#------------------------------------------------------------------------------
#$Date: 2022-11-01 10:47:30 +0200 (Tue, 01 Nov 2022) $
#$Revision: 278884 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/24/57/7245742.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_7245742
loop_
_publ_author_name
'Li, Duo-Fu'
'Guo, Feng'
'He, Xiao-Li'
'Wu, Yao-Zhen'
'Deng, Xiang-Hong'
'Yang, Kang-Ping'
'Sui, Yan'
'Li, Yongxiu'
_publ_section_title
;
 A Layered Hybrid Rare-Earth Double Perovskite with Two Continuous
 Reversible Phase Transitions Induced By Unusual Two Driving Gears of
 Fan-Like Rotation Movements
;
_journal_name_full               CrystEngComm
_journal_paper_doi               10.1039/D2CE01297A
_journal_year                    2022
_chemical_formula_moiety         'C28 H56 Eu K N12 O24'
_chemical_formula_sum            'C28 H56 Eu K N12 O24'
_chemical_formula_weight         1135.90
_space_group_crystal_system      orthorhombic
_space_group_IT_number           51
_space_group_name_Hall           '-P 2a 2a'
_space_group_name_H-M_alt        'P m m a'
_audit_creation_method           SHELXL-2014
_audit_update_record
;
2022-10-11 deposited with the CCDC.	2022-10-31 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   23.6915(11)
_cell_length_b                   9.7624(3)
_cell_length_c                   9.9066(4)
_cell_measurement_reflns_used    2605
_cell_measurement_temperature    313(2)
_cell_measurement_theta_max      27.2630
_cell_measurement_theta_min      3.9960
_cell_volume                     2291.26(16)
_computing_cell_refinement       'CrysAlisPro 1.171.40.53 (Rigaku OD, 2019)'
_computing_data_collection       'CrysAlisPro 1.171.40.53 (Rigaku OD, 2019)'
_computing_data_reduction        'CrysAlisPro 1.171.40.53 (Rigaku OD, 2019)'
_computing_structure_refinement  'SHELXL-2014 (Sheldrick, 2014)'
_diffrn_ambient_temperature      313(2)
_diffrn_measured_fraction_theta_full 0.978
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measurement_device_type  'SuperNova, Single source at offset/far, EosS2'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0227
_diffrn_reflns_av_unetI/netI     0.0302
_diffrn_reflns_Laue_measured_fraction_full 0.978
_diffrn_reflns_Laue_measured_fraction_max 0.996
_diffrn_reflns_limit_h_max       28
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_k_min       -8
_diffrn_reflns_limit_l_max       11
_diffrn_reflns_limit_l_min       -11
_diffrn_reflns_number            6011
_diffrn_reflns_point_group_measured_fraction_full 0.978
_diffrn_reflns_point_group_measured_fraction_max 0.996
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.027
_diffrn_reflns_theta_min         3.299
_diffrn_source                   'micro-focus sealed X-ray tube'
_exptl_absorpt_coefficient_mu    1.556
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.88984
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro 1.171.40.53 (Rigaku Oxford Diffraction, 2019)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.646
_exptl_crystal_description       block
_exptl_crystal_F_000             1164
_exptl_crystal_size_max          0.200
_exptl_crystal_size_mid          0.200
_exptl_crystal_size_min          0.180
_refine_diff_density_max         1.232
_refine_diff_density_min         -0.879
_refine_diff_density_rms         0.125
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.057
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_parameters     211
_refine_ls_number_reflns         2215
_refine_ls_number_restraints     40
_refine_ls_restrained_S_all      1.072
_refine_ls_R_factor_all          0.0654
_refine_ls_R_factor_gt           0.0549
_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)+(0.0851P)²+6.5522P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1426
_refine_ls_wR_factor_ref         0.1523
_reflns_Friedel_coverage         0.000
_reflns_number_gt                1852
_reflns_number_total             2215
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d2ce01297a2.cif
_cod_data_source_block           20211126-LDF-351-313K
_cod_database_code               7245742
_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   0.746
_shelx_estimated_absorpt_t_max   0.767
_shelxl_version_number           2014-3
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, -y, z'
'-x, y, -z'
'x+1/2, -y, -z'
'-x, -y, -z'
'x-1/2, y, -z'
'x, -y, z'
'-x-1/2, 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_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
C1 C 0.0718(6) 0.0764(12) 0.8696(11) 0.129(4) Uani 1 1 d D . . . .
