# Electronic Supplementary Material (ESI) for ChemComm.
# This journal is © The Royal Society of Chemistry 2017

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
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data_r-3
_database_code_depnum_ccdc_archive 'CCDC 1499234'
_audit_update_record             
;
2016-08-15 deposited with the CCDC.
2017-01-30 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/6
_chemical_name_systematic        Eu4L6
_chemical_name_common            'lanthanide tetrahedron'
_chemical_melting_point          ?
_chemical_formula_moiety         'C168 H132 Eu4 N36 O24,12(C F3 O3 S), 3(O)'
_chemical_formula_sum            'C180 H132 Eu4 F36 N36 O63 S12'
_chemical_formula_weight         5483.77

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0077 0.0035 '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 0.0139 0.0070 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Eu Eu -0.3075 6.3534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0226 0.0127 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0343 0.0213 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.2034 0.2377 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      trigonal
_space_group_IT_number           148
_space_group_name_H-M_alt        'R -3 :H'
_space_group_name_Hall           '-R 3'

_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.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'x+2/3, y+1/3, z+1/3'
'-y+2/3, x-y+1/3, z+1/3'
'-x+y+2/3, -x+1/3, z+1/3'
'x+1/3, y+2/3, z+2/3'
'-y+1/3, x-y+2/3, z+2/3'
'-x+y+1/3, -x+2/3, z+2/3'
'-x, -y, -z'
'y, -x+y, -z'
'x-y, x, -z'
'-x+2/3, -y+1/3, -z+1/3'
'y+2/3, -x+y+1/3, -z+1/3'
'x-y+2/3, x+1/3, -z+1/3'
'-x+1/3, -y+2/3, -z+2/3'
'y+1/3, -x+y+2/3, -z+2/3'
'x-y+1/3, x+2/3, -z+2/3'

_cell_length_a                   25.300(4)
_cell_length_b                   25.300(4)
_cell_length_c                   64.395(13)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_volume                     35696(12)
_cell_formula_units_Z            6
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    320
_cell_measurement_theta_min      1.353
_cell_measurement_theta_max      27.473

_exptl_crystal_description       block
_exptl_crystal_colour            yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.531
_exptl_crystal_F_000             16416
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.08
_exptl_crystal_size_mid          0.08
_exptl_crystal_size_min          0.06
_exptl_absorpt_coefficient_mu    2.920
_shelx_estimated_absorpt_T_min   ?
_shelx_estimated_absorpt_T_max   ?
_exptl_absorpt_correction_type   none
_exptl_absorpt_correction_T_min  ?
_exptl_absorpt_correction_T_max  ?
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.97944
_diffrn_radiation_type           synchrotron
_diffrn_source                   'SSRF BL17U beamline'
_diffrn_measurement_device_type  'Bruker P4'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            27764
_diffrn_reflns_av_unetI/netI     0.0645
_diffrn_reflns_av_R_equivalents  0.0881
_diffrn_reflns_limit_h_min       -20
_diffrn_reflns_limit_h_max       20
_diffrn_reflns_limit_k_min       -23
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_l_min       -60
_diffrn_reflns_limit_l_max       60
_diffrn_reflns_theta_min         1.353
_diffrn_reflns_theta_max         27.473
_diffrn_reflns_theta_full        35.991
_diffrn_measured_fraction_theta_max 0.818
_diffrn_measured_fraction_theta_full 0.396
_diffrn_reflns_Laue_measured_fraction_max 0.818
_diffrn_reflns_Laue_measured_fraction_full 0.396
_diffrn_reflns_point_group_measured_fraction_max 0.818
_diffrn_reflns_point_group_measured_fraction_full 0.396
_reflns_number_total             5701
_reflns_number_gt                4860
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       Blu-Ice
_computing_cell_refinement       HKL2000
_computing_data_reduction        HKL2000
_computing_structure_solution    'SHELXS-2014/6 (Sheldrick, 2014)'
_computing_structure_refinement  'SHELXL-2014/6 (Sheldrick, 2014)'
_computing_molecular_graphics    ?
_computing_publication_material  ?
