#------------------------------------------------------------------------------
#$Date: 2025-08-21 01:01:10 +0300 (Thu, 21 Aug 2025) $
#$Revision: 301838 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/32/14/4321444.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_4321444
loop_
_publ_author_name
'Brian M. Rapko'
'Bruce K. McNamara'
'Robin D. Rogers'
'Grant A. Broker'
'Gregg J. Lumetta'
'Benjamin P. Hay'
_publ_section_title
;
 Coordination of Lanthanide Triflates and Perchlorates with
 N,N,N',N'-Tetramethylsuccinamide
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              4858
_journal_page_last               4867
_journal_paper_doi               10.1021/ic000244k
_journal_volume                  39
_journal_year                    2000
_chemical_formula_structural     '[Eu(TMSA)~4~][ClO~4~]~3~'
_chemical_formula_sum            'C32 H64 Cl3 Eu N8 O20'
_chemical_formula_weight         1139.22
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL
_cell_angle_alpha                106.594(1)
_cell_angle_beta                 91.538(1)
_cell_angle_gamma                90.311(1)
_cell_formula_units_Z            2
_cell_length_a                   10.9611(2)
_cell_length_b                   14.6144(3)
_cell_length_c                   15.7992(2)
_cell_measurement_reflns_used    6145
_cell_measurement_temperature    173(2)
_cell_volume                     2424.37(7)
_computing_cell_refinement       'Siemens XSCANS'
_computing_data_collection       'Siemens XSCANS'
_computing_data_reduction        'Siemens SHELXTL'
_computing_molecular_graphics    'Siemens SHELXTL'
_computing_publication_material  'Siemens SHELXTL'
_computing_structure_refinement  'SHELXL-93 (Sheldrick, 1993)'
_computing_structure_solution    'SHELXS-86 (Sheldrick, 1990)'
_diffrn_ambient_temperature      173(2)
_diffrn_measurement_device       'Siemens P4'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0280
_diffrn_reflns_av_sigmaI/netI    0.0826
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_number            15331
_diffrn_reflns_theta_max         27.90
_diffrn_reflns_theta_min         1.35
_exptl_absorpt_coefficient_mu    1.538
_exptl_absorpt_correction_T_max  0.97
_exptl_absorpt_correction_T_min  0.76
_exptl_absorpt_correction_type   SADABS
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.561
_exptl_crystal_description       parallelepiped
_exptl_crystal_F_000             1172
_exptl_crystal_size_max          0.19
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.56
_refine_diff_density_max         1.332
_refine_diff_density_min         -1.241
_refine_diff_density_rms         0.122
_refine_ls_extinction_coef       0.0008(2)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_all   0.992
_refine_ls_goodness_of_fit_obs   1.036
_refine_ls_matrix_type           full
_refine_ls_number_parameters     594
_refine_ls_number_reflns         10711
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.087
_refine_ls_restrained_S_obs      1.036
_refine_ls_R_factor_all          0.0713
_refine_ls_R_factor_obs          0.0450
_refine_ls_shift/esd_max         0.614
_refine_ls_shift/esd_mean        0.009
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_scheme      '0.0500, 0.0000'
_refine_ls_wR_factor_all         0.1137
_refine_ls_wR_factor_obs         0.0935
_reflns_number_observed          8102
_reflns_number_total             10718
_reflns_observed_criterion       >2sigma(I)
_cod_data_source_file            ic000244k_4.cif
_cod_data_source_block           compound4
_cod_database_code               4321444
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_thermal_displace_type
_atom_site_occupancy
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_group
Eu Eu 0.24207(2) 0.29255(2) 0.290094(14) 0.01894(8) Uani 1 d . .
Cl1 Cl 0.74653(12) 0.64624(10) 0.16941(9) 0.0436(3) Uani 1 d . .
Cl2 Cl 0.25731(13) 0.85742(10) 0.38873(10) 0.0460(3) Uani 1 d . .
Cl3 Cl 0.73546(13) 0.15581(10) 0.14727(9) 0.0450(3) Uani 1 d . .