C2 C 0.1566(9) 0.063(2) 0.7383(12) 0.183(8) Uani 1 1 d . U . . .
C3 C 0.0688(6) 0.0743(15) 0.6214(11) 0.163(7) Uani 1 1 d D . . . .
C4 C 0.0744(5) 0.3736(10) 0.3091(11) 0.106(3) Uani 1 1 d . . . . .
C5 C 0.0602(6) 0.3717(11) 0.1598(12) 0.129(5) Uani 1 1 d . . . . .
C6 C 0.0799(7) 0.5000 0.0909(12) 0.102(5) Uani 1 2 d S T P . .
C7 C 0.1413(9) 0.5000 0.1042(19) 0.134(6) Uani 1 2 d S TU P . .
C8 C 0.1566(7) 0.5000 0.2537(15) 0.137(9) Uani 1 2 d S T P . .
Eu1 Eu 0.2500 0.0000 0.24342(4) 0.0323(2) Uani 1 4 d S T P A .
K1 K 0.2500 0.5000 0.7426(2) 0.0431(6) Uani 1 4 d S T P . .
N1 N 0.3947(10) 0.408(2) 0.663(2) 0.209(12) Uani 0.5 1 d D U P . .
N2 N 0.2500 0.2171(9) 0.4585(8) 0.062(2) Uani 1 2 d S T P . .
N3 N 0.1242(3) 0.0000 0.2436(7) 0.051(2) Uani 1 2 d S T P . .
N4 N 0.2500 -0.2162(9) 0.0281(8) 0.055(2) Uani 1 2 d S T P . .
N5 N 0.1060(5) 0.5000 0.3391(10) 0.087(3) Uani 1 2 d S T P . .
N6 N 0.0992(8) 0.1279(19) 0.7456(10) 0.177(6) Uani 1 1 d D U . . .
O1 O 0.3675(8) 0.419(2) 0.7756(19) 0.141(6) Uani 0.5 1 d D U P . .
O2 O 0.3615(7) 0.5000 0.6250(16) 0.192(7) Uani 1 2 d DS TU P . .
O3 O 0.4299(14) 0.5000 0.652(4) 0.390(19) Uiso 1 2 d DS . P . .
O4 O 0.2500 0.3031(11) 0.5450(10) 0.142(5) Uani 1 2 d S T P A .
O7 O 0.1506(4) 0.0746(10) 0.3214(9) 0.056(2) Uani 0.5 1 d . . P A .
O8 O 0.1515(4) -0.0802(10) 0.1681(9) 0.056(2) Uani 0.5 1 d . . P A .
O9 O 0.0723(3) 0.0000 0.2448(7) 0.090(3) Uani 1 2 d S T P A .
O12 O 0.2500 -0.3023(9) -0.0607(8) 0.099(3) Uani 1 2 d S T P A .
O5A O 0.2500 0.2459(12) 0.3351(12) 0.049(3) Uani 0.475(10) 2 d S T P A 1
O10A O 0.2500 -0.0907(14) 0.0000(11) 0.052(4) Uani 0.475(10) 2 d S T P A 1
O5B O 0.2500 0.0914(13) 0.4879(11) 0.051(4) Uani 0.475(10) 2 d S T P A 1
O10B O 0.2500 -0.2478(13) 0.1498(12) 0.057(4) Uani 0.475(10) 2 d S T P A 1
O6 O 0.2045(4) 0.1721(10) 0.4110(9) 0.064(3) Uani 0.525(10) 1 d . . P A 2
O11 O 0.2050(4) -0.1683(10) 0.0772(8) 0.061(3) Uani 0.525(10) 1 d . . P A 2
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'
Eu Eu -0.1578 3.6682 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
K K 0.2009 0.2494 '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'
H H 0.0000 0.0000 '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
N6 C1 C1 109.9(9) . 7 ?
