(10) . . . . ?
Eu2 O5 C7 Eu2 153.6(7) 3_766 . . . ?
Eu2 O5 C7 O6 -8.0(4) . . . . ?
Eu2 O5 C7 O6 145.7(5) 3_766 . . . ?
Eu2 O5 C7 C8 168.5(4) . . . . ?
Eu2 O5 C7 C8 -37.9(9) 3_766 . . . ?
Eu2 O6 C7 O5 9.5(5) . . . . ?
Eu2 O6 C7 C8 -167.1(3) . . . . ?
C5 C5 C4 O3 -62.5(4) 4_575 . . . ?
C5 C5 C4 O4 119.7(3) 4_575 . . . ?
C6 C5 C4 O3 7.9(6) . . . . ?
C6 C5 C4 O4 -169.9(4) . . . . ?
C4 C5 C6 C5 -109.3(4) . . . 4_575 ?
C2 C2 C1 O1 130.0(3) 4_565 . . . ?
C2 C2 C1 O2 -52.9(6) 4_565 . . . ?
C3 C2 C1 O1 -157.8(5) . . . . ?
C3 C2 C1 O2 19.3(8) . . . . ?
C1 C2 C3 C2 -112.1(4) . . . 4_565 ?
C8 C8 C7 Eu2 -177.9(10) 4_575 . . . ?
C8 C8 C7 O5 45.8(5) 4_575 . . . ?
C8 C8 C7 O6 -137.7(3) 4_575 . . . ?
C9 C8 C7 Eu2 109.9(11) . . . . ?
C9 C8 C7 O5 -26.5(6) . . . . ?
C9 C8 C7 O6 150.1(4) . . . . ?
C7 C8 C9 C8 115.1(4) . . . 4_575 ?
