#------------------------------------------------------------------------------
#$Date: 2016-03-23 00:43:47 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179125 $
#$URL: svn://www.crystallography.net/cod/cif/4/30/87/4308713.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_4308713
loop_
_publ_author_name
'Marat Moustiakimov'
'Mikael Kritikos'
'Gunnar Westin'
_publ_contact_author_address
;
Dept. of Structural Chemistry
Arrhenius Laboratory
Stockholm University
S-106 91 Stockholm
Sweden
;
_publ_contact_author_email       mkr@struc.su.se
_publ_contact_author_fax         46(8)163118
_publ_contact_author_name
;
Mikael Kritikos 
;
_publ_contact_author_phone       46(8)161440
_publ_section_title
;
First Example of Low-Valence Ion Substitution in Ln5O(OPri)13:
Mixed-Valence Europium Oxoalkoxide [EuIII4EuIIO(OPri)12(HOPri)]*HOPri
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              1499
_journal_page_last               1504
_journal_paper_doi               10.1021/ic048575a
_journal_volume                  44
_journal_year                    2005
_chemical_formula_sum            'C42 H100 Eu5 O15'
_chemical_formula_weight         1605.02
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           1
_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_date             'October 11, 2002'
_audit_creation_method           SHELXL-97
_audit_update_record
; 'November 2, 2004'
Text added by MK
'November 2, 2004'
;
_cell_angle_alpha                98.214(14)
_cell_angle_beta                 98.863(15)
_cell_angle_gamma                118.129(12)
_cell_formula_units_Z            2
_cell_length_a                   12.9810(16)
_cell_length_b                   13.1342(14)
_cell_length_c                   21.336(3)
_cell_measurement_reflns_used    5000
_cell_measurement_temperature    110(2)
_cell_measurement_theta_max      26.02
_cell_measurement_theta_min      2.34
_cell_volume                     3071.2(8)
_computing_cell_refinement       'IPDS Software, Stoe & Cie (1997)'
_computing_data_collection       'IPDS Software, by Stoe & Cie (1997)'
_computing_data_reduction        'IPDS Software,  Stoe & Cie (1997)'
_computing_molecular_graphics
'PLATON99 (Spek, 2000), DIAMOND (Brandenburg, 1999)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      110(2)
_diffrn_detector_area_resol_mean 6.67
_diffrn_measured_fraction_theta_full .918
_diffrn_measured_fraction_theta_max .918
_diffrn_measurement_device_type  'STOE IPDS'
_diffrn_measurement_method       'phi oscillation'
_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  0.1035
_diffrn_reflns_av_sigmaI/netI    0.0318
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            23021
_diffrn_reflns_theta_full        26.02
_diffrn_reflns_theta_max         26.02
_diffrn_reflns_theta_min         2.34
_exptl_absorpt_coefficient_mu    5.081
_exptl_crystal_colour            yellow-orange
_exptl_crystal_density_diffrn    1.736
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1574
_exptl_crystal_size_max          0.35
_exptl_crystal_size_mid          0.25
_exptl_crystal_size_min          0.15
_refine_diff_density_max         2.717
_refine_diff_density_min         -2.680
_refine_diff_density_rms         .248
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.05(3)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.032
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1017
_refine_ls_number_reflns         19412
_refine_ls_number_restraints     74
_refine_ls_restrained_S_all      1.030
_refine_ls_R_factor_all          0.0734
_refine_ls_R_factor_gt           0.0715
_refine_ls_shift/su_max          0.004
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.1286P)²+45.5372P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1857
_refine_ls_wR_factor_ref         0.1873
_reflns_number_gt                18510
_reflns_number_total             19412
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic048575asi20041115_025104.cif
_cod_data_source_block           eu5
_cod_original_cell_volume        3071.3(6)
_cod_database_code               4308713
loop_
_symmetry_equiv_pos_as_xyz
'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
_atom_site_disorder_assembly
_atom_site_disorder_group
Eu1 Eu 0.23879(7) 0.08322(7) 0.69381(4) 0.02406(18) Uani 1 1 d . C .
Eu2 Eu -0.06590(7) -0.00007(8) 0.67317(4) 0.02612(19) Uani 1 1 d . C .
Eu3 Eu 0.17883(7) -0.12851(8) 0.78556(4) 0.02820(19) Uani 1 1 d . . .
Eu4 Eu -0.11913(7) -0.20889(9) 0.76089(4) 0.0335(2) Uani 1 1 d . C .
Eu5 Eu 0.00202(7) -0.22425(8) 0.62361(4) 0.02762(19) Uani 1 1 d . C .
O29 O 0.0491(10) -0.0804(10) 0.7210(4) 0.019(2) Uani 1 1 d . C .
O_1 O -0.2690(11) -0.3446(12) 0.7818(6) 0.037(3) Uani 1 1 d . . .
C_1 C -0.3638(16) -0.4334(19) 0.8004(8) 0.037(4) Uani 1 1 d . C .
H0_1 H -0.3537 -0.5047 0.7978 0.044 Uiso 1 1 calc R . .
C1_1 C -0.357(2) -0.384(3) 0.8702(9) 0.057(7) Uani 1 1 d . . .
H1A_1 H -0.2721 -0.3299 0.8939 0.069 Uiso 1 1 calc R C .
H1B_1 H -0.3926 -0.4501 0.8912 0.069 Uiso 1 1 calc R . .
H1C_1 H -0.4012 -0.3412 0.8707 0.069 Uiso 1 1 calc R . .
C2_1 C -0.485(2) -0.470(2) 0.7580(10) 0.054(6) Uani 1 1 d . . .
H2A_1 H -0.5166 -0.4221 0.7779 0.065 Uiso 1 1 calc R C .
H2B_1 H -0.5408 -0.5543 0.7538 0.065 Uiso 1 1 calc R . .
H2C_1 H -0.4768 -0.4564 0.7146 0.065 Uiso 1 1 calc R . .
O_2 O 0.2065(13) -0.1312(14) 0.6743(5) 0.038(3) Uani 1 1 d . C .
C_2 C 0.304(2) -0.143(2) 0.6546(16) 0.060(7) Uani 1 1 d . . .
H0_2 H 0.3824 -0.0837 0.6871 0.072 Uiso 1 1 calc R C .
C1_2 C 0.312(3) -0.118(3) 0.5903(11) 0.064(8) Uani 1 1 d . C .
H1A_2 H 0.3912 -0.1001 0.5835 0.076 Uiso 1 1 calc R . .
H1B_2 H 0.3012 -0.0495 0.5882 0.076 Uiso 1 1 calc R . .
H1C_2 H 0.2485 -0.1877 0.5562 0.076 Uiso 1 1 calc R . .
C2_2 C 0.288(4) -0.263(3) 0.6517(18) 0.093(12) Uani 1 1 d . C .
H2A_2 H 0.2268 -0.3189 0.6118 0.111 Uiso 1 1 calc R . .
H2B_2 H 0.2624 -0.2890 0.6901 0.111 Uiso 1 1 calc R . .
H2C_2 H 0.3649 -0.2600 0.6511 0.111 Uiso 1 1 calc R . .
O_3 O 0.1132(12) 0.1790(11) 0.7120(5) 0.031(3) Uani 1 1 d . . .
C_3 C 0.146(2) 0.2669(17) 0.7712(8) 0.043(5) Uani 1 1 d D B .
H0_3 H 0.2267 0.3387 0.7771 0.051 Uiso 1 1 calc R A 1
C1_3 C 0.1394(19) 0.2149(18) 0.8309(8) 0.045(5) Uani 1 1 d D . .
H1A_3 H 0.0549 0.1685 0.8323 0.053 Uiso 1 1 calc R C .
H1B_3 H 0.1849 0.2798 0.8707 0.053 Uiso 1 1 calc R . .
H1C_3 H 0.1743 0.1631 0.8281 0.053 Uiso 1 1 calc R . .
C2A_3 C 0.045(3) 0.296(4) 0.7594(19) 0.058(8) Uiso 0.64(4) 1 d PD B 1
H2A1_3 H 0.0256 0.2991 0.7137 0.069 Uiso 0.64(4) 1 calc PR B 1
H2A2_3 H 0.0708 0.3737 0.7882 0.069 Uiso 0.64(4) 1 calc PR B 1
H2A3_3 H -0.0274 0.2346 0.7688 0.069 Uiso 0.64(4) 1 calc PR B 1
C2B_3 C 0.158(7) 0.388(4) 0.771(3) 0.058(8) Uiso 0.36(4) 1 d PD B 2
H2B1_3 H 0.1527 0.3976 0.7257 0.069 Uiso 0.36(4) 1 calc PR B 2
H2B2_3 H 0.2370 0.4505 0.7989 0.069 Uiso 0.36(4) 1 calc PR B 2
H2B3_3 H 0.0938 0.3926 0.7867 0.069 Uiso 0.36(4) 1 calc PR B 2
O_4 O 0.0474(11) -0.1455(13) 0.8473(5) 0.035(3) Uani 1 1 d . C .
C_4 C 0.048(2) -0.129(3) 0.9142(9) 0.064(8) Uani 1 1 d . . .
H0_4 H -0.0190 -0.1194 0.9260 0.077 Uiso 1 1 calc R C .
C1_4 C 0.180(3) -0.031(3) 0.9550(14) 0.095(12) Uani 1 1 d . C .
H1A_4 H 0.2388 -0.0450 0.9367 0.113 Uiso 1 1 calc R . .
H1B_4 H 0.1903 -0.0366 1.0007 0.113 Uiso 1 1 calc R . .
H1C_4 H 0.1939 0.0478 0.9529 0.113 Uiso 1 1 calc R . .
C2_4 C 0.067(7) -0.252(9) 0.940(2) 0.39(10) Uani 1 1 d . C .
H2A_4 H 0.0297 -0.3220 0.9033 0.466 Uiso 1 1 calc R . .
H2B_4 H 0.0277 -0.2737 0.9761 0.466 Uiso 1 1 calc R . .
H2C_4 H 0.1531 -0.2245 0.9557 0.466 Uiso 1 1 calc R . .
O_5 O 0.0435(10) -0.0418(10) 0.5976(5) 0.023(2) Uani 1 1 d . . .
C_5 C 0.0185(16) -0.0193(19) 0.5364(7) 0.032(4) Uani 1 1 d . C .
H0_5 H 0.0142 0.0553 0.5418 0.038 Uiso 1 1 calc R . .
C1_5 C 0.127(2) -0.005(2) 0.5058(9) 0.050(6) Uani 1 1 d . . .
H1A_5 H 0.2027 0.0621 0.5344 0.060 Uiso 1 1 calc R C .
H1B_5 H 0.1139 0.0110 0.4626 0.060 Uiso 1 1 calc R . .
H1C_5 H 0.1306 -0.0780 0.5014 0.060 Uiso 1 1 calc R . .
C2_5 C -0.098(2) -0.124(2) 0.4885(9) 0.052(6) Uani 1 1 d . . .
H2A_5 H -0.1051 -0.1996 0.4948 0.063 Uiso 1 1 calc R C .
H2B_5 H -0.0937 -0.1195 0.4434 0.063 Uiso 1 1 calc R . .
H2C_5 H -0.1678 -0.1199 0.4968 0.063 Uiso 1 1 calc R . .
O_6 O -0.0178(12) -0.3093(11) 0.7177(6) 0.035(3) Uani 1 1 d D C .
CA_6 C -0.073(4) -0.432(2) 0.7156(13) 0.054(8) Uiso 0.49(4) 1 d PD C 1
HA_6 H -0.1604 -0.4731 0.6927 0.065 Uiso 0.49(4) 1 calc PR C 1
C1A_6 C -0.058(2) -0.452(3) 0.7838(11) 0.062(6) Uiso 0.49(4) 1 d PD C 1
H1A1_6 H 0.0276 -0.4219 0.8035 0.074 Uiso 0.49(4) 1 calc PR C 1
H1A2_6 H -0.1046 -0.5375 0.7812 0.074 Uiso 0.49(4) 1 calc PR C 1
H1A3_6 H -0.0873 -0.4097 0.8107 0.074 Uiso 0.49(4) 1 calc PR C 1
C2A_6 C -0.009(6) -0.481(6) 0.677(3) 0.072(11) Uiso 0.49(4) 1 d PD C 1
H2A1_6 H 0.0305 -0.4281 0.6501 0.087 Uiso 0.49(4) 1 calc PR C 1
H2A2_6 H -0.0691 -0.5607 0.6491 0.087 Uiso 0.49(4) 1 calc PR C 1
H2A3_6 H 0.0509 -0.4875 0.7078 0.087 Uiso 0.49(4) 1 calc PR C 1
CB_6 C -0.005(4) -0.410(3) 0.7268(16) 0.054(8) Uiso 0.51(4) 1 d PD C 2
HB_6 H 0.0812 -0.3885 0.7352 0.065 Uiso 0.51(4) 1 calc PR C 2
C1B_6 C -0.058(2) -0.452(3) 0.7838(11) 0.062(6) Uiso 0.51(4) 1 d PD C 2
H1B1_6 H 0.0077 -0.4333 0.8212 0.074 Uiso 0.51(4) 1 calc PR C 2
H1B2_6 H -0.1138 -0.5383 0.7703 0.074 Uiso 0.51(4) 1 calc PR C 2
H1B3_6 H -0.1013 -0.4115 0.7963 0.074 Uiso 0.51(4) 1 calc PR C 2
C2B_6 C -0.079(6) -0.503(5) 0.662(2) 0.072(11) Uiso 0.51(4) 1 d PD C 2
H2B1_6 H -0.1645 -0.5463 0.6628 0.087 Uiso 0.51(4) 1 calc PR C 2
H2B2_6 H -0.0499 -0.5592 0.6559 0.087 Uiso 0.51(4) 1 calc PR C 2
H2B3_6 H -0.0712 -0.4636 0.6260 0.087 Uiso 0.51(4) 1 calc PR C 2
O_7 O 0.3180(11) 0.0629(12) 0.8007(6) 0.035(3) Uani 1 1 d . C .