O1 O 0.3418(3) 0.2668(2) 0.1557(2) 0.0322(8) Uani 1 d . .
O2 O 0.2609(3) 0.4479(2) 0.2622(2) 0.0272(7) Uani 1 d . .
O3 O 0.0772(3) 0.3072(2) 0.1946(2) 0.0293(7) Uani 1 d . .
O4 O 0.0969(3) 0.3941(2) 0.3827(2) 0.0236(7) Uani 1 d . .
O5 O 0.1275(3) 0.1490(2) 0.2529(2) 0.0339(8) Uani 1 d . .
O6 O 0.2327(3) 0.2424(2) 0.4236(2) 0.0295(7) Uani 1 d . .
O7 O 0.4015(3) 0.1847(2) 0.2876(2) 0.0308(7) Uani 1 d . .
O8 O 0.3966(3) 0.3831(2) 0.3900(2) 0.0244(7) Uani 1 d . .
O9 O 0.6837(4) 0.5981(4) 0.0888(3) 0.085(2) Uani 1 d . .
O10 O 0.8747(4) 0.6247(3) 0.1625(3) 0.0661(13) Uani 1 d . .
O11 O 0.6987(4) 0.6155(4) 0.2399(3) 0.0750(15) Uani 1 d . .
O12 O 0.7304(5) 0.7462(3) 0.1857(4) 0.095(2) Uani 1 d . .
O13 O 0.3125(6) 0.7960(4) 0.3164(4) 0.108(2) Uani 1 d . .
O14 O 0.2041(5) 0.8123(5) 0.4439(5) 0.140(3) Uani 1 d . .
O15 O 0.1891(6) 0.9281(4) 0.3686(4) 0.118(2) Uani 1 d . .
O16 O 0.3654(7) 0.9035(6) 0.4365(5) 0.150(3) Uani 1 d . .
O17 O 0.7996(9) 0.1450(8) 0.0788(5) 0.230(5) Uani 1 d . .
O18 O 0.6469(7) 0.0899(4) 0.1465(5) 0.158(3) Uani 1 d . .
O19 O 0.8097(5) 0.1693(5) 0.2257(4) 0.112(2) Uani 1 d . .
O20 O 0.6711(5) 0.2451(4) 0.1676(4) 0.104(2) Uani 1 d . .
N1 N 0.4244(4) 0.2084(3) 0.0234(3) 0.0344(10) Uani 1 d . .
N2 N 0.2925(3) 0.5503(3) 0.1828(2) 0.0293(9) Uani 1 d . .
N3 N -0.0014(4) 0.3354(3) 0.0725(3) 0.0411(11) Uani 1 d . .
N4 N 0.0299(3) 0.5412(3) 0.3922(2) 0.0241(8) Uani 1 d . .
N5 N 0.0360(4) 0.0066(3) 0.1961(3) 0.0351(10) Uani 1 d . .
N6 N 0.1968(4) 0.1559(3) 0.5164(2) 0.0291(9) Uani 1 d . .
N7 N 0.4785(4) 0.0445(3) 0.2919(3) 0.0365(10) Uani 1 d . .
N8 N 0.4684(3) 0.3767(3) 0.5231(2) 0.0245(8) Uani 1 d . .
C1 C 0.4092(4) 0.2783(3) 0.0974(3) 0.0261(10) Uani 1 d . .
C2 C 0.4740(5) 0.3732(3) 0.1087(3) 0.0353(12) Uani 1 d . .
H2A H 0.4415(5) 0.4024(3) 0.0635(3) 0.042 Uiso 1 calc R .
H2B H 0.5620(5) 0.3617(3) 0.0985(3) 0.042 Uiso 1 calc R .
C3 C 0.4589(4) 0.4427(3) 0.1998(3) 0.0299(11) Uani 1 d . .
H3A H 0.4822(4) 0.4105(3) 0.2450(3) 0.036 Uiso 1 calc R .
H3B H 0.5157(4) 0.4975(3) 0.2069(3) 0.036 Uiso 1 calc R .