C2 C2 N6 115.1(12) 7 . ?
C3 C3 N6 110.2(10) 7 . ?
N5 C4 C5 108.6(8) . . ?
C6 C5 C4 111.4(9) . . ?
C7 C6 C5 105.6(10) . . ?
C7 C6 C5 105.6(10) . 7_565 ?
C5 C6 C5 113.1(13) . 7_565 ?
C6 C7 C8 108.9(15) . . ?
N5 C8 C7 111.4(14) . . ?
O11 Eu1 O11 99.9(4) 8_655 7 ?
O11 Eu1 O11 79.9(4) 8_655 2 ?
O11 Eu1 O11 49.2(4) 7 2 ?
O11 Eu1 O11 49.2(4) 8_655 . ?
O11 Eu1 O11 79.9(4) 7 . ?
O11 Eu1 O11 99.9(4) 2 . ?
O5A Eu1 O5A 138.5(5) 2 . ?
O5A Eu1 O10A 130.9(4) 2 2 ?
O5A Eu1 O10A 90.6(4) . 2 ?
O5A Eu1 O10A 90.6(4) 2 . ?
O5A Eu1 O10A 130.9(4) . . ?
O10A Eu1 O10A 40.3(6) 2 . ?
O11 Eu1 O8 112.8(3) 8_655 7 ?
O11 Eu1 O8 40.5(3) 7 7 ?
O11 Eu1 O8 89.8(3) 2 7 ?
O11 Eu1 O8 68.3(3) . 7 ?
O5A Eu1 O8 112.8(2) 2 7 ?
O5A Eu1 O8 79.5(2) . 7 ?
O10A Eu1 O8 67.8(2) 2 7 ?
O10A Eu1 O8 80.4(2) . 7 ?
O11 Eu1 O8 68.3(3) 8_655 2 ?
O11 Eu1 O8 89.8(3) 7 2 ?
O11 Eu1 O8 40.5(3) 2 2 ?
O11 Eu1 O8 112.8(3) . 2 ?
O5A Eu1 O8 112.8(2) 2 2 ?
O5A Eu1 O8 79.5(2) . 2 ?
O10A Eu1 O8 67.8(2) 2 2 ?
O10A Eu1 O8 80.4(2) . 2 ?
O8 Eu1 O8 130.3(4) 7 2 ?
O11 Eu1 O8 40.5(3) 8_655 8_655 ?
O11 Eu1 O8 112.8(3) 7 8_655 ?
O11 Eu1 O8 68.3(3) 2 8_655 ?
O11 Eu1 O8 89.8(3) . 8_655 ?
O5A Eu1 O8 79.5(2) 2 8_655 ?
O5A Eu1 O8 112.8(2) . 8_655 ?
O10A Eu1 O8 80.4(2) 2 8_655 ?
O10A Eu1 O8 67.8(2) . 8_655 ?
O8 Eu1 O8 146.3(4) 7 8_655 ?
O8 Eu1 O8 35.5(4) 2 8_655 ?
O11 Eu1 O8 89.8(3) 8_655 . ?
O11 Eu1 O8 68.3(3) 7 . ?
O11 Eu1 O8 112.8(3) 2 . ?
O11 Eu1 O8 40.5(3) . . ?
O5A Eu1 O8 79.5(2) 2 . ?
O5A Eu1 O8 112.8(2) . . ?
O10A Eu1 O8 80.4(2) 2 . ?
O10A Eu1 O8 67.8(2) . . ?
O8 Eu1 O8 35.5(4) 7 . ?
O8 Eu1 O8 146.3(4) 2 . ?
O8 Eu1 O8 130.3(4) 8_655 . ?
O12 K1 O12 89.4(4) 1_566 2_556 ?
O12 K1 O4 90.8(4) 1_566 2_565 ?
O12 K1 O4 179.8(3) 2_556 2_565 ?
O12 K1 O4 179.8(3) 1_566 . ?
O12 K1 O4 90.8(4) 2_556 . ?
O4 K1 O4 88.9(5) 2_565 . ?
O12 K1 O2 106.7(3) 1_566 2_565 ?