C_7 C 0.428(2) 0.149(2) 0.8493(11) 0.054(6) Uani 1 1 d . . .
H0_7 H 0.4031 0.1430 0.8913 0.065 Uiso 1 1 calc R C .
C1_7 C 0.470(2) 0.271(3) 0.8485(15) 0.070(8) Uani 1 1 d . C .
H1A_7 H 0.5089 0.2887 0.8126 0.084 Uiso 1 1 calc R . .
H1B_7 H 0.5281 0.3224 0.8902 0.084 Uiso 1 1 calc R . .
H1C_7 H 0.4012 0.2839 0.8423 0.084 Uiso 1 1 calc R . .
C2_7 C 0.517(2) 0.112(3) 0.8563(12) 0.066(8) Uani 1 1 d . C .
H2A_7 H 0.4803 0.0314 0.8629 0.080 Uiso 1 1 calc R . .
H2B_7 H 0.5844 0.1672 0.8942 0.080 Uiso 1 1 calc R . .
H2C_7 H 0.5465 0.1135 0.8167 0.080 Uiso 1 1 calc R . .
O_8 O -0.1702(10) -0.2237(13) 0.6417(5) 0.037(3) Uani 1 1 d . . .
C_8 C -0.2938(16) -0.296(2) 0.5974(10) 0.052(7) Uani 1 1 d . C .
H0_8 H -0.2948 -0.2731 0.5546 0.063 Uiso 1 1 calc R . .
C1_8 C -0.3861(18) -0.277(2) 0.6302(11) 0.055(6) Uani 1 1 d . . .
H1A_8 H -0.3630 -0.2678 0.6775 0.066 Uiso 1 1 calc R C .
H1B_8 H -0.4674 -0.3458 0.6114 0.066 Uiso 1 1 calc R . .
H1C_8 H -0.3852 -0.2048 0.6221 0.066 Uiso 1 1 calc R . .
C2_8 C -0.328(2) -0.425(2) 0.5866(13) 0.065(7) Uani 1 1 d . . .
H2A_8 H -0.2734 -0.4386 0.5643 0.077 Uiso 1 1 calc R C .
H2B_8 H -0.4113 -0.4755 0.5595 0.077 Uiso 1 1 calc R . .
H2C_8 H -0.3223 -0.4457 0.6289 0.077 Uiso 1 1 calc R . .
O_9 O -0.1503(11) -0.0501(13) 0.7597(6) 0.036(3) Uani 1 1 d D . .
CA_9 C -0.246(3) -0.060(4) 0.7862(14) 0.033(6) Uiso 0.46(2) 1 d PD C 1
HA_9 H -0.3109 -0.1452 0.7685 0.040 Uiso 0.46(2) 1 calc PR C 1
C1A_9 C -0.214(5) -0.045(5) 0.8600(15) 0.049(7) Uiso 0.46(2) 1 d PD C 1
H1A1_9 H -0.1839 -0.0989 0.8694 0.059 Uiso 0.46(2) 1 calc PR C 1
H1A2_9 H -0.2855 -0.0647 0.8766 0.059 Uiso 0.46(2) 1 calc PR C 1
H1A3_9 H -0.1507 0.0374 0.8814 0.059 Uiso 0.46(2) 1 calc PR C 1
C2A_9 C -0.295(6) 0.007(6) 0.751(3) 0.069(10) Uiso 0.46(2) 1 d PD C 1
H2A1_9 H -0.2276 0.0792 0.7449 0.082 Uiso 0.46(2) 1 calc PR C 1
H2A2_9 H -0.3409 0.0296 0.7763 0.082 Uiso 0.46(2) 1 calc PR C 1
H2A3_9 H -0.3481 -0.0441 0.7076 0.082 Uiso 0.46(2) 1 calc PR C 1
CB_9 C -0.198(3) 0.012(3) 0.7967(14) 0.033(6) Uiso 0.54(2) 1 d PD C 2
HB_9 H -0.1363 0.0622 0.8390 0.040 Uiso 0.54(2) 1 calc PR C 2
C1B_9 C -0.316(3) -0.071(4) 0.813(2) 0.049(7) Uiso 0.54(2) 1 d PD C 2
H1B1_9 H -0.3741 -0.1289 0.7722 0.059 Uiso 0.54(2) 1 calc PR C 2
H1B2_9 H -0.3484 -0.0246 0.8321 0.059 Uiso 0.54(2) 1 calc PR C 2
H1B3_9 H -0.2998 -0.1139 0.8434 0.059 Uiso 0.54(2) 1 calc PR C 2
C2B_9 C -0.229(5) 0.092(5) 0.763(2) 0.069(10) Uiso 0.54(2) 1 d PD C 2
H2B1_9 H -0.1675 0.1756 0.7834 0.082 Uiso 0.54(2) 1 calc PR C 2
H2B2_9 H -0.3081 0.0788 0.7675 0.082 Uiso 0.54(2) 1 calc PR C 2
H2B3_9 H -0.2312 0.0736 0.7165 0.082 Uiso 0.54(2) 1 calc PR C 2
O_10 O -0.1781(13) 0.0324(18) 0.6062(7) 0.053(4) Uani 1 1 d . . .
C_10 C -0.236(3) 0.043(2) 0.5454(16) 0.111(16) Uani 1 1 d D C .
H0_10 H -0.2058 0.0069 0.5135 0.133 Uiso 1 1 calc R D 1
C1_10 C -0.171(2) 0.171(2) 0.5412(14) 0.067(7) Uani 1 1 d D . .
H1A_10 H -0.2046 0.1767 0.4985 0.080 Uiso 1 1 calc R C .
H1B_10 H -0.0846 0.1983 0.5464 0.080 Uiso 1 1 calc R . .
H1C_10 H -0.1805 0.2202 0.5760 0.080 Uiso 1 1 calc R . .
C2A_10 C -0.363(7) -0.060(12) 0.535(7) 0.048(7) Uiso 0.15(6) 1 d PD C 1
H2A1_10 H -0.4041 -0.0372 0.5637 0.058 Uiso 0.15(6) 1 calc PR C 1
H2A2_10 H -0.3598 -0.1295 0.5442 0.058 Uiso 0.15(6) 1 calc PR C 1
H2A3_10 H -0.4074 -0.0802 0.4890 0.058 Uiso 0.15(6) 1 calc PR C 1
C2B_10 C -0.366(2) -0.005(3) 0.5461(13) 0.048(7) Uiso 0.85(6) 1 d PD C 2
H2B1_10 H -0.3721 0.0515 0.5783 0.058 Uiso 0.85(6) 1 calc PR C 2
H2B2_10 H -0.3970 -0.0817 0.5577 0.058 Uiso 0.85(6) 1 calc PR C 2
H2B3_10 H -0.4127 -0.0157 0.5026 0.058 Uiso 0.85(6) 1 calc PR C 2
O_11 O -0.0406(18) -0.3525(15) 0.5376(6) 0.061(5) Uani 1 1 d D . .
CA_11 C -0.091(4) -0.421(3) 0.4707(11) 0.042(7) Uiso 0.49(3) 1 d PD C 1
HA_11 H -0.1484 -0.4015 0.4454 0.050 Uiso 0.49(3) 1 calc PR C 1
C1A_11 C -0.002(8) -0.426(7) 0.434(6) 0.13(2) Uiso 0.49(3) 1 d PD C 1
H1A1_11 H 0.0249 -0.3618 0.4112 0.155 Uiso 0.49(3) 1 calc PR C 1
H1A2_11 H -0.0406 -0.5030 0.4021 0.155 Uiso 0.49(3) 1 calc PR C 1
H1A3_11 H 0.0682 -0.4160 0.4651 0.155 Uiso 0.49(3) 1 calc PR C 1
C2A_11 C -0.152(5) -0.549(4) 0.477(3) 0.074(11) Uiso 0.49(3) 1 d PD C 1
H2A1_11 H -0.1197 -0.5514 0.5214 0.089 Uiso 0.49(3) 1 calc PR C 1
H2A2_11 H -0.1361 -0.5978 0.4450 0.089 Uiso 0.49(3) 1 calc PR C 1
H2A3_11 H -0.2393 -0.5817 0.4694 0.089 Uiso 0.49(3) 1 calc PR C 1
CB_11 C -0.040(4) -0.426(3) 0.4818(15) 0.042(7) Uiso 0.51(3) 1 d PD C 2
HB_11 H -0.0024 -0.4718 0.4965 0.050 Uiso 0.51(3) 1 calc PR C 2
C1B_11 C 0.017(10) -0.366(10) 0.431(5) 0.13(2) Uiso 0.51(3) 1 d PD C 2
H1B1_11 H -0.0302 -0.3337 0.4103 0.155 Uiso 0.51(3) 1 calc PR C 2
H1B2_11 H 0.0174 -0.4252 0.3973 0.155 Uiso 0.51(3) 1 calc PR C 2
H1B3_11 H 0.0996 -0.3018 0.4516 0.155 Uiso 0.51(3) 1 calc PR C 2
C2B_11 C -0.177(4) -0.510(6) 0.454(3) 0.074(11) Uiso 0.51(3) 1 d PD C 2
H2B1_11 H -0.2054 -0.5713 0.4790 0.089 Uiso 0.51(3) 1 calc PR C 2
H2B2_11 H -0.1934 -0.5485 0.4080 0.089 Uiso 0.51(3) 1 calc PR C 2
H2B3_11 H -0.2187 -0.4650 0.4580 0.089 Uiso 0.51(3) 1 calc PR C 2
O_12 O 0.4265(15) 0.2215(18) 0.6592(8) 0.055(4) Uani 1 1 d . . .
C_12 C 0.546(2) 0.270(3) 0.6546(13) 0.062(7) Uani 1 1 d . C .
H0_12 H 0.5846 0.3582 0.6696 0.074 Uiso 1 1 calc R . .
C1_12 C 0.540(2) 0.239(3) 0.5780(12) 0.060(7) Uani 1 1 d . . .
H1A_12 H 0.5849 0.1983 0.5707 0.072 Uiso 1 1 calc R C .
H1B_12 H 0.5756 0.3135 0.5636 0.072 Uiso 1 1 calc R . .
H1C_12 H 0.4554 0.1880 0.5530 0.072 Uiso 1 1 calc R . .
C2_12 C 0.615(3) 0.236(4) 0.6952(14) 0.086(10) Uani 1 1 d . . .
H2A_12 H 0.5903 0.2294 0.7362 0.103 Uiso 1 1 calc R C .
H2B_12 H 0.7009 0.2960 0.7047 0.103 Uiso 1 1 calc R . .
H2C_12 H 0.6021 0.1586 0.6727 0.103 Uiso 1 1 calc R . .
O_13 O 0.2758(18) -0.2039(18) 0.8278(9) 0.067(5) Uani 1 1 d D C .
CA_13 C 0.354(3) -0.248(4) 0.844(2) 0.050(8) Uiso 0.50(3) 1 d PD C 1
HA_13 H 0.3082 -0.3187 0.8051 0.060 Uiso 0.50(3) 1 calc PR C 1
C1A_13 C 0.289(7) -0.319(7) 0.889(3) 0.094(15) Uiso 0.50(3) 1 d PD C 1
H1A1_13 H 0.3344 -0.2764 0.9346 0.112 Uiso 0.50(3) 1 calc PR C 1
H1A2_13 H 0.2813 -0.3975 0.8798 0.112 Uiso 0.50(3) 1 calc PR C 1
H1A3_13 H 0.2082 -0.3279 0.8823 0.112 Uiso 0.50(3) 1 calc PR C 1
C2A_13 C 0.474(5) -0.219(10) 0.828(5) 0.12(2) Uiso 0.50(3) 1 d PD C 1
H2A1_13 H 0.4594 -0.2725 0.7871 0.149 Uiso 0.50(3) 1 calc PR C 1
H2A2_13 H 0.5239 -0.2282 0.8638 0.149 Uiso 0.50(3) 1 calc PR C 1
H2A3_13 H 0.5151 -0.1362 0.8247 0.149 Uiso 0.50(3) 1 calc PR C 1
CB_13 C 0.318(4) -0.259(4) 0.8701(18) 0.050(8) Uiso 0.50(3) 1 d PD C 2
HB_13 H 0.2577 -0.3072 0.8936 0.060 Uiso 0.50(3) 1 calc PR C 2
C1B_13 C 0.437(5) -0.160(5) 0.915(3) 0.094(15) Uiso 0.50(3) 1 d PD C 2
H1B1_13 H 0.4496 -0.0825 0.9089 0.112 Uiso 0.50(3) 1 calc PR C 2
H1B2_13 H 0.5032 -0.1701 0.9050 0.112 Uiso 0.50(3) 1 calc PR C 2
H1B3_13 H 0.4361 -0.1618 0.9608 0.112 Uiso 0.50(3) 1 calc PR C 2
C2B_13 C 0.365(7) -0.327(7) 0.832(4) 0.12(2) Uiso 0.50(3) 1 d PD C 2
H2B1_13 H 0.2985 -0.4063 0.8085 0.149 Uiso 0.50(3) 1 calc PR C 2
H2B2_13 H 0.4247 -0.3344 0.8628 0.149 Uiso 0.50(3) 1 calc PR C 2
H2B3_13 H 0.4042 -0.2835 0.8011 0.149 Uiso 0.50(3) 1 calc PR C 2
O_14 O 0.2475(11) 0.2730(12) 0.6313(6) 0.032(3) Uani 1 1 d . . .