C4 C 0.3302(4) 0.4802(3) 0.2166(3) 0.0239(10) Uani 1 d . .
C5 C 0.3700(6) 0.1154(4) 0.0130(4) 0.053(2) Uani 1 d . .
H5A H 0.3362(32) 0.0900(13) -0.0473(9) 0.080 Uiso 1 calc R .
H5B H 0.3046(25) 0.1210(6) 0.0552(18) 0.080 Uiso 1 calc R .
H5C H 0.4323(10) 0.0720(8) 0.0241(26) 0.080 Uiso 1 calc R .
C6 C 0.5043(6) 0.2165(4) -0.0469(4) 0.055(2) Uani 1 d . .
H6A H 0.4709(20) 0.1776(23) -0.1041(4) 0.083 Uiso 1 calc R .
H6B H 0.5859(11) 0.1940(27) -0.0366(14) 0.083 Uiso 1 calc R .
H6C H 0.5097(30) 0.2834(6) -0.0470(18) 0.083 Uiso 1 calc R .
C7 C 0.1668(5) 0.5829(4) 0.1959(4) 0.0415(13) Uani 1 d . .
H7A H 0.1660(5) 0.6529(4) 0.2137(22) 0.062 Uiso 1 calc R .
H7B H 0.1311(11) 0.5597(20) 0.2422(16) 0.062 Uiso 1 calc R .
H7C H 0.1191(9) 0.5581(20) 0.1406(7) 0.062 Uiso 1 calc R .
C8 C 0.3660(5) 0.5957(4) 0.1305(4) 0.0457(14) Uani 1 d . .
H8A H 0.3569(26) 0.6652(4) 0.1520(16) 0.069 Uiso 1 calc R .
H8B H 0.3385(22) 0.5732(20) 0.0684(5) 0.069 Uiso 1 calc R .
H8C H 0.4519(6) 0.5795(21) 0.1358(19) 0.069 Uiso 1 calc R .
C9 C -0.0013(4) 0.3451(3) 0.1591(3) 0.0271(10) Uani 1 d . .
C10 C -0.0996(4) 0.4052(3) 0.2128(3) 0.0324(11) Uani 1 d . .
H10A H -0.1805(4) 0.3815(3) 0.1859(3) 0.039 Uiso 1 calc R .
H10B H -0.0898(4) 0.4720(3) 0.2110(3) 0.039 Uiso 1 calc R .
C11 C -0.0954(4) 0.4034(3) 0.3092(3) 0.0267(10) Uani 1 d . .
H11A H -0.1675(4) 0.4375(3) 0.3386(3) 0.032 Uiso 1 calc R .
H11B H -0.1030(4) 0.3361(3) 0.3101(3) 0.032 Uiso 1 calc R .
C12 C 0.0175(4) 0.4468(3) 0.3633(3) 0.0221(9) Uani 1 d . .
C13 C 0.0883(6) 0.2726(5) 0.0183(3) 0.059(2) Uani 1 d . .
H13A H 0.0848(28) 0.2796(23) -0.0415(9) 0.089 Uiso 1 calc R .
H13B H 0.0698(24) 0.2062(5) 0.0158(24) 0.089 Uiso 1 calc R .
H13C H 0.1702(7) 0.2901(20) 0.0445(16) 0.089 Uiso 1 calc R .
C14 C -0.0978(7) 0.3732(5) 0.0259(4) 0.076(2) Uani 1 d . .
H14A H -0.0664(14) 0.3808(32) -0.0292(16) 0.114 Uiso 1 calc R .
H14B H -0.1238(31) 0.4353(16) 0.0635(13) 0.114 Uiso 1 calc R .
H14C H -0.1676(18) 0.3287(17) 0.0125(27) 0.114 Uiso 1 calc R .
C15 C 0.1376(4) 0.5836(3) 0.4461(3) 0.0313(11) Uani 1 d . .
H15A H 0.1627(16) 0.6414(12) 0.4311(14) 0.047 Uiso 1 calc R .