O12 K1 O2 106.7(3) 2_556 2_565 ?
O4 K1 O2 73.3(3) 2_565 2_565 ?
O4 K1 O2 73.3(3) . 2_565 ?
O12 K1 O2 106.7(3) 1_566 . ?
O12 K1 O2 106.7(3) 2_556 . ?
O4 K1 O2 73.3(3) 2_565 . ?
O4 K1 O2 73.3(3) . . ?
O2 K1 O2 132.4(7) 2_565 . ?
O12 K1 O1 96.3(4) 1_566 . ?
O12 K1 O1 74.4(4) 2_556 . ?
O4 K1 O1 105.6(4) 2_565 . ?
O4 K1 O1 83.7(4) . . ?
O2 K1 O1 157.0(5) 2_565 . ?
O2 K1 O1 33.9(5) . . ?
O12 K1 O1 74.4(4) 1_566 7_565 ?
O12 K1 O1 96.3(4) 2_556 7_565 ?
O4 K1 O1 83.7(4) 2_565 7_565 ?
O4 K1 O1 105.6(4) . 7_565 ?
O2 K1 O1 157.0(5) 2_565 7_565 ?
O2 K1 O1 33.9(5) . 7_565 ?
O1 K1 O1 31.3(8) . 7_565 ?
O12 K1 O1 96.3(4) 1_566 8_655 ?
O12 K1 O1 74.4(4) 2_556 8_655 ?
O4 K1 O1 105.6(4) 2_565 8_655 ?
O4 K1 O1 83.7(4) . 8_655 ?
O2 K1 O1 33.9(5) 2_565 8_655 ?
O2 K1 O1 157.0(5) . 8_655 ?
O1 K1 O1 146.0(8) . 8_655 ?
O1 K1 O1 167.1(7) 7_565 8_655 ?
O12 K1 O1 74.4(4) 1_566 2_565 ?
O12 K1 O1 96.3(4) 2_556 2_565 ?
O4 K1 O1 83.7(4) 2_565 2_565 ?
O4 K1 O1 105.6(4) . 2_565 ?
O2 K1 O1 33.9(5) 2_565 2_565 ?
O2 K1 O1 157.0(5) . 2_565 ?
O1 K1 O1 167.1(7) . 2_565 ?
O1 K1 O1 146.0(8) 7_565 2_565 ?
O1 K1 O1 31.3(8) 8_655 2_565 ?
O3 N1 O2 83(2) . . ?
O3 N1 O1 111(3) . . ?
O2 N1 O1 83.4(19) . . ?
O3 N1 N1 43.2(15) . 7_565 ?
O2 N1 N1 44.2(13) . 7_565 ?
O1 N1 N1 85.0(13) . 7_565 ?
O4 N2 O5A 122.6(11) . . ?
O4 N2 O6 120.8(5) . 8_655 ?
O4 N2 O6 120.8(5) . . ?
O6 N2 O6 118.3(10) 8_655 . ?
O4 N2 O5B 121.0(11) . . ?
O5A N2 O5B 116.4(10) . . ?
O4 N2 Eu1 179.6(9) . . ?
O5A N2 Eu1 57.8(6) . . ?
O6 N2 Eu1 59.2(5) 8_655 . ?
O6 N2 Eu1 59.2(5) . . ?
O5B N2 Eu1 58.5(6) . . ?
O9 N3 O7 120.2(7) . . ?
O9 N3 O7 120.2(7) . 7 ?
O7 N3 O7 72.5(10) . 7 ?
O9 N3 O8 121.3(7) . . ?
O7 N3 O8 118.4(9) . . ?
O7 N3 O8 75.1(7) 7 . ?
O9 N3 O8 121.3(7) . 7 ?
O7 N3 O8 75.1(7) . 7 ?
O7 N3 O8 118.4(9) 7 7 ?
O8 N3 O8 76.7(9) . 7 ?
O9 N3 Eu1 179.5(6) . . ?
O7 N3 Eu1 59.4(5) . . ?
O7 N3 Eu1 59.4(5) 7 . ?
O8 N3 Eu1 59.0(5) . . ?