C_14 C 0.219(2) 0.324(2) 0.5870(10) 0.046(5) Uiso 1 1 d . C .
H0_14 H 0.1378 0.2618 0.5580 0.055 Uiso 1 1 calc R . .
C1_14 C 0.306(2) 0.349(2) 0.5450(11) 0.054(6) Uiso 1 1 d . . .
H1A_14 H 0.3683 0.3311 0.5630 0.065 Uiso 1 1 calc R C .
H1B_14 H 0.3449 0.4335 0.5443 0.065 Uiso 1 1 calc R . .
H1C_14 H 0.2634 0.2995 0.5003 0.065 Uiso 1 1 calc R . .
C2_14 C 0.206(3) 0.428(3) 0.6143(16) 0.081(9) Uiso 1 1 d . . .
H2A_14 H 0.1444 0.4034 0.6393 0.098 Uiso 1 1 calc R C .
H2B_14 H 0.1810 0.4573 0.5782 0.098 Uiso 1 1 calc R . .
H2C_14 H 0.2832 0.4923 0.6430 0.098 Uiso 1 1 calc R . .
Eu6 Eu 0.51997(8) 0.67918(8) 0.17008(4) 0.0302(2) Uani 1 1 d . E .
Eu7 Eu 0.33592(8) 0.68646(9) 0.26719(4) 0.0352(2) Uani 1 1 d . . .
Eu8 Eu 0.45938(10) 0.39950(9) 0.19151(4) 0.0395(2) Uani 1 1 d . . .
Eu9 Eu 0.21585(8) 0.44507(9) 0.12621(4) 0.0337(2) Uani 1 1 d . E .
Eu10 Eu 0.27272(10) 0.40967(11) 0.28714(5) 0.0438(3) Uani 1 1 d . E .
O30 O 0.3832(12) 0.5371(12) 0.2211(5) 0.031(3) Uani 1 1 d . E .
O_15 O 0.3108(13) 0.6558(15) 0.1479(6) 0.044(4) Uani 1 1 d D E .
CA_15 C 0.298(4) 0.750(3) 0.130(2) 0.093(12) Uiso 0.62(4) 1 d PD E 1
HA_15 H 0.3574 0.8313 0.1587 0.112 Uiso 0.62(4) 1 calc PR E 1
C1A_15 C 0.302(5) 0.735(6) 0.058(2) 0.087(13) Uiso 0.62(4) 1 d PD E 1
H1A1_15 H 0.3835 0.7523 0.0553 0.105 Uiso 0.62(4) 1 calc PR E 1
H1A2_15 H 0.2839 0.7905 0.0395 0.105 Uiso 0.62(4) 1 calc PR E 1
H1A3_15 H 0.2431 0.6532 0.0335 0.105 Uiso 0.62(4) 1 calc PR E 1
C2A_15 C 0.166(4) 0.719(6) 0.119(3) 0.085(13) Uiso 0.62(4) 1 d PD E 1
H2A1_15 H 0.1198 0.6450 0.1319 0.102 Uiso 0.62(4) 1 calc PR E 1
H2A2_15 H 0.1325 0.7078 0.0723 0.102 Uiso 0.62(4) 1 calc PR E 1
H2A3_15 H 0.1615 0.7836 0.1449 0.102 Uiso 0.62(4) 1 calc PR E 1
CB_15 C 0.292(9) 0.740(6) 0.121(3) 0.093(12) Uiso 0.38(4) 1 d PD E 2
HB_15 H 0.3692 0.7966 0.1109 0.112 Uiso 0.38(4) 1 calc PR E 2
C1B_15 C 0.204(8) 0.654(9) 0.057(4) 0.087(13) Uiso 0.38(4) 1 d PD E 2
H1B1_15 H 0.2481 0.6459 0.0250 0.105 Uiso 0.38(4) 1 calc PR E 2
H1B2_15 H 0.1532 0.6860 0.0390 0.105 Uiso 0.38(4) 1 calc PR E 2
H1B3_15 H 0.1520 0.5766 0.0644 0.105 Uiso 0.38(4) 1 calc PR E 2
C2B_15 C 0.246(9) 0.812(9) 0.157(4) 0.085(13) Uiso 0.38(4) 1 d PD E 2
H2B1_15 H 0.1602 0.7606 0.1533 0.102 Uiso 0.38(4) 1 calc PR E 2
H2B2_15 H 0.2577 0.8781 0.1367 0.102 Uiso 0.38(4) 1 calc PR E 2
H2B3_15 H 0.2912 0.8434 0.2027 0.102 Uiso 0.38(4) 1 calc PR E 2
O_16 O 0.5301(13) 0.8068(12) 0.2629(6) 0.037(3) Uani 1 1 d . E .
C_16 C 0.621(2) 0.929(2) 0.2857(9) 0.043(5) Uani 1 1 d . . .
H0_16 H 0.6937 0.9428 0.2695 0.051 Uiso 1 1 calc R E .
C1_16 C 0.578(3) 1.007(3) 0.2654(14) 0.066(7) Uani 1 1 d . E .
H1A_16 H 0.5216 0.9679 0.2219 0.079 Uiso 1 1 calc R . .
H1B_16 H 0.6470 1.0821 0.2637 0.079 Uiso 1 1 calc R . .
H1C_16 H 0.5371 1.0236 0.2969 0.079 Uiso 1 1 calc R . .
C2_16 C 0.653(2) 0.956(3) 0.3581(11) 0.068(8) Uani 1 1 d . E .
H2A_16 H 0.5842 0.9527 0.3739 0.082 Uiso 1 1 calc R . .
H2B_16 H 0.7231 1.0367 0.3757 0.082 Uiso 1 1 calc R . .
H2C_16 H 0.6715 0.8983 0.3727 0.082 Uiso 1 1 calc R . .
O_17 O 0.1572(12) 0.4857(13) 0.2238(5) 0.037(3) Uani 1 1 d . E .
C_17 C 0.043(3) 0.454(3) 0.232(2) 0.077(9) Uani 1 1 d . . .
H0_17 H 0.0500 0.4633 0.2804 0.092 Uiso 1 1 calc R E .
C1_17 C -0.053(3) 0.325(3) 0.1993(17) 0.096(14) Uani 1 1 d . E .
H1A_17 H -0.0627 0.3110 0.1519 0.115 Uiso 1 1 calc R . .
H1B_17 H -0.1299 0.3086 0.2090 0.115 Uiso 1 1 calc R . .
H1C_17 H -0.0283 0.2717 0.2159 0.115 Uiso 1 1 calc R . .
C2_17 C -0.006(4) 0.536(4) 0.211(2) 0.111(13) Uiso 1 1 d . E .
H2A_17 H 0.0620 0.6175 0.2192 0.133 Uiso 1 1 calc R . .
H2B_17 H -0.0631 0.5355 0.2358 0.133 Uiso 1 1 calc R . .
H2C_17 H -0.0461 0.5062 0.1639 0.133 Uiso 1 1 calc R . .
O_18 O 0.3987(13) 0.4764(12) 0.0958(5) 0.036(3) Uani 1 1 d . E .
C_18 C 0.412(2) 0.449(3) 0.0311(10) 0.070(9) Uani 1 1 d . . .
H0_18 H 0.4975 0.4691 0.0349 0.084 Uiso 1 1 calc R E .
C1_18 C 0.328(3) 0.310(3) 0.0050(10) 0.086(11) Uani 1 1 d . E .
H1A_18 H 0.2436 0.2895 -0.0048 0.103 Uiso 1 1 calc R . .
H1B_18 H 0.3429 0.2712 0.0384 0.103 Uiso 1 1 calc R . .
H1C_18 H 0.3466 0.2833 -0.0349 0.103 Uiso 1 1 calc R . .
C2_18 C 0.386(2) 0.502(3) -0.0116(11) 0.068(8) Uani 1 1 d . E .
H2A_18 H 0.3010 0.4812 -0.0177 0.082 Uiso 1 1 calc R . .
H2B_18 H 0.3988 0.4764 -0.0536 0.082 Uiso 1 1 calc R . .
H2C_18 H 0.4378 0.5889 0.0047 0.082 Uiso 1 1 calc R . .
O_19 O 0.4308(14) 0.3766(16) 0.2974(7) 0.049(4) Uani 1 1 d . E .
C_19 C 0.495(3) 0.352(3) 0.3508(12) 0.068(8) Uani 1 1 d . . .
H0_19 H 0.5698 0.4273 0.3772 0.082 Uiso 1 1 calc R E .
C1_19 C 0.528(3) 0.264(3) 0.3192(13) 0.078(10) Uani 1 1 d . E .
H1A_19 H 0.5527 0.2304 0.3526 0.093 Uiso 1 1 calc R . .
H1B_19 H 0.5944 0.3050 0.2992 0.093 Uiso 1 1 calc R . .
H1C_19 H 0.4575 0.1999 0.2855 0.093 Uiso 1 1 calc R . .
C2_19 C 0.423(3) 0.299(3) 0.3900(16) 0.083(9) Uiso 1 1 d . E .
H2A_19 H 0.4021 0.3543 0.4124 0.099 Uiso 1 1 calc R . .
H2B_19 H 0.4664 0.2775 0.4225 0.099 Uiso 1 1 calc R . .
H2C_19 H 0.3495 0.2270 0.3632 0.099 Uiso 1 1 calc R . .
O_20 O 0.2283(14) 0.2957(14) 0.1744(7) 0.050(4) Uani 1 1 d D E .
C_20 C 0.153(3) 0.172(2) 0.1656(16) 0.124(19) Uani 1 1 d D . .
H0_20 H 0.1223 0.1594 0.2056 0.149 Uiso 1 1 calc R E 1
C1A_20 C 0.044(5) 0.117(6) 0.107(3) 0.057(9) Uiso 0.39(4) 1 d PD E 1
H1A1_20 H 0.0005 0.1612 0.1107 0.068 Uiso 0.39(4) 1 calc PR E 1
H1A2_20 H -0.0101 0.0337 0.1056 0.068 Uiso 0.39(4) 1 calc PR E 1
H1A3_20 H 0.0711 0.1225 0.0664 0.068 Uiso 0.39(4) 1 calc PR E 1
C2A_20 C 0.239(8) 0.123(9) 0.165(5) 0.096(15) Uiso 0.39(4) 1 d PD E 1
H2A1_20 H 0.3128 0.1801 0.1551 0.115 Uiso 0.39(4) 1 calc PR E 1
H2A2_20 H 0.1995 0.0472 0.1316 0.115 Uiso 0.39(4) 1 calc PR E 1
H2A3_20 H 0.2593 0.1091 0.2080 0.115 Uiso 0.39(4) 1 calc PR E 1
C1B_20 C 0.089(4) 0.114(4) 0.0941(15) 0.057(9) Uiso 0.61(4) 1 d PD E 2
H1B1_20 H 0.0434 0.1517 0.0789 0.068 Uiso 0.61(4) 1 calc PR E 2
H1B2_20 H 0.0336 0.0291 0.0885 0.068 Uiso 0.61(4) 1 calc PR E 2
H1B3_20 H 0.1486 0.1248 0.0687 0.068 Uiso 0.61(4) 1 calc PR E 2
C2B_20 C 0.185(6) 0.100(6) 0.206(3) 0.096(15) Uiso 0.61(4) 1 d PD E 2
H2B1_20 H 0.2715 0.1289 0.2142 0.115 Uiso 0.61(4) 1 calc PR E 2
H2B2_20 H 0.1392 0.0159 0.1827 0.115 Uiso 0.61(4) 1 calc PR E 2
H2B3_20 H 0.1641 0.1095 0.2482 0.115 Uiso 0.61(4) 1 calc PR E 2
O_21 O 0.3427(16) 0.5933(13) 0.3514(6) 0.049(4) Uani 1 1 d . E .
C_21 C 0.411(2) 0.670(3) 0.4137(11) 0.078(10) Uani 1 1 d D E .