H15B H 0.2043(9) 0.5377(8) 0.4345(15) 0.047 Uiso 1 calc R .
H15C H 0.1180(9) 0.6001(20) 0.5088(3) 0.047 Uiso 1 calc R .
C16 C -0.0607(4) 0.6102(3) 0.3801(3) 0.0313(11) Uani 1 d . .
H16A H -0.0195(5) 0.6619(11) 0.3633(19) 0.047 Uiso 1 calc R .
H16B H -0.1030(19) 0.6367(16) 0.4354(6) 0.047 Uiso 1 calc R .
H16C H -0.1200(16) 0.5781(6) 0.3334(14) 0.047 Uiso 1 calc R .
C17 C 0.0586(4) 0.0848(3) 0.2616(3) 0.0284(10) Uani 1 d . .
C18 C 0.0008(4) 0.0924(3) 0.3512(3) 0.0343(12) Uani 1 d . .
H18A H -0.0889(4) 0.0850(3) 0.3421(3) 0.041 Uiso 1 calc R .
H18B H 0.0302(4) 0.0391(3) 0.3730(3) 0.041 Uiso 1 calc R .
C19 C 0.0287(4) 0.1850(3) 0.4208(3) 0.0303(11) Uani 1 d . .
H19A H 0.0093(4) 0.2385(3) 0.3962(3) 0.036 Uiso 1 calc R .
H19B H -0.0248(4) 0.1899(3) 0.4713(3) 0.036 Uiso 1 calc R .
C20 C 0.1591(4) 0.1949(3) 0.4537(3) 0.0261(10) Uani 1 d . .
C21 C 0.0839(6) -0.0016(5) 0.1087(3) 0.061(2) Uani 1 d . .
H21A H 0.1151(36) -0.0661(11) 0.0835(13) 0.091 Uiso 1 calc R .
H21B H 0.1502(27) 0.0452(22) 0.1142(5) 0.091 Uiso 1 calc R .
H21C H 0.0186(11) 0.0106(30) 0.0699(9) 0.091 Uiso 1 calc R .
C22 C -0.0469(6) -0.0700(4) 0.2030(4) 0.058(2) Uani 1 d . .
H22A H -0.0193(22) -0.1313(5) 0.1649(21) 0.086 Uiso 1 calc R .
H22B H -0.1296(9) -0.0577(15) 0.1844(25) 0.086 Uiso 1 calc R .
H22C H -0.0470(29) -0.0723(20) 0.2644(7) 0.086 Uiso 1 calc R .
C23 C 0.1199(5) 0.1016(4) 0.5595(3) 0.0466(14) Uani 1 d . .
H23A H 0.1497(21) 0.0362(8) 0.5469(20) 0.070 Uiso 1 calc R .
H23B H 0.0356(8) 0.1005(22) 0.5369(18) 0.070 Uiso 1 calc R .
H23C H 0.1229(27) 0.1319(16) 0.6234(4) 0.070 Uiso 1 calc R .
C24 C 0.3252(5) 0.1627(4) 0.5456(3) 0.0415(13) Uani 1 d . .
H24A H 0.3317(5) 0.1951(21) 0.6091(5) 0.062 Uiso 1 calc R .
H24B H 0.3711(7) 0.1990(20) 0.5134(16) 0.062 Uiso 1 calc R .
H24C H 0.3587(9) 0.0984(4) 0.5340(20) 0.062 Uiso 1 calc R .
C25 C 0.4811(4) 0.1396(3) 0.3162(3) 0.0298(11) Uani 1 d . .
C26 C 0.5823(4) 0.1912(3) 0.3783(3) 0.0343(12) Uani 1 d . .
H26A H 0.6615(4) 0.1643(3) 0.3553(3) 0.041 Uiso 1 calc R .
H26B H 0.5725(4) 0.1800(3) 0.4367(3) 0.041 Uiso 1 calc R .
C27 C 0.5847(4) 0.2990(3) 0.3903(3) 0.0313(11) Uani 1 d . .