O8 N3 Eu1 59.0(5) 7 . ?
O12 N4 O10B 122.0(11) . . ?
O12 N4 O10A 120.9(10) . . ?
O10B N4 O10A 117.2(10) . . ?
O12 N4 O11 122.3(5) . 8_655 ?
O12 N4 O11 122.3(5) . . ?
O11 N4 O11 115.3(10) 8_655 . ?
O12 N4 Eu1 179.0(8) . . ?
O10B N4 Eu1 59.0(7) . . ?
O10A N4 Eu1 58.1(6) . . ?
O11 N4 Eu1 57.7(5) 8_655 . ?
O11 N4 Eu1 57.7(5) . . ?
C8 N5 C4 107.4(7) . . ?
C8 N5 C4 107.5(7) . 7_565 ?
C4 N5 C4 113.6(12) . 7_565 ?
C1 N6 C2 107.1(13) . . ?
C1 N6 C3 110.3(16) . . ?
C2 N6 C3 104.1(13) . . ?
N1 O1 O1 95.0(13) . 7_565 ?
N1 O1 K1 113.8(15) . . ?
O1 O1 K1 74.3(4) 7_565 . ?
N1 O2 N1 92(3) 7_565 . ?
N1 O2 O1 49.3(12) 7_565 7_565 ?
N1 O2 O1 90.8(17) . 7_565 ?
N1 O2 K1 116.9(12) 7_565 . ?
N1 O2 K1 116.9(12) . . ?
O1 O2 K1 73.8(7) 7_565 . ?
N1 O3 N1 94(3) . 7_565 ?
N2 O4 K1 180.0(10) . . ?
N3 O7 O7 53.7(5) . 7 ?
N3 O7 O8 53.4(5) . 7 ?
O7 O7 O8 92.0(4) 7 7 ?
N3 O7 Eu1 96.3(6) . . ?
O7 O7 Eu1 73.6(2) 7 . ?
O8 O7 Eu1 72.4(4) 7 . ?
N3 O8 O7 51.6(5) . 7 ?
N3 O8 O8 51.7(5) . 7 ?
O7 O8 O8 88.0(4) 7 7 ?
N3 O8 Eu1 96.1(6) . . ?
O7 O8 Eu1 73.3(4) 7 . ?
O8 O8 Eu1 72.3(2) 7 . ?
N4 O12 K1 179.0(8) . 1_544 ?
N2 O5A Eu1 97.8(8) . . ?
N4 O10A O10A 167.2(6) . 2 ?
N4 O10A Eu1 97.3(7) . . ?
O10A O10A Eu1 69.8(3) 2 . ?
N2 O5B O5B 166.6(6) . 2 ?
N2 O5B Eu1 96.8(7) . . ?
O5B O5B Eu1 69.8(3) 2 . ?
N4 O10B Eu1 96.6(8) . . ?
N2 O6 Eu1 96.3(6) . . ?
N4 O11 Eu1 97.7(6) . . ?
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
C1 N6 1.478(15) . ?
C1 C1 1.49(2) 7 ?
C2 C2 1.22(5) 7 ?
C2 N6 1.50(2) . ?
C3 C3 1.45(3) 7 ?
C3 N6 1.519(16) . ?
C4 N5 1.475(11) . ?
C4 C5 1.517(16) . ?
C5 C6 1.501(12) . ?
C6 C7 1.46(2) . ?
C6 C5 1.501(12) 7_565 ?
C7 C8 1.52(2) . ?
C8 N5 1.466(19) . ?
Eu1 O11 2.559(8) 8_655 ?
Eu1 O11 2.559(8) 7 ?
Eu1 O11 2.559(8) 2 ?
Eu1 O11 2.559(8) . ?
Eu1 O5A 2.567(12) 2 ?
Eu1 O5A 2.567(12) . ?
Eu1 O10A 2.569(11) 2 ?
Eu1 O10A 2.569(11) . ?
Eu1 O8 2.571(8) 7 ?
Eu1 O8 2.571(8) 2 ?
Eu1 O8 2.571(8) 8_655 ?
Eu1 O8 2.571(8) . ?
K1 O12 2.742(7) 1_566 ?