H0_21 H 0.4326 0.7515 0.4092 0.094 Uiso 1 1 calc R F 1
C1_21 C 0.330(4) 0.642(4) 0.4593(15) 0.116(16) Uani 1 1 d D . .
H1A_21 H 0.2715 0.6680 0.4478 0.139 Uiso 1 1 calc R E .
H1B_21 H 0.3781 0.6840 0.5045 0.139 Uiso 1 1 calc R . .
H1C_21 H 0.2865 0.5560 0.4556 0.139 Uiso 1 1 calc R . .
C2A_21 C 0.530(3) 0.673(4) 0.4327(17) 0.059(9) Uiso 0.75(5) 1 d PD E 1
H2A1_21 H 0.5145 0.5929 0.4330 0.071 Uiso 0.75(5) 1 calc PR E 1
H2A2_21 H 0.5748 0.7263 0.4764 0.071 Uiso 0.75(5) 1 calc PR E 1
H2A3_21 H 0.5767 0.7030 0.4010 0.071 Uiso 0.75(5) 1 calc PR E 1
C2B_21 C 0.528(6) 0.696(10) 0.395(5) 0.059(9) Uiso 0.25(5) 1 d PD E 2
H2B1_21 H 0.5660 0.6587 0.4187 0.071 Uiso 0.25(5) 1 calc PR E 2
H2B2_21 H 0.5835 0.7824 0.4061 0.071 Uiso 0.25(5) 1 calc PR E 2
H2B3_21 H 0.5107 0.6640 0.3477 0.071 Uiso 0.25(5) 1 calc PR E 2
O_22 O 0.6095(16) 0.8000(14) 0.1143(6) 0.056(5) Uani 1 1 d . . .
C_22 C 0.658(2) 0.893(2) 0.0829(12) 0.082(11) Uani 1 1 d D E .
H0_22 H 0.5862 0.8953 0.0602 0.098 Uiso 1 1 calc R G 1
C1_22 C 0.701(4) 0.853(3) 0.0270(15) 0.108(15) Uani 1 1 d D . .
H1A_22 H 0.7587 0.8289 0.0440 0.130 Uiso 1 1 calc R E .
H1B_22 H 0.7409 0.9189 0.0065 0.130 Uiso 1 1 calc R . .
H1C_22 H 0.6320 0.7854 -0.0057 0.130 Uiso 1 1 calc R . .
C2A_22 C 0.746(4) 1.023(3) 0.120(2) 0.051(8) Uiso 0.54(7) 1 d PD E 1
H2A1_22 H 0.7629 1.0279 0.1673 0.061 Uiso 0.54(7) 1 calc PR E 1
H2A2_22 H 0.7110 1.0719 0.1108 0.061 Uiso 0.54(7) 1 calc PR E 1
H2A3_22 H 0.8220 1.0513 0.1066 0.061 Uiso 0.54(7) 1 calc PR E 1
C2B_22 C 0.775(4) 0.994(5) 0.131(2) 0.051(8) Uiso 0.46(7) 1 d PD E 2
H2B1_22 H 0.7903 0.9683 0.1702 0.061 Uiso 0.46(7) 1 calc PR E 2
H2B2_22 H 0.7661 1.0641 0.1423 0.061 Uiso 0.46(7) 1 calc PR E 2
H2B3_22 H 0.8419 1.0141 0.1101 0.061 Uiso 0.46(7) 1 calc PR E 2
O_23 O 0.0724(16) 0.3626(17) 0.0396(7) 0.070(6) Uani 1 1 d . . .
C_23 C -0.015(2) 0.298(4) -0.0207(12) 0.091(12) Uani 1 1 d . E .
H0_23 H 0.0056 0.2400 -0.0433 0.109 Uiso 1 1 calc R . .
C1_23 C -0.008(3) 0.383(4) -0.0633(14) 0.096(12) Uani 1 1 d . . .
H1A_23 H -0.0783 0.3430 -0.1009 0.115 Uiso 1 1 calc R E .
H1B_23 H 0.0660 0.4098 -0.0789 0.115 Uiso 1 1 calc R . .
H1C_23 H -0.0056 0.4526 -0.0375 0.115 Uiso 1 1 calc R . .
C2_23 C -0.134(3) 0.229(5) -0.0078(19) 0.13(2) Uani 1 1 d . . .
H2A_23 H -0.1251 0.1983 0.0308 0.159 Uiso 1 1 calc R E .
H2B_23 H -0.1880 0.1620 -0.0458 0.159 Uiso 1 1 calc R . .
H2C_23 H -0.1681 0.2805 0.0002 0.159 Uiso 1 1 calc R . .
O_24 O 0.2865(17) 0.8067(19) 0.3060(8) 0.069(6) Uani 1 1 d . E .
C_24 C 0.266(4) 0.904(4) 0.331(2) 0.117(18) Uani 1 1 d . . .
H0_24 H 0.3049 0.9654 0.3065 0.140 Uiso 1 1 calc R E .
C1_24 C 0.335(3) 0.961(3) 0.4002(12) 0.072(8) Uani 1 1 d . E .
H1A_24 H 0.2949 0.9084 0.4278 0.086 Uiso 1 1 calc R . .
H1B_24 H 0.3391 1.0371 0.4137 0.086 Uiso 1 1 calc R . .
H1C_24 H 0.4170 0.9737 0.4050 0.086 Uiso 1 1 calc R . .
C2_24 C 0.142(6) 0.866(6) 0.313(3) 0.19(3) Uani 1 1 d . E .
H2A_24 H 0.1069 0.8170 0.2680 0.224 Uiso 1 1 calc R . .
H2B_24 H 0.1322 0.9360 0.3161 0.224 Uiso 1 1 calc R . .
H2C_24 H 0.1015 0.8195 0.3426 0.224 Uiso 1 1 calc R . .
O_25 O 0.148(2) 0.292(2) 0.3313(11) 0.080(6) Uani 1 1 d D . .
CA_25 C 0.083(3) 0.222(3) 0.3722(15) 0.072(10) Uiso 0.67(5) 1 d PD E 1
HA_25 H 0.1390 0.2140 0.4063 0.086 Uiso 0.67(5) 1 calc PR E 1
C1A_25 C 0.011(6) 0.268(7) 0.403(3) 0.086(13) Uiso 0.67(5) 1 d PD E 1
H1A1_25 H 0.0663 0.3424 0.4368 0.104 Uiso 0.67(5) 1 calc PR E 1
H1A2_25 H -0.0427 0.2086 0.4235 0.104 Uiso 0.67(5) 1 calc PR E 1
H1A3_25 H -0.0369 0.2832 0.3697 0.104 Uiso 0.67(5) 1 calc PR E 1
C2A_25 C -0.005(3) 0.102(3) 0.3237(15) 0.082(9) Uiso 0.67(5) 1 d PD E 1
H2A1_25 H -0.0623 0.1113 0.2925 0.098 Uiso 0.67(5) 1 calc PR E 1
H2A2_25 H -0.0496 0.0441 0.3475 0.098 Uiso 0.67(5) 1 calc PR E 1
H2A3_25 H 0.0394 0.0746 0.3001 0.098 Uiso 0.67(5) 1 calc PR E 1
CB_25 C 0.031(4) 0.233(3) 0.343(4) 0.072(10) Uiso 0.33(5) 1 d PD E 2
HB_25 H -0.0175 0.2373 0.3037 0.086 Uiso 0.33(5) 1 calc PR E 2
C1B_25 C -0.009(14) 0.286(14) 0.396(5) 0.086(13) Uiso 0.33(5) 1 d PD E 2
H1B1_25 H 0.0590 0.3632 0.4221 0.104 Uiso 0.33(5) 1 calc PR E 2
H1B2_25 H -0.0379 0.2320 0.4247 0.104 Uiso 0.33(5) 1 calc PR E 2
H1B3_25 H -0.0748 0.2973 0.3754 0.104 Uiso 0.33(5) 1 calc PR E 2
C2B_25 C -0.005(3) 0.102(3) 0.3237(15) 0.082(9) Uiso 0.33(5) 1 d PD E 2
H2B1_25 H -0.0720 0.0620 0.2841 0.098 Uiso 0.33(5) 1 calc PR E 2
H2B2_25 H -0.0310 0.0646 0.3592 0.098 Uiso 0.33(5) 1 calc PR E 2
H2B3_25 H 0.0639 0.0962 0.3152 0.098 Uiso 0.33(5) 1 calc PR E 2
O_26 O 0.6361(14) 0.5921(16) 0.2025(6) 0.051(4) Uani 1 1 d D E .
CA_26 C 0.726(5) 0.634(5) 0.2628(19) 0.094(15) Uiso 0.53(5) 1 d PD E 1
HA_26 H 0.7837 0.6031 0.2631 0.113 Uiso 0.53(5) 1 calc PR E 1
C1A_26 C 0.785(6) 0.768(5) 0.289(3) 0.081(13) Uiso 0.53(5) 1 d PD E 1
H1A1_26 H 0.8663 0.8082 0.2825 0.097 Uiso 0.53(5) 1 calc PR E 1
H1A2_26 H 0.7891 0.7862 0.3360 0.097 Uiso 0.53(5) 1 calc PR E 1
H1A3_26 H 0.7361 0.7965 0.2658 0.097 Uiso 0.53(5) 1 calc PR E 1
C2A_26 C 0.645(10) 0.596(8) 0.309(5) 0.17(4) Uiso 0.53(5) 1 d PD E 1
H2A1_26 H 0.6519 0.6662 0.3367 0.206 Uiso 0.53(5) 1 calc PR E 1
H2A2_26 H 0.6705 0.5543 0.3374 0.206 Uiso 0.53(5) 1 calc PR E 1
H2A3_26 H 0.5614 0.5421 0.2842 0.206 Uiso 0.53(5) 1 calc PR E 1
CB_26 C 0.755(4) 0.664(5) 0.246(3) 0.094(15) Uiso 0.47(5) 1 d PD E 2
HB_26 H 0.8106 0.6344 0.2368 0.113 Uiso 0.47(5) 1 calc PR E 2
C1B_26 C 0.813(7) 0.799(6) 0.256(4) 0.081(13) Uiso 0.47(5) 1 d PD E 2
H1B1_26 H 0.8081 0.8187 0.2137 0.097 Uiso 0.47(5) 1 calc PR E 2
H1B2_26 H 0.8974 0.8373 0.2805 0.097 Uiso 0.47(5) 1 calc PR E 2
H1B3_26 H 0.7697 0.8267 0.2812 0.097 Uiso 0.47(5) 1 calc PR E 2
C2B_26 C 0.728(14) 0.656(10) 0.312(5) 0.17(4) Uiso 0.47(5) 1 d PD E 2
H2B1_26 H 0.6430 0.6297 0.3087 0.206 Uiso 0.47(5) 1 calc PR E 2
H2B2_26 H 0.7787 0.7341 0.3433 0.206 Uiso 0.47(5) 1 calc PR E 2
H2B3_26 H 0.7466 0.5981 0.3282 0.206 Uiso 0.47(5) 1 calc PR E 2
OA_27 O 0.569(2) 0.314(2) 0.1283(12) 0.057(5) Uiso 0.70(2) 1 d PD E 1
CA_27 C 0.585(4) 0.213(3) 0.1182(18) 0.073(11) Uiso 0.70(2) 1 d PD E 1
HA_27 H 0.6531 0.2237 0.1524 0.087 Uiso 0.70(2) 1 calc PR E 1
C1A_27 C 0.465(3) 0.103(4) 0.116(2) 0.073(10) Uiso 0.70(2) 1 d PD E 1
H1A1_27 H 0.4342 0.1189 0.1527 0.088 Uiso 0.70(2) 1 calc PR E 1
H1A2_27 H 0.4779 0.0356 0.1177 0.088 Uiso 0.70(2) 1 calc PR E 1
H1A3_27 H 0.4059 0.0832 0.0745 0.088 Uiso 0.70(2) 1 calc PR E 1
C2A_27 C 0.598(5) 0.185(5) 0.0494(18) 0.083(13) Uiso 0.70(2) 1 d PD E 1
H2A1_27 H 0.6003 0.2460 0.0273 0.099 Uiso 0.70(2) 1 calc PR E 1
H2A2_27 H 0.5288 0.1068 0.0248 0.099 Uiso 0.70(2) 1 calc PR E 1
H2A3_27 H 0.6726 0.1824 0.0517 0.099 Uiso 0.70(2) 1 calc PR E 1
OB_27 O 0.485(5) 0.260(5) 0.149(3) 0.057(5) Uiso 0.30(2) 1 d PD E 2
CB_27 C 0.501(10) 0.170(7) 0.115(4) 0.073(11) Uiso 0.30(2) 1 d PD E 2
HB_27 H 0.5870 0.2051 0.1406 0.087 Uiso 0.30(2) 1 calc PR E 2
C1B_27 C 0.447(9) 0.101(6) 0.165(4) 0.073(10) Uiso 0.30(2) 1 d PD E 2
H1B1_27 H 0.5008 0.1433 0.2088 0.088 Uiso 0.30(2) 1 calc PR E 2
H1B2_27 H 0.4356 0.0212 0.1533 0.088 Uiso 0.30(2) 1 calc PR E 2
H1B3_27 H 0.3681 0.0949 0.1644 0.088 Uiso 0.30(2) 1 calc PR E 2
C2B_27 C 0.528(11) 0.165(11) 0.049(4) 0.083(13) Uiso 0.30(2) 1 d PD E 2
H2B1_27 H 0.4571 0.1469 0.0152 0.099 Uiso 0.30(2) 1 calc PR E 2
H2B2_27 H 0.5485 0.1022 0.0386 0.099 Uiso 0.30(2) 1 calc PR E 2
H2B3_27 H 0.5966 0.2417 0.0487 0.099 Uiso 0.30(2) 1 calc PR E 2
O_28 O 0.722(3) 0.534(3) 0.1082(18) 0.137(12) Uiso 1 1 d . . .