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.2000P)²] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         5701
_refine_ls_number_parameters     899
_refine_ls_number_restraints     1242
_refine_ls_R_factor_all          0.1032
_refine_ls_R_factor_gt           0.0965
_refine_ls_wR_factor_ref         0.3103
_refine_ls_wR_factor_gt          0.2999
_refine_ls_goodness_of_fit_ref   1.444
_refine_ls_restrained_S_all      1.394
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Eu1 Eu 0.36675(3) 0.38852(3) 0.44909(2) 0.1200(6) Uani 1 1 d . U . . .
Eu2 Eu 0.3333 0.6667 0.30857(2) 0.1113(7) Uani 1 3 d S TU P . .
C1_1 C 0.3599(10) 0.2490(7) 0.4286(3) 0.188(6) Uani 1 1 d D U . . .
H1A_1 H 0.3160 0.2256 0.4268 0.225 Uiso 1 1 calc R U . . .
H1B_1 H 0.3707 0.2379 0.4417 0.225 Uiso 1 1 calc R U . . .
C2_1 C 0.3936(11) 0.2396(8) 0.4101(4) 0.203(7) Uani 1 1 d D U . . .
H2A_1 H 0.4201 0.2249 0.4151 0.244 Uiso 1 1 calc R U . . .
H2B_1 H 0.3645 0.2099 0.4005 0.244 Uiso 1 1 calc R U . . .
O3_1 O 0.4286(7) 0.2974(6) 0.4002(2) 0.186(4) Uani 1 1 d D U . . .
C4_1 C 0.4163(8) 0.3351(7) 0.4123(3) 0.147(4) Uani 1 1 d D U . . .
N5_1 N 0.3830(7) 0.3161(5) 0.4274(2) 0.146(3) Uani 1 1 d D U . . .
N6_1 N 0.4467(4) 0.4362(4) 0.42053(11) 0.117(3) Uani 1 1 d DG U . . .
C7_1 C 0.4497(4) 0.3983(3) 0.40555(15) 0.138(4) Uani 1 1 d DG U . . .
C8_1 C 0.4778(5) 0.4223(5) 0.38660(14) 0.159(5) Uani 1 1 d DG U . . .
H8_1 H 0.4799 0.3969 0.3766 0.191 Uiso 1 1 calc R U . . .
C9_1 C 0.5030(5) 0.4843(5) 0.38263(12) 0.165(6) Uani 1 1 d DG U . . .
H9_1 H 0.5218 0.5003 0.3700 0.198 Uiso 1 1 calc R U . . .
C10_1 C 0.5000(5) 0.5222(4) 0.39761(15) 0.150(5) Uani 1 1 d DG U . . .
H10_1 H 0.5168 0.5637 0.3950 0.180 Uiso 1 1 calc R U . . .
C11_1 C 0.4718(4) 0.4982(4) 0.41656(13) 0.116(3) Uani 1 1 d DG U . . .
C12_1 C 0.4627(6) 0.5299(6) 0.4339(2) 0.103(3) Uani 1 1 d D U . . .
O13_1 O 0.4321(4) 0.5009(4) 0.44855(14) 0.117(2) Uani 1 1 d D U . . .
N14_1 N 0.4894(5) 0.5894(5) 0.43311(18) 0.125(3) Uani 1 1 d D U . . .
H14_1 H 0.5143 0.6076 0.4230 0.150 Uiso 1 1 calc R U . . .
C15_1 C 0.4803(4) 0.6276(4) 0.44807(14) 0.119(4) Uani 1 1 d DG U . . .
C16_1 C 0.4212(4) 0.6114(4) 0.45379(18) 0.147(5) Uani 1 1 d DG U . . .
H16_1 H 0.3883 0.5755 0.4488 0.177 Uiso 1 1 calc R U . . .
C17_1 C 0.4111(3) 0.6489(5) 0.46702(19) 0.161(5) Uani 1 1 d DG U . . .
H17_1 H 0.3715 0.6381 0.4708 0.194 Uiso 1 1 calc R U . . .
C18_1 C 0.4602(5) 0.7025(5) 0.47452(16) 0.149(5) Uani 1 1 d DG U . . .