K1 O12 2.742(7) 2_556 ?
K1 O4 2.743(8) 2_565 ?
K1 O4 2.743(8) . ?
K1 O2 2.887(12) 2_565 ?
K1 O2 2.887(12) . ?
K1 O1 2.91(2) . ?
K1 O1 2.91(2) 7_565 ?
K1 O1 2.91(2) 8_655 ?
K1 O1 2.91(2) 2_565 ?
N1 O3 1.231(18) . ?
N1 O2 1.252(17) . ?
N1 O1 1.291(18) . ?
N1 N1 1.80(5) 7_565 ?
N2 O4 1.201(11) . ?
N2 O5A 1.254(14) . ?
N2 O6 1.255(10) 8_655 ?
N2 O6 1.255(10) . ?
N2 O5B 1.261(15) . ?
N3 O9 1.228(12) . ?
N3 O7 1.232(10) . ?
N3 O7 1.232(10) 7 ?
N3 O8 1.262(10) . ?
N3 O8 1.262(10) 7 ?
N4 O12 1.217(10) . ?
N4 O10B 1.244(14) . ?
N4 O10A 1.256(15) . ?
N4 O11 1.262(10) 8_655 ?
N4 O11 1.262(10) . ?
N5 C4 1.475(11) 7_565 ?
O1 O1 1.57(4) 7_565 ?
O2 N1 1.252(17) 7_565 ?
O2 O1 1.69(2) 7_565 ?
O3 N1 1.231(18) 7_565 ?
O7 O7 1.457(19) 7 ?
O7 O8 1.520(14) 7 ?
O8 O7 1.520(14) 7 ?
O8 O8 1.565(19) 7 ?
O12 K1 2.742(7) 1_544 ?
O10A O10A 1.77(3) 2 ?
O5B O5B 1.78(3) 2 ?
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
N5 C4 C5 C6 -2.7(14) . . . . ?
C4 C5 C6 C7 63.0(13) . . . . ?
C4 C5 C6 C5 -52.0(19) . . . 7_565 ?
C5 C6 C7 C8 -60.0(8) . . . . ?
C5 C6 C7 C8 60.0(8) 7_565 . . . ?
C6 C7 C8 N5 0.000(1) . . . . ?
C7 C8 N5 C4 61.3(7) . . . . ?
C7 C8 N5 C4 -61.3(7) . . . 7_565 ?
C5 C4 N5 C8 -58.1(11) . . . . ?
C5 C4 N5 C4 60.6(15) . . . 7_565 ?
C1 C1 N6 C2 -54.3(14) 7 . . . ?
C1 C1 N6 C3 58.3(16) 7 . . . ?
C2 C2 N6 C1 57.5(12) 7 . . . ?
C2 C2 N6 C3 -59.3(12) 7 . . . ?
C3 C3 N6 C1 -58.5(15) 7 . . . ?
C3 C3 N6 C2 56.1(13) 7 . . . ?
O3 N1 O1 O1 35(2) . . . 7_565 ?
O2 N1 O1 O1 -44.4(13) . . . 7_565 ?
N1 N1 O1 O1 -0.004(6) 7_565 . . 7_565 ?
O3 N1 O1 K1 110(2) . . . . ?
O2 N1 O1 K1 30.7(18) . . . . ?
N1 N1 O1 K1 75.1(9) 7_565 . . . ?
O3 N1 O2 N1 -22(3) . . . 7_565 ?
O1 N1 O2 N1 89.6(18) . . . 7_565 ?
O3 N1 O2 O1 -72(2) . . . 7_565 ?
O1 N1 O2 O1 40.3(15) . . . 7_565 ?
N1 N1 O2 O1 -49.3(12) 7_565 . . 7_565 ?
O3 N1 O2 K1 -144(2) . . . . ?
O1 N1 O2 K1 -32(2) . . . . ?
N1 N1 O2 K1 -121.5(19) 7_565 . . . ?
O2 N1 O3 N1 23(3) . . . 7_565 ?
O1 N1 O3 N1 -57(4) . . . 7_565 ?
O9 N3 O7 O7 115.3(8) . . . 7 ?