C_28 C 0.777(4) 0.582(4) 0.0571(19) 0.093(10) Uiso 1 1 d . . .
H0_28 H 0.7161 0.5928 0.0285 0.111 Uiso 1 1 calc R . .
C1_28 C 0.887(5) 0.719(5) 0.095(3) 0.134(17) Uiso 1 1 d . . .
H1A_28 H 0.8750 0.7406 0.1385 0.161 Uiso 1 1 calc R . .
H1B_28 H 0.8859 0.7743 0.0697 0.161 Uiso 1 1 calc R . .
H1C_28 H 0.9647 0.7216 0.1011 0.161 Uiso 1 1 calc R . .
C2_28 C 0.810(4) 0.516(4) 0.013(2) 0.099(11) Uiso 1 1 d . . .
H2A_28 H 0.7622 0.4310 0.0122 0.119 Uiso 1 1 calc R . .
H2B_28 H 0.8958 0.5435 0.0286 0.119 Uiso 1 1 calc R . .
H2C_28 H 0.7930 0.5274 -0.0306 0.119 Uiso 1 1 calc R . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C .0033 .0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H .0000 .0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O .0106 .0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Eu Eu -.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
_geom_angle_publ_flag
O_7 Eu1 O_3 107.1(4) . . yes
O_7 Eu1 O_12 104.7(5) . . yes
O_3 Eu1 O_12 111.1(5) . . yes
O_7 Eu1 O_2 73.7(4) . . yes
O_3 Eu1 O_2 136.7(4) . . yes
O_12 Eu1 O_2 110.4(5) . . yes
O_7 Eu1 O29 75.6(4) . . yes
O_3 Eu1 O29 75.5(4) . . ?
O_12 Eu1 O29 172.7(5) . . ?
O_2 Eu1 O29 62.5(4) . . yes
O_7 Eu1 O_5 137.0(4) . . yes
O_3 Eu1 O_5 75.9(4) . . yes
O_12 Eu1 O_5 114.2(4) . . yes
O_2 Eu1 O_5 76.1(4) . . yes
O29 Eu1 O_5 63.4(3) . . yes
O_7 Eu1 O_14 138.9(4) . . yes
O_3 Eu1 O_14 57.2(4) . . yes
O_12 Eu1 O_14 58.5(5) . . ?
O_2 Eu1 O_14 145.5(3) . . ?
O29 Eu1 O_14 126.0(3) . . ?
O_5 Eu1 O_14 79.9(4) . . ?
O_7 Eu1 Eu3 39.6(3) . . ?
O_3 Eu1 Eu3 108.6(3) . . ?
O_12 Eu1 Eu3 133.7(4) . . ?
O_2 Eu1 Eu3 44.6(2) . . ?
O29 Eu1 Eu3 43.0(2) . . ?
O_5 Eu1 Eu3 97.8(2) . . ?
O_14 Eu1 Eu3 165.8(2) . . ?
O_7 Eu1 Eu2 110.0(3) . . ?
O_3 Eu1 Eu2 41.1(3) . . ?
O_12 Eu1 Eu2 140.7(4) . . ?
O_2 Eu1 Eu2 96.7(3) . . ?
O29 Eu1 Eu2 43.0(2) . . ?
O_5 Eu1 Eu2 44.8(2) . . ?
O_14 Eu1 Eu2 83.0(2) . . ?
Eu3 Eu1 Eu2 85.57(3) . . ?
O_7 Eu1 Eu5 98.7(3) . . ?
O_3 Eu1 Eu5 100.2(3) . . ?
O_12 Eu1 Eu5 132.6(4) . . ?
O_2 Eu1 Eu5 39.6(3) . . ?
O29 Eu1 Eu5 40.9(2) . . ?
O_5 Eu1 Eu5 40.6(3) . . ?
O_14 Eu1 Eu5 120.5(3) . . ?
Eu3 Eu1 Eu5 59.27(3) . . ?
Eu2 Eu1 Eu5 59.19(3) . . ?
O_10 Eu2 O_3 105.4(6) . . ?
O_10 Eu2 O_9 109.5(5) . . ?
O_3 Eu2 O_9 108.5(4) . . ?
O_10 Eu2 O29 163.0(6) . . ?
O_3 Eu2 O29 84.2(4) . . ?
O_9 Eu2 O29 79.8(4) . . ?
O_10 Eu2 O_5 97.9(5) . . ?
O_3 Eu2 O_5 82.9(4) . . ?
O_9 Eu2 O_5 145.4(4) . . ?
O29 Eu2 O_5 68.8(3) . . ?
O_10 Eu2 O_8 101.7(6) . . ?
O_3 Eu2 O_8 147.8(4) . . ?
O_9 Eu2 O_8 77.9(5) . . ?
O29 Eu2 O_8 65.6(4) . . ?
O_5 Eu2 O_8 76.3(4) . . ?
O_10 Eu2 Eu4 133.9(5) . . ?
O_3 Eu2 Eu4 117.5(3) . . ?
O_9 Eu2 Eu4 42.5(3) . . ?
O29 Eu2 Eu4 45.3(2) . . ?
O_5 Eu2 Eu4 103.1(3) . . ?
O_8 Eu2 Eu4 46.7(3) . . ?
O_10 Eu2 Eu1 130.4(4) . . ?
O_3 Eu2 Eu1 46.0(3) . . ?
O_9 Eu2 Eu1 117.6(3) . . ?
O29 Eu2 Eu1 48.2(3) . . ?
O_5 Eu2 Eu1 48.2(3) . . ?
O_8 Eu2 Eu1 102.4(3) . . ?
Eu4 Eu2 Eu1 93.14(3) . . ?
O_10 Eu2 Eu5 120.8(5) . . ?
O_3 Eu2 Eu5 108.2(3) . . ?
O_9 Eu2 Eu5 104.1(3) . . ?
O29 Eu2 Eu5 42.2(2) . . ?
O_5 Eu2 Eu5 42.1(3) . . ?
O_8 Eu2 Eu5 41.3(3) . . ?
Eu4 Eu2 Eu5 61.75(3) . . ?
Eu1 Eu2 Eu5 62.13(3) . . ?
O_13 Eu3 O_7 104.3(7) . . ?
O_13 Eu3 O_4 104.6(7) . . ?
O_7 Eu3 O_4 110.3(5) . . ?
O_13 Eu3 O29 168.3(6) . . ?
O_7 Eu3 O29 84.7(4) . . ?
O_4 Eu3 O29 78.6(4) . . ?
O_13 Eu3 O_2 105.5(7) . . ?
O_7 Eu3 O_2 80.6(5) . . ?
O_4 Eu3 O_2 144.0(4) . . ?
O29 Eu3 O_2 68.1(4) . . ?
O_13 Eu3 O_6 103.1(6) . . ?
O_7 Eu3 O_6 148.8(4) . . ?
O_4 Eu3 O_6 76.5(4) . . ?
O29 Eu3 O_6 66.4(4) . . ?
O_2 Eu3 O_6 77.9(4) . . ?
O_13 Eu3 CB_6 77.5(8) . . ?
O_7 Eu3 CB_6 164.8(6) . . ?
O_4 Eu3 CB_6 83.4(7) . . ?
O29 Eu3 CB_6 91.8(7) . . ?
O_2 Eu3 CB_6 84.4(6) . . ?
O_6 Eu3 CB_6 25.6(6) . . ?
O_13 Eu3 Eu4 131.4(6) . . ?
O_7 Eu3 Eu4 119.4(4) . . ?
O_4 Eu3 Eu4 42.4(3) . . ?
O29 Eu3 Eu4 45.0(2) . . ?
O_2 Eu3 Eu4 101.9(3) . . ?
O_6 Eu3 Eu4 45.5(3) . . ?
CB_6 Eu3 Eu4 66.0(6) . . ?
O_13 Eu3 Eu1 134.8(6) . . ?
O_7 Eu3 Eu1 44.5(3) . . ?
O_4 Eu3 Eu1 116.1(4) . . ?
O29 Eu3 Eu1 48.5(3) . . ?
O_2 Eu3 Eu1 48.2(3) . . ?
O_6 Eu3 Eu1 104.6(3) . . ?
CB_6 Eu3 Eu1 124.1(5) . . ?
Eu4 Eu3 Eu1 93.11(3) . . ?
O_13 Eu3 Eu5 126.5(5) . . ?
O_7 Eu3 Eu5 106.7(3) . . ?
O_4 Eu3 Eu5 104.0(3) . . ?
O29 Eu3 Eu5 42.3(2) . . ?
O_2 Eu3 Eu5 41.1(3) . . ?
O_6 Eu3 Eu5 43.5(3) . . ?
CB_6 Eu3 Eu5 62.2(5) . . ?
Eu4 Eu3 Eu5 61.61(3) . . ?
Eu1 Eu3 Eu5 62.34(3) . . ?
O_1 Eu4 O_9 107.9(5) . . ?
O_1 Eu4 O_4 107.5(5) . . ?
O_9 Eu4 O_4 107.1(5) . . ?
O_1 Eu4 O29 169.6(5) . . ?
O_9 Eu4 O29 79.2(4) . . ?
O_4 Eu4 O29 76.7(4) . . ?
O_1 Eu4 O_6 104.0(5) . . ?
O_9 Eu4 O_6 144.4(4) . . ?
O_4 Eu4 O_6 77.2(4) . . ?
O29 Eu4 O_6 67.2(4) . . ?
O_1 Eu4 O_8 107.7(5) . . ?
O_9 Eu4 O_8 78.5(5) . . ?
O_4 Eu4 O_8 140.3(4) . . ?
O29 Eu4 O_8 65.6(4) . . ?
O_6 Eu4 O_8 77.1(5) . . ?
O_1 Eu4 CA_9 84.2(8) . . ?
O_9 Eu4 CA_9 24.2(6) . . ?
O_4 Eu4 CA_9 110.7(7) . . ?
O29 Eu4 CA_9 103.4(7) . . ?
O_6 Eu4 CA_9 166.6(6) . . ?
O_8 Eu4 CA_9 90.5(6) . . ?
O_1 Eu4 Eu2 137.2(4) . . ?
O_9 Eu4 Eu2 42.5(3) . . ?
O_4 Eu4 Eu2 110.8(4) . . ?
O29 Eu4 Eu2 44.6(3) . . ?
O_6 Eu4 Eu2 102.3(3) . . ?
O_8 Eu4 Eu2 47.5(3) . . ?
CA_9 Eu4 Eu2 65.1(6) . . ?
O_1 Eu4 Eu3 134.2(4) . . ?
O_9 Eu4 Eu3 113.0(3) . . ?
O_4 Eu4 Eu3 41.0(3) . . ?
O29 Eu4 Eu3 44.1(2) . . ?
O_6 Eu4 Eu3 47.6(3) . . ?
O_8 Eu4 Eu3 99.9(3) . . ?
CA_9 Eu4 Eu3 132.0(7) . . ?
Eu2 Eu4 Eu3 88.17(3) . . ?
O_1 Eu4 Eu5 128.0(4) . . ?
O_9 Eu4 Eu5 103.2(3) . . ?
O_4 Eu4 Eu5 101.5(3) . . ?
O29 Eu4 Eu5 41.7(2) . . ?
O_6 Eu4 Eu5 42.8(3) . . ?
O_8 Eu4 Eu5 40.7(3) . . ?
CA_9 Eu4 Eu5 123.8(5) . . ?
Eu2 Eu4 Eu5 60.78(3) . . ?
Eu3 Eu4 Eu5 60.53(3) . . ?
O_11 Eu5 O_2 109.9(6) . . ?
O_11 Eu5 O_8 111.0(6) . . ?
O_2 Eu5 O_8 139.0(4) . . ?
O_11 Eu5 O_5 109.5(5) . . ?
O_2 Eu5 O_5 86.7(5) . . ?
O_8 Eu5 O_5 82.0(4) . . ?
O_11 Eu5 O29 179.6(7) . . ?
O_2 Eu5 O29 70.3(4) . . ?
O_8 Eu5 O29 68.7(4) . . ?
O_5 Eu5 O29 70.8(4) . . ?
O_11 Eu5 O_6 111.5(6) . . ?
O_2 Eu5 O_6 82.7(4) . . ?
O_8 Eu5 O_6 80.5(5) . . ?
O_5 Eu5 O_6 138.9(4) . . ?
O29 Eu5 O_6 68.2(4) . . ?
O_11 Eu5 Eu3 137.6(5) . . ?