H18_1 H 0.4534 0.7276 0.4834 0.179 Uiso 1 1 calc R U . . .
C19_1 C 0.5193(4) 0.7187(4) 0.46880(15) 0.124(4) Uani 1 1 d DG U . . .
C20_1 C 0.5294(3) 0.6812(4) 0.45558(14) 0.108(3) Uani 1 1 d DG U . . .
C21_1 C 0.5895(6) 0.6968(6) 0.4507(2) 0.121(4) Uani 1 1 d D U . . .
H21_1 H 0.5972 0.6719 0.4421 0.145 Uiso 1 1 calc R U . . .
C22_1 C 0.6375(7) 0.7501(7) 0.4590(2) 0.135(4) Uani 1 1 d D U . . .
H22_1 H 0.6775 0.7602 0.4561 0.162 Uiso 1 1 calc R U . . .
C23_1 C 0.6260(7) 0.7888(7) 0.4716(2) 0.140(4) Uani 1 1 d D U . . .
H23_1 H 0.6581 0.8250 0.4768 0.168 Uiso 1 1 calc R U . . .
C24_1 C 0.5672(7) 0.7724(6) 0.4761(2) 0.123(4) Uani 1 1 d D U . . .
N25_1 N 0.5579(6) 0.8137(6) 0.48890(18) 0.145(4) Uani 1 1 d D U . . .
H25_1 H 0.5462 0.8033 0.5015 0.174 Uiso 1 1 calc R U . . .
C26_1 C 0.5665(7) 0.8664(7) 0.4822(2) 0.127(4) Uani 1 1 d D U . . .
O27_1 O 0.5817(4) 0.8815(4) 0.46378(14) 0.125(3) Uani 1 1 d D U . . .
N28_1 N 0.5773(5) 0.9618(5) 0.48695(17) 0.123(3) Uani 1 1 d D U . . .
C29_1 C 0.5597(8) 0.9081(7) 0.4961(2) 0.138(4) Uani 1 1 d D U . . .
C30_1 C 0.5442(10) 0.9005(9) 0.5172(2) 0.179(6) Uani 1 1 d D U . . .
H30_1 H 0.5362 0.8654 0.5244 0.214 Uiso 1 1 calc R U . . .
C31_1 C 0.5415(11) 0.9483(9) 0.5268(3) 0.182(6) Uani 1 1 d D U . . .
H31_1 H 0.5260 0.9421 0.5403 0.219 Uiso 1 1 calc R U . . .
C32_1 C 0.5595(9) 1.0020(8) 0.5181(2) 0.160(5) Uani 1 1 d D U . . .
H32_1 H 0.5611 1.0345 0.5254 0.192 Uiso 1 1 calc R U . . .
C33_1 C 0.5756(7) 1.0068(7) 0.4978(2) 0.137(4) Uani 1 1 d D U . . .
C34_1 C 0.5962(8) 1.0612(7) 0.4864(3) 0.146(4) Uani 1 1 d D U . . .
N35_1 N 0.6122(6) 1.0670(6) 0.4668(2) 0.152(4) Uani 1 1 d D U . . .
C36_1 C 0.6273(10) 1.1292(7) 0.4614(3) 0.199(7) Uani 1 1 d D U . . .
H36A_1 H 0.6003 1.1282 0.4505 0.239 Uiso 1 1 calc R U . . .
H36B_1 H 0.6690 1.1520 0.4563 0.239 Uiso 1 1 calc R U . . .
C37_1 C 0.6203(11) 1.1582(8) 0.4801(3) 0.204(8) Uani 1 1 d D U . . .
H37A_1 H 0.5923 1.1731 0.4777 0.245 Uiso 1 1 calc R U . . .
H37B_1 H 0.6593 1.1918 0.4846 0.245 Uiso 1 1 calc R U . . .
O38_1 O 0.5955(6) 1.1081(6) 0.49563(19) 0.186(4) Uani 1 1 d D U . . .
C1_2 C 0.3258(9) 0.2636(8) 0.4877(3) 0.207(8) Uani 1 1 d D U . . .
H1A_2 H 0.3456 0.2929 0.4988 0.248 Uiso 1 1 calc R U . . .