O8 N3 O7 O7 -61.5(6) . . . 7 ?
O8 N3 O7 O7 -126.9(7) 7 . . 7 ?
Eu1 N3 O7 O7 -64.3(5) . . . 7 ?
O9 N3 O7 O8 -117.8(7) . . . 7 ?
O7 N3 O7 O8 126.9(7) 7 . . 7 ?
O8 N3 O7 O8 65.4(9) . . . 7 ?
Eu1 N3 O7 O8 62.6(5) . . . 7 ?
O9 N3 O7 Eu1 179.6(5) . . . . ?
O7 N3 O7 Eu1 64.3(5) 7 . . . ?
O8 N3 O7 Eu1 2.9(7) . . . . ?
O8 N3 O7 Eu1 -62.6(5) 7 . . . ?
O9 N3 O8 O7 -116.6(7) . . . 7 ?
O7 N3 O8 O7 60.1(9) . . . 7 ?
O8 N3 O8 O7 124.7(7) 7 . . 7 ?
Eu1 N3 O8 O7 63.0(5) . . . 7 ?
O9 N3 O8 O8 118.7(9) . . . 7 ?
O7 N3 O8 O8 -64.6(6) . . . 7 ?
O7 N3 O8 O8 -124.7(7) 7 . . 7 ?
Eu1 N3 O8 O8 -61.7(6) . . . 7 ?
O9 N3 O8 Eu1 -179.6(5) . . . . ?
O7 N3 O8 Eu1 -2.9(7) . . . . ?
O7 N3 O8 Eu1 -63.0(5) 7 . . . ?
O8 N3 O8 Eu1 61.7(6) 7 . . . ?
O4 N2 O5A Eu1 180.000(2) . . . . ?
O6 N2 O5A Eu1 63.7(5) 8_655 . . . ?
O6 N2 O5A Eu1 -63.7(5) . . . . ?
O5B N2 O5A Eu1 0.000(2) . . . . ?
O12 N4 O10A O10A 180.000(3) . . . 2 ?
O10B N4 O10A O10A 0.000(4) . . . 2 ?
O11 N4 O10A O10A -61.5(5) 8_655 . . 2 ?
O11 N4 O10A O10A 61.5(5) . . . 2 ?
Eu1 N4 O10A O10A 0.000(3) . . . 2 ?
O12 N4 O10A Eu1 180.000(1) . . . . ?
O10B N4 O10A Eu1 0.000(1) . . . . ?
O11 N4 O10A Eu1 -61.5(5) 8_655 . . . ?
O11 N4 O10A Eu1 61.5(5) . . . . ?
O4 N2 O5B O5B 180.000(10) . . . 2 ?
O5A N2 O5B O5B 0.000(11) . . . 2 ?
O6 N2 O5B O5B -62.6(5) 8_655 . . 2 ?
O6 N2 O5B O5B 62.6(5) . . . 2 ?
Eu1 N2 O5B O5B 0.000(10) . . . 2 ?
O4 N2 O5B Eu1 180.000(2) . . . . ?
O5A N2 O5B Eu1 0.000(2) . . . . ?
O6 N2 O5B Eu1 -62.6(5) 8_655 . . . ?
O6 N2 O5B Eu1 62.6(5) . . . . ?
O12 N4 O10B Eu1 180.000(1) . . . . ?
O10A N4 O10B Eu1 0.000(1) . . . . ?
O11 N4 O10B Eu1 61.7(5) 8_655 . . . ?
O11 N4 O10B Eu1 -61.7(5) . . . . ?
O4 N2 O6 Eu1 -179.5(10) . . . . ?
O5A N2 O6 Eu1 62.0(6) . . . . ?
O6 N2 O6 Eu1 2.2(13) 8_655 . . . ?
O5B N2 O6 Eu1 -61.8(6) . . . . ?
O12 N4 O11 Eu1 -178.8(9) . . . . ?
O10B N4 O11 Eu1 63.3(7) . . . . ?
O10A N4 O11 Eu1 -62.1(6) . . . . ?
O11 N4 O11 Eu1 1.0(12) 8_655 . . . ?