H27A H 0.6596(4) 0.3263(3) 0.4250(3) 0.038 Uiso 1 calc R .
H27B H 0.5912(4) 0.3093(3) 0.3313(3) 0.038 Uiso 1 calc R .
C28 C 0.4762(4) 0.3549(3) 0.4353(3) 0.0225(9) Uani 1 d . .
C29 C 0.3872(5) -0.0059(4) 0.2272(4) 0.0484(14) Uani 1 d . .
H29A H 0.3744(24) -0.0702(10) 0.2333(16) 0.073 Uiso 1 calc R .
H29B H 0.4150(16) -0.0108(23) 0.1677(4) 0.073 Uiso 1 calc R .
H29C H 0.3103(11) 0.0289(14) 0.2368(16) 0.073 Uiso 1 calc R .
C30 C 0.5742(6) -0.0132(4) 0.3170(4) 0.059(2) Uani 1 d . .
H30A H 0.5388(9) -0.0738(13) 0.3202(26) 0.088 Uiso 1 calc R .
H30B H 0.6100(25) 0.0216(13) 0.3748(13) 0.088 Uiso 1 calc R .
H30C H 0.6377(19) -0.0259(24) 0.2728(14) 0.088 Uiso 1 calc R .
C31 C 0.3656(4) 0.4313(3) 0.5667(3) 0.0328(11) Uani 1 d . .
H31A H 0.3282(18) 0.3979(11) 0.6054(16) 0.049 Uiso 1 calc R .
H31B H 0.3050(13) 0.4379(19) 0.5221(3) 0.049 Uiso 1 calc R .
H31C H 0.3942(6) 0.4947(8) 0.6020(16) 0.049 Uiso 1 calc R .
C32 C 0.5593(4) 0.3531(4) 0.5826(3) 0.0338(11) Uani 1 d . .
H32A H 0.5182(5) 0.3280(20) 0.6257(13) 0.051 Uiso 1 calc R .
H32B H 0.6063(19) 0.4107(6) 0.6137(15) 0.051 Uiso 1 calc R .
H32C H 0.6145(17) 0.3049(16) 0.5483(4) 0.051 Uiso 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 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'
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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Eu Eu -0.1578 3.6682 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
O1 Eu O7 71.66(11) . . ?
O1 Eu O5 97.41(11) . . ?
O7 Eu O5 80.84(11) . . ?
O1 Eu O3 79.10(11) . . ?
O7 Eu O3 136.66(11) . . ?
O5 Eu O3 71.86(11) . . ?
O1 Eu O8 100.03(11) . . ?
O7 Eu O8 74.93(10) . . ?
O5 Eu O8 143.73(10) . . ?
O3 Eu O8 142.75(10) . . ?
O1 Eu O4 142.68(10) . . ?
O7 Eu O4 144.34(10) . . ?
O5 Eu O4 98.45(11) . . ?
O3 Eu O4 74.17(10) . . ?
O8 Eu O4 86.47(10) . . ?
O1 Eu O6 143.72(11) . . ?
O7 Eu O6 72.22(11) . . ?
O5 Eu O6 73.44(11) . . ?
O3 Eu O6 127.55(10) . . ?
O8 Eu O6 73.68(10) . . ?
O4 Eu O6 73.46(10) . . ?
O1 Eu O2 73.31(10) . . ?
O7 Eu O2 125.94(11) . . ?
O5 Eu O2 143.76(11) . . ?
O3 Eu O2 71.99(10) . . ?
O8 Eu O2 72.18(10) . . ?
O4 Eu O2 73.94(10) . . ?
O6 Eu O2 133.58(10) . . ?
O9 Cl1 O12 108.6(3) . . ?
O9 Cl1 O11 109.6(3) . . ?
O12 Cl1 O11 110.1(3) . . ?
O9 Cl1 O10 109.8(3) . . ?
O12 Cl1 O10 109.6(3) . . ?
O11 Cl1 O10 109.1(3) . . ?
O14 Cl2 O15 115.8(3) . . ?
O14 Cl2 O13 114.2(4) . . ?