H1B_2 H 0.3524 0.2487 0.4830 0.248 Uiso 1 1 calc R U . . .
C2_2 C 0.2623(11) 0.2101(10) 0.4947(3) 0.251(11) Uani 1 1 d D U . . .
H2A_2 H 0.2637 0.1727 0.4964 0.301 Uiso 1 1 calc R U . . .
H2B_2 H 0.2495 0.2197 0.5076 0.301 Uiso 1 1 calc R U . . .
O3_2 O 0.2217(7) 0.2042(6) 0.4779(2) 0.216(6) Uani 1 1 d D U . . .
C4_2 C 0.2544(9) 0.2563(8) 0.4664(3) 0.180(7) Uani 1 1 d D U . . .
N5_2 N 0.3086(7) 0.2901(6) 0.4705(2) 0.156(4) Uani 1 1 d D U . . .
N6_2 N 0.2566(5) 0.3145(5) 0.43826(17) 0.136(3) Uani 1 1 d D U . . .
C7_2 C 0.2216(7) 0.2622(7) 0.4486(2) 0.164(6) Uani 1 1 d D U . . .
C8_2 C 0.1599(7) 0.2235(8) 0.4438(3) 0.178(7) Uani 1 1 d D U . . .
H8_2 H 0.1356 0.1889 0.4517 0.213 Uiso 1 1 calc R U . . .
C9_2 C 0.1372(7) 0.2388(8) 0.4272(3) 0.176(7) Uani 1 1 d D U . . .
H9_2 H 0.0973 0.2122 0.4230 0.211 Uiso 1 1 calc R U . . .
C10_2 C 0.1716(6) 0.2929(7) 0.4164(3) 0.158(5) Uani 1 1 d D U . . .
H10_2 H 0.1549 0.3036 0.4055 0.190 Uiso 1 1 calc R U . . .
C11_2 C 0.2316(6) 0.3303(6) 0.4225(2) 0.131(4) Uani 1 1 d D U . . .
C12_2 C 0.2763(6) 0.3886(7) 0.4132(2) 0.134(4) Uani 1 1 d D U . . .
O13_2 O 0.3285(4) 0.4158(4) 0.41971(14) 0.133(3) Uani 1 1 d D U . . .
N14_2 N 0.2563(5) 0.4140(5) 0.3999(2) 0.150(4) Uani 1 1 d D U . . .
H14_2 H 0.2208 0.3931 0.3944 0.180 Uiso 1 1 calc R U . . .
C15_2 C 0.2967(7) 0.4801(6) 0.3944(2) 0.145(4) Uani 1 1 d D U . . .
C16_2 C 0.2969(9) 0.5242(8) 0.4057(3) 0.179(6) Uani 1 1 d D U . . .
H16_2 H 0.2687 0.5155 0.4163 0.215 Uiso 1 1 calc R U . . .
C17_2 C 0.3415(9) 0.5847(8) 0.4009(3) 0.179(6) Uani 1 1 d D U . . .
H17_2 H 0.3447 0.6161 0.4092 0.215 Uiso 1 1 calc R U . . .
C18_2 C 0.3799(8) 0.5986(7) 0.3847(3) 0.164(5) Uani 1 1 d D U . . .
H18_2 H 0.4083 0.6392 0.3819 0.197 Uiso 1 1 calc R U . . .
C19_2 C 0.3771(7) 0.5514(6) 0.3719(2) 0.134(4) Uani 1 1 d D U . . .
C20_2 C 0.3370(6) 0.4918(6) 0.3778(2) 0.124(4) Uani 1 1 d D U . . .
C21_2 C 0.3337(9) 0.4433(8) 0.3659(3) 0.164(5) Uani 1 1 d D U . . .
H21_2 H 0.3063 0.4028 0.3693 0.197 Uiso 1 1 calc R U . . .
C22_2 C 0.3739(10) 0.4587(8) 0.3488(3) 0.191(7) Uani 1 1 d D U . . .
H22_2 H 0.3722 0.4277 0.3405 0.229 Uiso 1 1 calc R U . . .
C23_2 C 0.4167(9) 0.5204(8) 0.3439(3) 0.175(6) Uani 1 1 d D U . . .