O_2 Eu5 Eu3 44.0(3) . . ?
O_8 Eu5 Eu3 100.5(3) . . ?
O_5 Eu5 Eu3 102.2(3) . . ?
O29 Eu5 Eu3 42.3(3) . . ?
O_6 Eu5 Eu3 46.0(3) . . ?
O_11 Eu5 Eu2 137.6(5) . . ?
O_2 Eu5 Eu2 102.0(3) . . ?
O_8 Eu5 Eu2 45.4(4) . . ?
O_5 Eu5 Eu2 44.4(2) . . ?
O29 Eu5 Eu2 42.5(3) . . ?
O_6 Eu5 Eu2 99.5(3) . . ?
Eu3 Eu5 Eu2 84.81(3) . . ?
O_11 Eu5 Eu4 137.0(5) . . ?
O_2 Eu5 Eu4 101.1(3) . . ?
O_8 Eu5 Eu4 44.1(3) . . ?
O_5 Eu5 Eu4 101.2(2) . . ?
O29 Eu5 Eu4 42.6(3) . . ?
O_6 Eu5 Eu4 43.3(3) . . ?
Eu3 Eu5 Eu4 57.87(2) . . ?
Eu2 Eu5 Eu4 57.47(3) . . ?
O_11 Eu5 Eu1 134.4(5) . . ?
O_2 Eu5 Eu1 45.7(4) . . ?
O_8 Eu5 Eu1 103.1(3) . . ?
O_5 Eu5 Eu1 46.1(3) . . ?
O29 Eu5 Eu1 46.0(3) . . ?
O_6 Eu5 Eu1 103.1(3) . . ?
Eu3 Eu5 Eu1 58.39(3) . . ?
Eu2 Eu5 Eu1 58.68(2) . . ?
Eu4 Eu5 Eu1 88.61(3) . . ?
Eu5 O29 Eu3 95.4(4) . . ?
Eu5 O29 Eu2 95.3(3) . . ?
Eu3 O29 Eu2 169.1(5) . . ?
Eu5 O29 Eu4 95.7(4) . . ?
Eu3 O29 Eu4 91.0(3) . . ?
Eu2 O29 Eu4 90.1(4) . . ?
Eu5 O29 Eu1 93.1(3) . . ?
Eu3 O29 Eu1 88.5(3) . . ?
Eu2 O29 Eu1 88.8(3) . . ?
Eu4 O29 Eu1 171.2(5) . . ?
C_1 O_1 Eu4 175.7(11) . . ?
O_1 C_1 C2_1 112.1(17) . . ?
O_1 C_1 C1_1 107.7(17) . . ?
C2_1 C_1 C1_1 109.1(17) . . ?
C_2 O_2 Eu5 131.3(14) . . ?
C_2 O_2 Eu3 122.6(14) . . ?
Eu5 O_2 Eu3 94.9(5) . . ?
C_2 O_2 Eu1 115.2(12) . . ?
Eu5 O_2 Eu1 94.7(5) . . ?
Eu3 O_2 Eu1 87.2(4) . . ?
C1_2 C_2 O_2 110(2) . . ?
C1_2 C_2 C2_2 109(2) . . ?
O_2 C_2 C2_2 113(2) . . ?
C_3 O_3 Eu2 125.9(11) . . ?
C_3 O_3 Eu1 121.4(11) . . ?
Eu2 O_3 Eu1 92.9(4) . . ?
O_3 C_3 C2B_3 122(3) . . ?
O_3 C_3 C1_3 111.8(16) . . ?
C2B_3 C_3 C1_3 125(3) . . ?
O_3 C_3 C2A_3 102(2) . . ?
C2B_3 C_3 C2A_3 53(3) . . ?
C1_3 C_3 C2A_3 108(2) . . ?
C_4 O_4 Eu3 138.0(13) . . ?
C_4 O_4 Eu4 125.5(13) . . ?
Eu3 O_4 Eu4 96.5(4) . . ?
O_4 C_4 C1_4 108(2) . . ?
O_4 C_4 C2_4 105(3) . . ?
C1_4 C_4 C2_4 92(3) . . ?
C_5 O_5 Eu5 129.3(11) . . ?
C_5 O_5 Eu2 113.3(10) . . ?
Eu5 O_5 Eu2 93.5(3) . . ?
C_5 O_5 Eu1 128.6(10) . . ?
Eu5 O_5 Eu1 93.3(4) . . ?
Eu2 O_5 Eu1 87.0(3) . . ?
O_5 C_5 C2_5 113.1(16) . . ?
O_5 C_5 C1_5 105.7(15) . . ?
C2_5 C_5 C1_5 106.6(16) . . ?
CA_6 O_6 CB_6 31(2) . . ?
CA_6 O_6 Eu5 125.7(13) . . ?
CB_6 O_6 Eu5 127.3(13) . . ?
CA_6 O_6 Eu4 115(2) . . ?
CB_6 O_6 Eu4 136.2(13) . . ?
Eu5 O_6 Eu4 93.8(5) . . ?
CA_6 O_6 Eu3 133.2(18) . . ?
CB_6 O_6 Eu3 105.0(19) . . ?
Eu5 O_6 Eu3 90.5(4) . . ?
Eu4 O_6 Eu3 86.9(4) . . ?
O_6 CA_6 C1A_6 111(2) . . ?
O_6 CA_6 C2A_6 107(4) . . ?
C1A_6 CA_6 C2A_6 109(4) . . ?
O_6 CB_6 C2B_6 104(3) . . ?
O_6 CB_6 Eu3 49.5(14) . . ?
C2B_6 CB_6 Eu3 142(3) . . ?
C_7 O_7 Eu3 135.8(14) . . ?
C_7 O_7 Eu1 127.9(13) . . ?
Eu3 O_7 Eu1 95.9(4) . . ?
C1_7 C_7 C2_7 117(2) . . ?
C1_7 C_7 O_7 115(2) . . ?
C2_7 C_7 O_7 113(2) . . ?
C_8 O_8 Eu5 126.1(13) . . ?
C_8 O_8 Eu4 124.9(10) . . ?
Eu5 O_8 Eu4 95.2(4) . . ?
C_8 O_8 Eu2 120.9(14) . . ?
Eu5 O_8 Eu2 93.3(4) . . ?
Eu4 O_8 Eu2 85.9(4) . . ?
O_8 C_8 C2_8 107.7(18) . . ?
O_8 C_8 C1_8 110.0(18) . . ?
C2_8 C_8 C1_8 109.1(19) . . ?
CA_9 O_9 CB_9 33.1(19) . . ?
CA_9 O_9 Eu4 113.5(19) . . ?
CB_9 O_9 Eu4 138.4(14) . . ?
CA_9 O_9 Eu2 142.4(15) . . ?
CB_9 O_9 Eu2 126.5(14) . . ?
Eu4 O_9 Eu2 95.0(4) . . ?
O_9 CA_9 C2A_9 105(3) . . ?
O_9 CA_9 C1A_9 110(3) . . ?
C2A_9 CA_9 C1A_9 127(4) . . ?
O_9 CA_9 Eu4 42.2(13) . . ?
C2A_9 CA_9 Eu4 139(3) . . ?
C1A_9 CA_9 Eu4 92(2) . . ?
O_9 CB_9 C2B_9 115(3) . . ?
O_9 CB_9 C1B_9 114(3) . . ?
C2B_9 CB_9 C1B_9 103(3) . . ?
C_10 O_10 Eu2 160.8(15) . . ?
O_10 C_10 C2B_10 106(2) . . ?
O_10 C_10 C1_10 109(2) . . ?
C2B_10 C_10 C1_10 114(3) . . ?
O_10 C_10 C2A_10 100(6) . . ?
C2B_10 C_10 C2A_10 29(7) . . ?
C1_10 C_10 C2A_10 140(8) . . ?
CB_11 O_11 CA_11 28.3(19) . . ?
CB_11 O_11 Eu5 167(2) . . ?
CA_11 O_11 Eu5 161(2) . . ?
O_11 CA_11 C1A_11 116(6) . . ?
O_11 CA_11 C2A_11 103(3) . . ?
C1A_11 CA_11 C2A_11 97.9(17) . . ?
O_11 CB_11 C1B_11 118(5) . . ?
O_11 CB_11 C2B_11 100(3) . . ?
C1B_11 CB_11 C2B_11 111(6) . . ?
C_12 O_12 Eu1 155.4(16) . . ?
O_12 C_12 C2_12 114(2) . . ?
O_12 C_12 C1_12 106(2) . . ?
C2_12 C_12 C1_12 115(2) . . ?
CA_13 O_13 CB_13 32(2) . . ?
CA_13 O_13 Eu3 166(2) . . ?
CB_13 O_13 Eu3 162(2) . . ?
O_13 CA_13 C2A_13 131(5) . . ?
O_13 CA_13 C1A_13 96(4) . . ?
C2A_13 CA_13 C1A_13 132(5) . . ?
O_13 CB_13 C2B_13 109(5) . . ?
O_13 CB_13 C1B_13 106(4) . . ?
C2B_13 CB_13 C1B_13 98.3(17) . . ?
C_14 O_14 Eu1 159.2(13) . . ?
O_14 C_14 C1_14 107.0(19) . . ?
O_14 C_14 C2_14 115(2) . . ?
C1_14 C_14 C2_14 115(2) . . ?
O_22 Eu6 O_16 102.2(6) . . ?
O_22 Eu6 O_26 108.4(7) . . ?
O_16 Eu6 O_26 108.7(5) . . ?
O_22 Eu6 O30 169.1(6) . . ?
O_16 Eu6 O30 78.9(4) . . ?
O_26 Eu6 O30 81.2(5) . . ?
O_22 Eu6 O_18 108.0(5) . . ?
O_16 Eu6 O_18 144.7(5) . . ?
O_26 Eu6 O_18 78.6(5) . . ?
O30 Eu6 O_18 68.0(4) . . ?
O_22 Eu6 O_15 103.3(6) . . ?
O_16 Eu6 O_15 76.5(5) . . ?
O_26 Eu6 O_15 145.6(6) . . ?
O30 Eu6 O_15 66.3(5) . . ?
O_18 Eu6 O_15 79.2(5) . . ?
O_22 Eu6 Eu7 129.5(5) . . ?
O_16 Eu6 Eu7 41.7(4) . . ?
O_26 Eu6 Eu7 115.9(4) . . ?
O30 Eu6 Eu7 45.6(3) . . ?
O_18 Eu6 Eu7 103.5(3) . . ?
O_15 Eu6 Eu7 46.0(3) . . ?
O_22 Eu6 Eu8 139.5(5) . . ?
O_16 Eu6 Eu8 114.1(3) . . ?
O_26 Eu6 Eu8 44.0(4) . . ?
O30 Eu6 Eu8 45.5(3) . . ?
O_18 Eu6 Eu8 47.6(3) . . ?
O_15 Eu6 Eu8 102.1(4) . . ?
Eu7 Eu6 Eu8 90.60(3) . . ?
O_22 Eu6 Eu9 127.6(4) . . ?
O_16 Eu6 Eu9 103.2(4) . . ?
O_26 Eu6 Eu9 105.5(4) . . ?
O30 Eu6 Eu9 42.5(2) . . ?
O_18 Eu6 Eu9 43.1(3) . . ?
O_15 Eu6 Eu9 42.1(4) . . ?
Eu7 Eu6 Eu9 61.60(3) . . ?
Eu8 Eu6 Eu9 61.62(3) . . ?
O_24 Eu7 O_16 103.3(7) . . ?
O_24 Eu7 O_21 102.3(7) . . ?
O_16 Eu7 O_21 107.6(6) . . ?
O_24 Eu7 O30 177.0(7) . . ?
O_16 Eu7 O30 79.7(5) . . ?
O_21 Eu7 O30 76.8(4) . . ?
O_24 Eu7 O_17 110.4(6) . . ?
O_16 Eu7 O_17 144.3(4) . . ?
O_21 Eu7 O_17 76.9(5) . . ?
O30 Eu7 O_17 66.7(4) . . ?
O_24 Eu7 O_15 112.9(7) . . ?
O_16 Eu7 O_15 79.2(5) . . ?
O_21 Eu7 O_15 141.6(5) . . ?
O30 Eu7 O_15 67.2(4) . . ?
O_17 Eu7 O_15 77.0(5) . . ?
O_24 Eu7 CA_15 88.5(9) . . ?
O_16 Eu7 CA_15 77.9(10) . . ?
O_21 Eu7 CA_15 166.0(8) . . ?
O30 Eu7 CA_15 92.0(7) . . ?
O_17 Eu7 CA_15 91.1(9) . . ?
O_15 Eu7 CA_15 25.3(6) . . ?
O_24 Eu7 C_21 87.3(8) . . ?
O_16 Eu7 C_21 94.3(6) . . ?
O_21 Eu7 C_21 23.3(8) . . ?
O30 Eu7 C_21 92.7(7) . . ?
O_17 Eu7 C_21 98.8(7) . . ?
O_15 Eu7 C_21 159.7(7) . . ?
CA_15 Eu7 C_21 170.0(11) . . ?
O_24 Eu7 Eu6 137.3(7) . . ?