O15 Cl2 O13 114.1(4) . . ?
O14 Cl2 O16 105.0(5) . . ?
O15 Cl2 O16 106.6(4) . . ?
O13 Cl2 O16 98.9(4) . . ?
O17 Cl3 O18 118.9(6) . . ?
O17 Cl3 O19 111.9(5) . . ?
O18 Cl3 O19 108.5(5) . . ?
O17 Cl3 O20 111.2(6) . . ?
O18 Cl3 O20 103.9(4) . . ?
O19 Cl3 O20 100.8(4) . . ?
C1 O1 Eu 161.6(3) . . ?
C4 O2 Eu 133.3(3) . . ?
C9 O3 Eu 159.4(3) . . ?
C12 O4 Eu 129.6(3) . . ?
C17 O5 Eu 159.4(3) . . ?
C20 O6 Eu 135.3(3) . . ?
C25 O7 Eu 158.8(3) . . ?
C28 O8 Eu 129.2(3) . . ?
C1 N1 C5 120.0(4) . . ?
C1 N1 C6 123.5(4) . . ?
C5 N1 C6 116.2(4) . . ?
C4 N2 C8 125.3(4) . . ?
C4 N2 C7 118.9(4) . . ?
C8 N2 C7 115.7(4) . . ?
C9 N3 C13 118.8(4) . . ?
C9 N3 C14 123.3(5) . . ?
C13 N3 C14 117.3(4) . . ?
C12 N4 C15 119.6(4) . . ?
C12 N4 C16 125.6(4) . . ?
C15 N4 C16 114.7(4) . . ?
C17 N5 C21 119.7(4) . . ?
C17 N5 C22 123.3(4) . . ?
C21 N5 C22 116.7(4) . . ?
C20 N6 C23 125.4(4) . . ?
C20 N6 C24 120.5(4) . . ?
C23 N6 C24 114.1(4) . . ?
C25 N7 C29 119.2(4) . . ?
C25 N7 C30 123.4(5) . . ?
C29 N7 C30 116.8(4) . . ?
C28 N8 C31 120.1(4) . . ?
C28 N8 C32 125.1(4) . . ?
C31 N8 C32 114.8(4) . . ?
O1 C1 N1 120.7(4) . . ?
O1 C1 C2 120.5(4) . . ?
N1 C1 C2 118.7(4) . . ?
C1 C2 C3 113.0(4) . . ?
C4 C3 C2 113.8(4) . . ?
O2 C4 N2 120.1(4) . . ?
O2 C4 C3 120.6(4) . . ?
N2 C4 C3 119.3(4) . . ?
O3 C9 N3 121.2(4) . . ?
O3 C9 C10 120.9(4) . . ?
N3 C9 C10 118.0(4) . . ?
C9 C10 C11 112.5(4) . . ?
C12 C11 C10 116.1(4) . . ?
O4 C12 N4 120.4(4) . . ?
O4 C12 C11 120.2(4) . . ?
N4 C12 C11 119.4(4) . . ?
O5 C17 N5 121.5(4) . . ?
O5 C17 C18 120.6(4) . . ?
N5 C17 C18 117.8(4) . . ?
C19 C18 C17 114.0(4) . . ?
C20 C19 C18 113.6(4) . . ?
O6 C20 N6 119.6(4) . . ?
O6 C20 C19 119.6(4) . . ?
N6 C20 C19 120.8(4) . . ?
O7 C25 N7 120.4(5) . . ?
O7 C25 C26 120.9(4) . . ?
N7 C25 C26 118.7(4) . . ?
C25 C26 C27 113.1(4) . . ?
C28 C27 C26 116.6(4) . . ?
O8 C28 N8 120.4(4) . . ?
O8 C28 C27 119.7(4) . . ?
N8 C28 C27 119.8(4) . . ?
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
Eu O1 2.349(3) . ?
Eu O7 2.353(3) . ?
Eu O5 2.356(3) . ?
Eu O3 2.373(3) . ?
Eu O8 2.398(3) . ?