H23_2 H 0.4444 0.5298 0.3330 0.211 Uiso 1 1 calc R U . . .
C24_2 C 0.4164(7) 0.5657(7) 0.3554(3) 0.145(4) Uani 1 1 d D U . . .
N25_2 N 0.4551(6) 0.6282(6) 0.3497(2) 0.152(4) Uani 1 1 d D U . . .
H25_2 H 0.4917 0.6480 0.3545 0.183 Uiso 1 1 calc R U . . .
C26_2 C 0.4351(6) 0.6559(6) 0.3373(2) 0.122(4) Uani 1 1 d D U . . .
O27_2 O 0.3798(4) 0.6322(4) 0.33336(14) 0.117(2) Uani 1 1 d D U . . .
N28_2 N 0.4500(5) 0.7260(5) 0.31129(17) 0.116(3) Uani 1 1 d D U . . .
C29_2 C 0.4775(6) 0.7140(6) 0.3267(2) 0.121(4) Uani 1 1 d D U . . .
C30_2 C 0.5394(6) 0.7526(6) 0.3313(3) 0.139(5) Uani 1 1 d D U . . .
H30_2 H 0.5591 0.7455 0.3422 0.167 Uiso 1 1 calc R U . . .
C31_2 C 0.5682(7) 0.8016(8) 0.3182(3) 0.176(6) Uani 1 1 d D U . . .
H31_2 H 0.6094 0.8286 0.3206 0.211 Uiso 1 1 calc R U . . .
C32_2 C 0.5421(7) 0.8134(7) 0.3027(3) 0.169(6) Uani 1 1 d D U . . .
H32_2 H 0.5646 0.8469 0.2941 0.203 Uiso 1 1 calc R U . . .
C33_2 C 0.4826(6) 0.7764(6) 0.2996(2) 0.133(4) Uani 1 1 d D U . . .
C34_2 C 0.4476(8) 0.7850(8) 0.2842(3) 0.155(5) Uani 1 1 d D U . . .
N35_2 N 0.3876(6) 0.7508(6) 0.2826(2) 0.149(4) Uani 1 1 d D U . . .
C36_2 C 0.3705(8) 0.7796(10) 0.2657(3) 0.196(7) Uani 1 1 d D U . . .
H36A_2 H 0.3523 0.7516 0.2542 0.235 Uiso 1 1 calc R U . . .
H36B_2 H 0.3415 0.7911 0.2708 0.235 Uiso 1 1 calc R U . . .
C37_2 C 0.4275(9) 0.8342(10) 0.2591(4) 0.222(9) Uani 1 1 d D U . . .
H37A_2 H 0.4270 0.8712 0.2627 0.266 Uiso 1 1 calc R U . . .
H37B_2 H 0.4335 0.8335 0.2443 0.266 Uiso 1 1 calc R U . . .
O38_2 O 0.4760(6) 0.8303(6) 0.2708(2) 0.198(5) Uani 1 1 d D U . . .
S1_3 S 0.59929(19) 0.7020(2) 0.38506(6) 0.1361(13) Uani 1 1 d D U . . .
O1_3 O 0.5690(7) 0.6601(7) 0.3684(2) 0.215(5) Uani 1 1 d D U . . .
O2_3 O 0.6274(6) 0.7662(5) 0.3812(2) 0.191(5) Uani 1 1 d D U . . .
O3_3 O 0.5625(6) 0.6811(6) 0.40281(19) 0.196(5) Uani 1 1 d D U . . .
C1_3 C 0.6575(7) 0.6935(7) 0.3905(3) 0.205(6) Uani 1 1 d D U . . .
F1_3 F 0.6962(6) 0.7015(6) 0.3748(3) 0.278(7) Uani 1 1 d D U . . .
F2_3 F 0.6443(6) 0.6401(6) 0.3978(4) 0.320(9) Uani 1 1 d D U . . .
F3_3 F 0.6950(7) 0.7324(7) 0.4053(3) 0.296(7) Uani 1 1 d D U . . .
S1_4 S 0.4992(9) 0.8478(7) 0.5781(2) 0.322(7) Uani 0.690(8) 1 d D U P . .