O_16 Eu7 Eu6 43.1(3) . . ?
O_21 Eu7 Eu6 112.0(4) . . ?
O30 Eu7 Eu6 45.1(3) . . ?
O_17 Eu7 Eu6 101.6(3) . . ?
O_15 Eu7 Eu6 47.9(3) . . ?
CA_15 Eu7 Eu6 62.9(8) . . ?
C_21 Eu7 Eu6 115.3(5) . . ?
O_24 Eu7 Eu10 132.9(7) . . ?
O_16 Eu7 Eu10 114.4(4) . . ?
O_21 Eu7 Eu10 40.9(3) . . ?
O30 Eu7 Eu10 44.9(3) . . ?
O_17 Eu7 Eu10 46.6(3) . . ?
O_15 Eu7 Eu10 101.3(4) . . ?
CA_15 Eu7 Eu10 125.2(7) . . ?
C_21 Eu7 Eu10 63.6(7) . . ?
Eu6 Eu7 Eu10 89.64(3) . . ?
O_24 Eu7 Eu9 136.0(5) . . ?
O_16 Eu7 Eu9 103.9(3) . . ?
O_21 Eu7 Eu9 101.6(3) . . ?
O30 Eu7 Eu9 42.1(2) . . ?
O_17 Eu7 Eu9 42.1(3) . . ?
O_15 Eu7 Eu9 41.6(4) . . ?
CA_15 Eu7 Eu9 64.4(7) . . ?
C_21 Eu7 Eu9 124.2(7) . . ?
Eu6 Eu7 Eu9 60.81(3) . . ?
Eu10 Eu7 Eu9 60.77(3) . . ?
OB_27 Eu8 O_19 107.3(15) . . ?
OB_27 Eu8 O_26 110.5(16) . . ?
O_19 Eu8 O_26 109.2(5) . . ?
OB_27 Eu8 O30 166.5(16) . . ?
O_19 Eu8 O30 77.8(5) . . ?
O_26 Eu8 O30 78.6(5) . . ?
OB_27 Eu8 O_20 102.9(16) . . ?
O_19 Eu8 O_20 76.1(5) . . ?
O_26 Eu8 O_20 142.1(5) . . ?
O30 Eu8 O_20 65.7(5) . . ?
OB_27 Eu8 O_18 106.2(15) . . ?
O_19 Eu8 O_18 141.6(5) . . ?
O_26 Eu8 O_18 75.5(5) . . ?
O30 Eu8 O_18 65.5(4) . . ?
O_20 Eu8 O_18 78.5(5) . . ?
OB_27 Eu8 OA_27 26.7(16) . . ?
O_19 Eu8 OA_27 124.4(7) . . ?
O_26 Eu8 OA_27 84.7(7) . . ?
O30 Eu8 OA_27 156.0(6) . . ?
O_20 Eu8 OA_27 124.4(7) . . ?
O_18 Eu8 OA_27 93.8(6) . . ?
OB_27 Eu8 Eu10 132.3(15) . . ?
O_19 Eu8 Eu10 41.3(4) . . ?
O_26 Eu8 Eu10 113.8(4) . . ?
O30 Eu8 Eu10 44.9(3) . . ?
O_20 Eu8 Eu10 45.8(3) . . ?
O_18 Eu8 Eu10 101.0(3) . . ?
OA_27 Eu8 Eu10 158.6(6) . . ?
OB_27 Eu8 Eu6 137.7(14) . . ?
O_19 Eu8 Eu6 112.5(4) . . ?
O_26 Eu8 Eu6 42.6(4) . . ?
O30 Eu8 Eu6 43.9(3) . . ?
O_20 Eu8 Eu6 100.0(4) . . ?
O_18 Eu8 Eu6 45.2(3) . . ?
OA_27 Eu8 Eu6 112.8(6) . . ?
Eu10 Eu8 Eu6 88.48(3) . . ?
OB_27 Eu8 Eu9 125.0(15) . . ?
O_19 Eu8 Eu9 101.6(4) . . ?
O_26 Eu8 Eu9 102.2(4) . . ?
O30 Eu8 Eu9 41.6(2) . . ?
O_20 Eu8 Eu9 41.7(3) . . ?
O_18 Eu8 Eu9 42.2(3) . . ?
OA_27 Eu8 Eu9 128.5(5) . . ?
Eu10 Eu8 Eu9 60.42(3) . . ?
Eu6 Eu8 Eu9 59.82(3) . . ?
O_23 Eu9 O_15 110.9(6) . . ?
O_23 Eu9 O_17 114.1(7) . . ?
O_15 Eu9 O_17 80.0(5) . . ?
O_23 Eu9 O30 177.5(7) . . ?
O_15 Eu9 O30 69.4(4) . . ?
O_17 Eu9 O30 68.4(4) . . ?
O_23 Eu9 O_20 109.9(7) . . ?
O_15 Eu9 O_20 139.2(5) . . ?
O_17 Eu9 O_20 82.0(5) . . ?
O30 Eu9 O_20 70.0(5) . . ?
O_23 Eu9 O_18 108.1(6) . . ?
O_15 Eu9 O_18 83.9(5) . . ?
O_17 Eu9 O_18 137.8(4) . . ?
O30 Eu9 O_18 69.5(4) . . ?
O_20 Eu9 O_18 85.4(5) . . ?
O_23 Eu9 Eu6 135.3(5) . . ?
O_15 Eu9 Eu6 45.9(3) . . ?
O_17 Eu9 Eu6 99.8(3) . . ?
O30 Eu9 Eu6 43.1(3) . . ?
O_20 Eu9 Eu6 102.6(4) . . ?
O_18 Eu9 Eu6 44.5(3) . . ?
O_23 Eu9 Eu10 138.5(5) . . ?
O_15 Eu9 Eu10 100.4(3) . . ?
O_17 Eu9 Eu10 44.8(3) . . ?
O30 Eu9 Eu10 43.0(3) . . ?
O_20 Eu9 Eu10 44.1(4) . . ?
O_18 Eu9 Eu10 101.6(3) . . ?
Eu6 Eu9 Eu10 86.10(4) . . ?
O_23 Eu9 Eu7 138.8(6) . . ?
O_15 Eu9 Eu7 43.6(3) . . ?
O_17 Eu9 Eu7 43.6(3) . . ?
O30 Eu9 Eu7 43.1(3) . . ?
O_20 Eu9 Eu7 100.9(4) . . ?
O_18 Eu9 Eu7 100.9(3) . . ?
Eu6 Eu9 Eu7 57.58(3) . . ?
Eu10 Eu9 Eu7 57.83(3) . . ?
O_23 Eu9 Eu8 134.5(6) . . ?
O_15 Eu9 Eu8 102.8(3) . . ?
O_17 Eu9 Eu8 100.8(3) . . ?
O30 Eu9 Eu8 43.5(3) . . ?
O_20 Eu9 Eu8 45.7(4) . . ?
O_18 Eu9 Eu8 45.7(3) . . ?
Eu6 Eu9 Eu8 58.57(3) . . ?
Eu10 Eu9 Eu8 57.50(3) . . ?
Eu7 Eu9 Eu8 86.60(3) . . ?
O_25 Eu10 O_21 104.8(8) . . ?
O_25 Eu10 O_19 107.3(7) . . ?
O_21 Eu10 O_19 106.7(6) . . ?
O_25 Eu10 O30 169.2(7) . . ?
O_21 Eu10 O30 78.3(5) . . ?
O_19 Eu10 O30 81.2(5) . . ?
O_25 Eu10 O_20 106.0(8) . . ?
O_21 Eu10 O_20 144.6(5) . . ?
O_19 Eu10 O_20 80.3(5) . . ?
O30 Eu10 O_20 68.4(4) . . ?
O_25 Eu10 O_17 103.9(7) . . ?
O_21 Eu10 O_17 77.3(5) . . ?
O_19 Eu10 O_17 146.0(4) . . ?
O30 Eu10 O_17 66.3(4) . . ?
O_20 Eu10 O_17 78.6(5) . . ?
O_25 Eu10 Eu8 136.9(7) . . ?
O_21 Eu10 Eu8 113.6(4) . . ?
O_19 Eu10 Eu8 43.7(3) . . ?
O30 Eu10 Eu8 46.4(3) . . ?
O_20 Eu10 Eu8 48.5(4) . . ?
O_17 Eu10 Eu8 103.1(3) . . ?
O_25 Eu10 Eu7 131.4(7) . . ?
O_21 Eu10 Eu7 42.2(4) . . ?
O_19 Eu10 Eu7 115.5(4) . . ?
O30 Eu10 Eu7 45.3(3) . . ?
O_20 Eu10 Eu7 102.9(4) . . ?
O_17 Eu10 Eu7 45.7(3) . . ?
Eu8 Eu10 Eu7 91.27(4) . . ?
O_25 Eu10 Eu9 127.2(7) . . ?
O_21 Eu10 Eu9 103.6(4) . . ?
O_19 Eu10 Eu9 105.8(3) . . ?
O30 Eu10 Eu9 42.4(3) . . ?
O_20 Eu10 Eu9 42.5(4) . . ?
O_17 Eu10 Eu9 42.5(3) . . ?
Eu8 Eu10 Eu9 62.09(3) . . ?
Eu7 Eu10 Eu9 61.39(3) . . ?
Eu9 O30 Eu6 94.4(4) . . ?
Eu9 O30 Eu10 94.5(5) . . ?
Eu6 O30 Eu10 171.1(5) . . ?
Eu9 O30 Eu7 94.8(4) . . ?
Eu6 O30 Eu7 89.3(4) . . ?
Eu10 O30 Eu7 89.8(4) . . ?
Eu9 O30 Eu8 94.9(4) . . ?
Eu6 O30 Eu8 90.6(5) . . ?
Eu10 O30 Eu8 88.7(4) . . ?
Eu7 O30 Eu8 170.3(5) . . ?
CB_15 O_15 CA_15 8(4) . . ?
CB_15 O_15 Eu9 137(4) . . ?
CA_15 O_15 Eu9 143(2) . . ?
CB_15 O_15 Eu7 115(3) . . ?
CA_15 O_15 Eu7 107.2(19) . . ?
Eu9 O_15 Eu7 94.9(5) . . ?
CB_15 O_15 Eu6 119(4) . . ?
CA_15 O_15 Eu6 118(2) . . ?
Eu9 O_15 Eu6 91.9(5) . . ?
Eu7 O_15 Eu6 86.1(4) . . ?
O_15 CA_15 C2A_15 110(4) . . ?
O_15 CA_15 C1A_15 103(4) . . ?
C2A_15 CA_15 C1A_15 97.5(16) . . ?
O_15 CA_15 Eu7 47.5(13) . . ?
C2A_15 CA_15 Eu7 100(3) . . ?
C1A_15 CA_15 Eu7 150(3) . . ?
O_15 CB_15 C2B_15 121(7) . . ?
O_15 CB_15 C1B_15 97(5) . . ?
C2B_15 CB_15 C1B_15 113(7) . . ?
C_16 O_16 Eu7 138.2(12) . . ?
C_16 O_16 Eu6 123.4(11) . . ?
Eu7 O_16 Eu6 95.2(5) . . ?
O_16 C_16 C1_16 111.9(19) . . ?
O_16 C_16 C2_16 107.1(18) . . ?
C1_16 C_16 C2_16 108(2) . . ?
C_17 O_17 Eu9 129.4(18) . . ?
C_17 O_17 Eu7 124.6(15) . . ?
Eu9 O_17 Eu7 94.3(5) . . ?
C_17 O_17 Eu10 117.2(17) . . ?
Eu9 O_17 Eu10 92.6(5) . . ?
Eu7 O_17 Eu10 87.6(4) . . ?
O_17 C_17 C1_17 114(2) . . ?
O_17 C_17 C2_17 114(3) . . ?
C1_17 C_17 C2_17 108(3) . . ?
C_18 O_18 Eu9 127.2(12) . . ?
C_18 O_18 Eu6 122.7(16) . . ?
Eu9 O_18 Eu6 92.4(4) . . ?
C_18 O_18 Eu8 124.4(15) . . ?
Eu9 O_18 Eu8 92.1(4) . . ?
Eu6 O_18 Eu8 87.2(3) . . ?
C2_18 C_18 O_18 118(3) . . ?
C2_18 C_18 C1_18 110(2) . . ?
O_18 C_18 C1_18 105(2) . . ?
C_19 O_19 Eu10 133.0(14) . . ?
C_19 O_19 Eu8 132.0(14) . . ?
Eu10 O_19 Eu8 95.0(5) . . ?
C2_19 C_19 O_19 112(3) . . ?
C2_19 C_19 C1_19 107(3) . . ?
O_19 C_19 C1_19 107(2) . . ?
C_20 O_20 Eu9 135.4(16) . . ?
C_20 O_20 Eu10 112.6(18) . . ?
Eu9 O_20 Eu10 93.4(5) . . ?
C_20 O_20 Eu8 124(2) . . ?
Eu9 O_20 Eu8 92.6(5) . . ?
Eu10 O_20 Eu8 85.8(5) . . ?
O_20 C_20 C1B_20 109(3) . . ?