Eu O4 2.406(3) . ?
Eu O6 2.427(3) . ?
Eu O2 2.442(3) . ?
Cl1 O9 1.423(5) . ?
Cl1 O12 1.422(5) . ?
Cl1 O11 1.426(4) . ?
Cl1 O10 1.441(4) . ?
Cl2 O14 1.373(5) . ?
Cl2 O15 1.382(5) . ?
Cl2 O13 1.391(5) . ?
Cl2 O16 1.443(6) . ?
Cl3 O17 1.278(6) . ?
Cl3 O18 1.361(6) . ?
Cl3 O19 1.428(6) . ?
Cl3 O20 1.444(5) . ?
O1 C1 1.244(5) . ?
O2 C4 1.241(5) . ?
O3 C9 1.232(5) . ?
O4 C12 1.254(5) . ?
O5 C17 1.241(5) . ?
O6 C20 1.249(5) . ?
O7 C25 1.247(5) . ?
O8 C28 1.258(5) . ?
N1 C1 1.331(6) . ?
N1 C5 1.445(7) . ?
N1 C6 1.463(6) . ?
N2 C4 1.345(5) . ?
N2 C8 1.455(6) . ?
N2 C7 1.461(6) . ?
N3 C9 1.335(6) . ?
N3 C13 1.465(7) . ?
N3 C14 1.470(7) . ?
N4 C12 1.329(5) . ?
N4 C15 1.463(6) . ?
N4 C16 1.466(5) . ?
N5 C17 1.322(6) . ?
N5 C21 1.464(6) . ?
N5 C22 1.468(6) . ?
N6 C20 1.334(6) . ?
N6 C23 1.461(6) . ?
N6 C24 1.464(6) . ?
N7 C25 1.331(6) . ?
N7 C29 1.448(7) . ?
N7 C30 1.465(6) . ?
N8 C28 1.336(5) . ?
N8 C31 1.455(6) . ?
N8 C32 1.462(6) . ?
C1 C2 1.515(6) . ?
C2 C3 1.520(6) . ?
C3 C4 1.518(6) . ?
C9 C10 1.513(7) . ?
C10 C11 1.530(6) . ?
C11 C12 1.513(6) . ?
C17 C18 1.541(6) . ?
C18 C19 1.503(7) . ?
C19 C20 1.500(6) . ?
C25 C26 1.508(7) . ?
C26 C27 1.532(7) . ?
C27 C28 1.520(6) . ?
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
N1 C1 C2 C3 -174.1(4) . . . . ?
C1 C2 C3 C4 -69.5(5) . . . . ?
C2 C3 C4 N2 -79.0(5) . . . . ?
O1 C1 C2 C3 7.0(6) . . . . ?
C1 C2 C3 C4 -69.5(5) . . . . ?
C2 C3 C4 O2 102.3(5) . . . . ?
N3 C9 C10 C11 175.1(4) . . . . ?
C9 C10 C11 C12 64.7(5) . . . . ?
C10 C11 C12 N4 76.3(5) . . . . ?
O3 C9 C10 C11 -5.7(6) . . . . ?
C9 C10 C11 C12 64.7(5) . . . . ?
C10 C11 C12 O4 -105.8(5) . . . . ?
N5 C17 C18 C19 -178.3(4) . . . . ?
C17 C18 C19 C20 -70.3(5) . . . . ?
C18 C19 C20 N6 -82.9(5) . . . . ?
O5 C17 C18 C19 4.1(7) . . . . ?
C17 C18 C19 C20 -70.3(5) . . . . ?
C18 C19 C20 O6 98.8(5) . . . . ?
N7 C25 C26 C27 171.8(4) . . . . ?
C25 C26 C27 C28 65.6(5) . . . . ?
C26 C27 C28 N8 77.9(5) . . . . ?
O7 C25 C26 C27 -7.8(6) . . . . ?
C25 C26 C27 C28 65.6(5) . . . . ?
C26 C27 C28 O8 -104.5(5) . . . . ?
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 PubChem 139134253