O1_4 O 0.4912(17) 0.8986(12) 0.5752(4) 0.337(15) Uani 0.690(8) 1 d D U P . .
O2_4 O 0.5528(15) 0.8574(19) 0.5893(7) 0.46(2) Uani 0.690(8) 1 d D U P . .
O3_4 O 0.4868(19) 0.8146(14) 0.5594(4) 0.392(18) Uani 0.690(8) 1 d D U P . .
C1_4 C 0.4444(13) 0.8025(12) 0.5936(4) 0.394(17) Uani 0.690(8) 1 d D U P . .
F1_4 F 0.4444(18) 0.7507(10) 0.5972(5) 0.424(18) Uani 0.690(8) 1 d D U P . .
F2_4 F 0.3894(10) 0.785(2) 0.5857(7) 0.51(2) Uani 0.690(8) 1 d D U P . .
F3_4 F 0.449(2) 0.8304(16) 0.6119(4) 0.436(18) Uani 0.690(8) 1 d D U P . .
S1_5 S 0.4352(9) 0.4441(8) 0.1969(3) 0.420(9) Uiso 0.977(8) 1 d D U P . .
O1_5 O 0.4119(12) 0.4576(12) 0.1793(4) 0.353(13) Uiso 0.977(8) 1 d D U P . .
O2_5 O 0.4969(10) 0.4595(13) 0.2003(5) 0.357(13) Uiso 0.977(8) 1 d D U P . .
O3_5 O 0.3926(17) 0.3821(12) 0.2040(7) 0.56(3) Uiso 0.977(8) 1 d D U P . .
C1_5 C 0.4196(10) 0.4753(11) 0.2165(4) 0.50(3) Uiso 0.977(8) 1 d D U P . .
F1_5 F 0.4240(12) 0.4508(12) 0.2342(3) 0.389(13) Uiso 0.977(8) 1 d D U P . .
F2_5 F 0.3597(9) 0.4554(10) 0.2166(3) 0.344(10) Uiso 0.977(8) 1 d D U P . .
F3_5 F 0.4574(13) 0.5350(9) 0.2153(5) 0.459(17) Uiso 0.977(8) 1 d D U P . .
S1_6 S 0.2492(5) 0.2414(5) 0.37598(17) 0.272(4) Uiso 1 1 d D U . . .
O1_6 O 0.2287(11) 0.2825(9) 0.3719(4) 0.312(10) Uiso 1 1 d D U . . .
O2_6 O 0.2708(14) 0.2351(15) 0.3956(3) 0.429(18) Uiso 1 1 d D U . . .
O3_6 O 0.2063(11) 0.1806(9) 0.3679(4) 0.359(13) Uiso 1 1 d D U . . .
C1_6 C 0.3022(10) 0.2532(9) 0.3593(3) 0.323(16) Uiso 1 1 d D U . . .
F1_6 F 0.3504(8) 0.3085(10) 0.3610(4) 0.389(13) Uiso 1 1 d D U . . .
F2_6 F 0.2812(11) 0.2466(12) 0.3400(3) 0.377(12) Uiso 1 1 d D U . . .
F3_6 F 0.3207(11) 0.2120(11) 0.3620(4) 0.414(14) Uiso 1 1 d D U . . .
S1_7 S 0.6667 1.3333 0.4800(5) 0.367(11) Uiso 1 3 d DS U P . .
O1_7 O 0.6818(16) 1.3968(9) 0.4820(6) 0.394(16) Uiso 1 1 d D U . . .
C1_7 C 0.6667 1.3333 0.4545(6) 0.49(3) Uiso 1 3 d DS U P . .
F1_7 F 0.6667(18) 1.2874(12) 0.4462(5) 0.450(17) Uiso 1 1 d D U . . .
O1_8 O 0.5117(11) 0.7658(12) 0.5282(4) 0.328(11) Uiso 1 1 d . . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

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 O27_1 2.368(9) 3_565 ?
Eu1 O13_2 2.380(9) . ?
Eu1 O13_1 2.473(9) . ?
Eu1 N5_1 2.496(13) . ?
Eu1 N35_1 2.510(12) 3_565 ?