O_20 C_20 C2B_20 123(3) . . ?
C1B_20 C_20 C2B_20 118(4) . . ?
O_20 C_20 C2A_20 104(5) . . ?
C1B_20 C_20 C2A_20 94(5) . . ?
C2B_20 C_20 C2A_20 46(4) . . ?
O_20 C_20 C1A_20 112(3) . . ?
C1B_20 C_20 C1A_20 27(3) . . ?
C2B_20 C_20 C1A_20 124(4) . . ?
C2A_20 C_20 C1A_20 117(6) . . ?
C_21 O_21 Eu10 144.1(17) . . ?
C_21 O_21 Eu7 115.8(16) . . ?
Eu10 O_21 Eu7 96.9(5) . . ?
O_21 C_21 C2A_21 111(3) . . ?
O_21 C_21 C1_21 108(2) . . ?
C2A_21 C_21 C1_21 120(3) . . ?
O_21 C_21 C2B_21 91(4) . . ?
C2A_21 C_21 C2B_21 35(4) . . ?
C1_21 C_21 C2B_21 154(5) . . ?
O_21 C_21 Eu7 40.9(10) . . ?
C2A_21 C_21 Eu7 115.7(17) . . ?
C1_21 C_21 Eu7 124.2(19) . . ?
C2B_21 C_21 Eu7 82(4) . . ?
C_22 O_22 Eu6 168.2(19) . . ?
O_22 C_22 C1_22 108(3) . . ?
O_22 C_22 C2B_22 107(3) . . ?
C1_22 C_22 C2B_22 104(3) . . ?
O_22 C_22 C2A_22 123(3) . . ?
C1_22 C_22 C2A_22 112(3) . . ?
C2B_22 C_22 C2A_22 25(2) . . ?
C_23 O_23 Eu9 171(2) . . ?
O_23 C_23 C2_23 109(3) . . ?
O_23 C_23 C1_23 109(3) . . ?
C2_23 C_23 C1_23 115(3) . . ?
C_24 O_24 Eu7 172(3) . . ?
C2_24 C_24 O_24 111(4) . . ?
C2_24 C_24 C1_24 120(4) . . ?
O_24 C_24 C1_24 109(3) . . ?
CA_25 O_25 CB_25 38(4) . . ?
CA_25 O_25 Eu10 168(2) . . ?
CB_25 O_25 Eu10 152(4) . . ?
O_25 CA_25 C1A_25 114(4) . . ?
O_25 CA_25 C2A_25 102(2) . . ?
C1A_25 CA_25 C2A_25 108(4) . . ?
O_25 CB_25 C1B_25 125(7) . . ?
CB_26 O_26 CA_26 25(4) . . ?
CB_26 O_26 Eu6 120(3) . . ?
CA_26 O_26 Eu6 126(2) . . ?
CB_26 O_26 Eu8 137(3) . . ?
CA_26 O_26 Eu8 114(3) . . ?
Eu6 O_26 Eu8 93.4(5) . . ?
O_26 CA_26 C2A_26 100(6) . . ?
O_26 CA_26 C1A_26 111(4) . . ?
C2A_26 CA_26 C1A_26 97.4(17) . . ?
O_26 CB_26 C2B_26 102(7) . . ?
O_26 CB_26 C1B_26 117(5) . . ?
C2B_26 CB_26 C1B_26 97.7(17) . . ?
CA_27 OA_27 Eu8 140(2) . . ?
OA_27 CA_27 C2A_27 110(3) . . ?
OA_27 CA_27 C1A_27 108(3) . . ?
C2A_27 CA_27 C1A_27 101(3) . . ?
CB_27 OB_27 Eu8 175(4) . . ?
OB_27 CB_27 C2B_27 125(7) . . ?
OB_27 CB_27 C1B_27 85.3(15) . . ?
C2B_27 CB_27 C1B_27 147(8) . . ?
C2_28 C_28 O_28 120(4) . . ?
C2_28 C_28 C1_28 115(4) . . ?
O_28 C_28 C1_28 104(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 O_7 2.458(12) . yes
Eu1 O_3 2.526(13) . yes
Eu1 O_12 2.558(15) . yes
Eu1 O_2 2.603(15) . yes
Eu1 O29 2.612(11) . yes
Eu1 O_5 2.616(11) . yes
Eu1 O_14 2.956(13) . yes
Eu1 Eu3 3.4866(12) . ?
Eu1 Eu2 3.5043(12) . ?
Eu1 Eu5 3.6260(15) . ?
Eu2 O_10 2.113(13) . yes
Eu2 O_3 2.305(13) . yes
Eu2 O_9 2.309(11) . yes
Eu2 O29 2.389(11) . yes
Eu2 O_5 2.471(10) . yes
Eu2 O_8 2.514(15) . yes
Eu2 Eu4 3.4030(13) . ?
Eu2 Eu5 3.5228(13) . ?
Eu3 O_13 2.111(16) . yes
Eu3 O_7 2.234(13) . yes
Eu3 O_4 2.262(12) . yes
Eu3 O29 2.381(10) . yes
Eu3 O_2 2.452(11) . yes
Eu3 O_6 2.532(12) . yes
Eu3 CB_6 3.22(4) . ?
Eu3 Eu4 3.4226(13) . ?
Eu3 Eu5 3.5189(14) . ?
Eu4 O_1 2.094(11) . yes
Eu4 O_9 2.306(14) . yes
Eu4 O_4 2.324(11) . yes
Eu4 O29 2.419(10) . yes
Eu4 O_6 2.446(14) . yes
Eu4 O_8 2.483(11) . yes
Eu4 CA_9 3.15(3) . ?
Eu4 Eu5 3.5556(12) . ?
Eu5 O_11 2.106(12) . yes
Eu5 O_2 2.321(14) . yes
Eu5 O_8 2.329(14) . yes
Eu5 O_5 2.365(12) . yes
Eu5 O29 2.378(10) . yes
Eu5 O_6 2.423(11) . yes
O_1 C_1 1.402(19) . ?
C_1 C2_1 1.50(3) . ?
C_1 C1_1 1.51(2) . ?
O_2 C_2 1.47(2) . ?
C_2 C1_2 1.46(4) . ?
C_2 C2_2 1.47(4) . ?
O_3 C_3 1.44(2) . ?
C_3 C2B_3 1.52(2) . ?
C_3 C1_3 1.524(16) . ?
C_3 C2A_3 1.529(19) . ?
O_4 C_4 1.41(2) . ?
C_4 C1_4 1.58(4) . ?
C_4 C2_4 1.89(12) . ?
O_5 C_5 1.40(2) . ?
C_5 C2_5 1.54(3) . ?
C_5 C1_5 1.58(2) . ?
O_6 CA_6 1.413(19) . ?
O_6 CB_6 1.439(19) . ?
CA_6 C1A_6 1.515(19) . ?
CA_6 C2A_6 1.52(2) . ?
CB_6 C2B_6 1.53(2) . ?
O_7 C_7 1.44(2) . ?
C_7 C1_7 1.43(4) . ?
C_7 C2_7 1.44(4) . ?
O_8 C_8 1.49(2) . ?
C_8 C2_8 1.51(4) . ?
C_8 C1_8 1.58(4) . ?
O_9 CA_9 1.409(18) . ?
O_9 CB_9 1.454(18) . ?
CA_9 C2A_9 1.52(2) . ?
CA_9 C1A_9 1.526(19) . ?
CB_9 C2B_9 1.52(2) . ?
CB_9 C1B_9 1.526(19) . ?
O_10 C_10 1.45(4) . ?
C_10 C2B_10 1.500(19) . ?
C_10 C1_10 1.507(19) . ?
C_10 C2A_10 1.52(2) . ?
O_11 CB_11 1.419(19) . ?
O_11 CA_11 1.435(19) . ?
CA_11 C1A_11 1.52(2) . ?
CA_11 C2A_11 1.53(2) . ?
CB_11 C1B_11 1.51(2) . ?
CB_11 C2B_11 1.53(2) . ?
O_12 C_12 1.40(3) . ?
C_12 C2_12 1.42(4) . ?
C_12 C1_12 1.61(3) . ?
O_13 CA_13 1.419(19) . ?
O_13 CB_13 1.429(19) . ?
CA_13 C2A_13 1.51(2) . ?
CA_13 C1A_13 1.51(2) . ?
CB_13 C2B_13 1.52(2) . ?
CB_13 C1B_13 1.52(2) . ?
O_14 C_14 1.34(3) . ?
C_14 C1_14 1.50(3) . ?
C_14 C2_14 1.50(4) . ?
Eu6 O_22 2.124(15) . ?
Eu6 O_16 2.348(12) . ?
Eu6 O_26 2.365(16) . ?
Eu6 O30 2.423(14) . ?
Eu6 O_18 2.481(12) . ?
Eu6 O_15 2.543(13) . ?
Eu6 Eu7 3.4198(13) . ?
Eu6 Eu8 3.4911(15) . ?
Eu6 Eu9 3.5368(15) . ?
Eu7 O_24 2.081(16) . ?
Eu7 O_16 2.284(15) . ?
Eu7 O_21 2.327(15) . ?
Eu7 O30 2.442(13) . ?
Eu7 O_17 2.463(14) . ?
Eu7 O_15 2.464(12) . ?
Eu7 CA_15 3.19(3) . ?
Eu7 C_21 3.20(2) . ?
Eu7 Eu10 3.4362(16) . ?
Eu7 Eu9 3.5637(14) . ?
Eu8 OB_27 2.11(5) . ?
Eu8 O_19 2.384(14) . ?
Eu8 O_26 2.431(18) . ?
Eu8 O30 2.489(13) . ?
Eu8 O_20 2.580(16) . ?
Eu8 O_18 2.580(13) . ?
Eu8 OA_27 2.60(2) . ?
Eu8 Eu10 3.4355(15) . ?
Eu8 Eu9 3.5997(15) . ?
Eu9 O_23 2.126(13) . ?
Eu9 O_15 2.374(16) . ?
Eu9 O_17 2.398(11) . ?
Eu9 O30 2.398(10) . ?
Eu9 O_20 2.398(16) . ?
Eu9 O_18 2.419(14) . ?
Eu9 Eu10 3.5425(13) . ?
Eu10 O_25 2.105(19) . ?
Eu10 O_21 2.264(14) . ?
Eu10 O_19 2.275(15) . ?
Eu10 O30 2.425(14) . ?
Eu10 O_20 2.468(15) . ?
Eu10 O_17 2.500(14) . ?
O_15 CB_15 1.42(2) . ?
O_15 CA_15 1.43(2) . ?
CA_15 C2A_15 1.53(2) . ?
CA_15 C1A_15 1.53(2) . ?
CB_15 C2B_15 1.52(2) . ?
CB_15 C1B_15 1.52(2) . ?
O_16 C_16 1.42(3) . ?
C_16 C1_16 1.47(4) . ?
C_16 C2_16 1.48(3) . ?
O_17 C_17 1.39(3) . ?
C_17 C1_17 1.52(5) . ?
C_17 C2_17 1.57(5) . ?
O_18 C_18 1.43(2) . ?
C_18 C2_18 1.32(4) . ?
C_18 C1_18 1.57(5) . ?
O_19 C_19 1.47(2) . ?
C_19 C2_19 1.36(4) . ?
C_19 C1_19 1.52(4) . ?
O_20 C_20 1.412(18) . ?
C_20 C1B_20 1.509(19) . ?
C_20 C2B_20 1.51(2) . ?
C_20 C2A_20 1.53(2) . ?
C_20 C1A_20 1.53(2) . ?
O_21 C_21 1.41(3) . ?
C_21 C2A_21 1.502(19) . ?
C_21 C1_21 1.503(19) . ?
C_21 C2B_21 1.52(2) . ?
O_22 C_22 1.41(3) . ?
C_22 C1_22 1.522(19) . ?
C_22 C2B_22 1.52(2) . ?
C_22 C2A_22 1.526(19) . ?
O_23 C_23 1.41(2) . ?
C_23 C2_23 1.47(5) . ?
C_23 C1_23 1.52(5) . ?
O_24 C_24 1.47(4) . ?
C_24 C2_24 1.41(6) . ?
C_24 C1_24 1.48(4) . ?
O_25 CA_25 1.424(19) . ?
O_25 CB_25 1.43(2) . ?
CA_25 C1A_25 1.51(2) . ?
CA_25 C2A_25 1.528(19) . ?
CB_25 C1B_25 1.52(2) . ?
O_26 CB_26 1.43(2) . ?
O_26 CA_26 1.43(2) . ?
CA_26 C2A_26 1.52(2) . ?
CA_26 C1A_26 1.53(2) . ?
CB_26 C2B_26 1.52(2) . ?
CB_26 C1B_26 1.53(2) . ?
OA_27 CA_27 1.422(19) . ?
CA_27 C2A_27 1.520(19) . ?
CA_27 C1A_27 1.53(2) . ?
OB_27 CB_27 1.42(2) . ?
CB_27 C2B_27 1.52(2) . ?
CB_27 C1B_27 1.53(2) . ?
O_28 C_28 1.46(5) . ?
C_28 C2_28 1.43(5) . ?
C_28 C1_28 1.65(6) . ?