Eu1 N6_1 2.547(7) . ?
Eu1 N28_1 2.551(11) 3_565 ?
Eu1 N6_2 2.557(11) . ?
Eu1 N5_2 2.569(12) . ?
Eu1 C12_2 3.252(14) . ?
Eu1 C26_1 3.261(15) 3_565 ?
Eu2 O27_2 2.391(8) 3_565 ?
Eu2 O27_2 2.391(8) 2_665 ?
Eu2 O27_2 2.391(8) . ?
Eu2 N35_2 2.507(12) 2_665 ?
Eu2 N35_2 2.507(12) 3_565 ?
Eu2 N35_2 2.507(12) . ?
Eu2 N28_2 2.563(11) 2_665 ?
Eu2 N28_2 2.563(11) 3_565 ?
Eu2 N28_2 2.563(11) . ?
C1_1 N5_1 1.496(16) . ?
C1_1 C2_1 1.55(2) . ?
C1_1 H1A_1 0.9700 . ?
C1_1 H1B_1 0.9700 . ?
C2_1 O3_1 1.428(19) . ?
C2_1 H2A_1 0.9700 . ?
C2_1 H2B_1 0.9700 . ?
O3_1 C4_1 1.383(17) . ?
C4_1 N5_1 1.215(17) . ?
C4_1 C7_1 1.451(16) . ?
N6_1 C7_1 1.3900 . ?
N6_1 C11_1 1.3900 . ?
C7_1 C8_1 1.3900 . ?
C8_1 C9_1 1.3900 . ?
C8_1 H8_1 0.9300 . ?
C9_1 C10_1 1.3900 . ?
C9_1 H9_1 0.9300 . ?
C10_1 C11_1 1.3900 . ?
C10_1 H10_1 0.9300 . ?
C11_1 C12_1 1.456(13) . ?
C12_1 O13_1 1.210(12) . ?
C12_1 N14_1 1.309(13) . ?
N14_1 C15_1 1.460(11) . ?
N14_1 H14_1 0.8600 . ?
C15_1 C16_1 1.3900 . ?
C15_1 C20_1 1.3900 . ?
C16_1 C17_1 1.3900 . ?
C16_1 H16_1 0.9300 . ?
C17_1 C18_1 1.3900 . ?
C17_1 H17_1 0.9300 . ?
C18_1 C19_1 1.3900 . ?
C18_1 H18_1 0.9300 . ?
C19_1 C24_1 1.374(14) . ?
C19_1 C20_1 1.3900 . ?
C20_1 C21_1 1.402(13) . ?
C21_1 C22_1 1.390(16) . ?
C21_1 H21_1 0.9300 . ?
C22_1 C23_1 1.411(16) . ?
C22_1 H22_1 0.9300 . ?
C23_1 C24_1 1.361(17) . ?
C23_1 H23_1 0.9300 . ?
C24_1 N25_1 1.440(15) . ?
N25_1 C26_1 1.311(15) . ?
N25_1 H25_1 0.8600 . ?
C26_1 O27_1 1.248(14) . ?
C26_1 C29_1 1.457(16) . ?
C26_1 Eu1 3.261(15) 2_665 ?
O27_1 Eu1 2.368(9) 2_665 ?
N28_1 C29_1 1.339(15) . ?
N28_1 C33_1 1.354(15) . ?
N28_1 Eu1 2.551(11) 2_665 ?
C29_1 C30_1 1.400(17) . ?
C30_1 C31_1 1.390(18) . ?
C30_1 H30_1 0.9300 . ?
C31_1 C32_1 1.326(19) . ?
C31_1 H31_1 0.9300 . ?
C32_1 C33_1 1.353(18) . ?
C32_1 H32_1 0.9300 . ?
C33_1 C34_1 1.408(19) . ?
C34_1 N35_1 1.314(17) . ?
C34_1 O38_1 1.334(16) . ?
N35_1 C36_1 1.464(18) . ?
N35_1 Eu1 2.510(12) 2_665 ?
C36_1 C37_1 1.47(2) . ?
C36_1 H36A_1 0.9700 . ?
C36_1 H36B_1 0.9700 . ?
C37_1 O38_1 1.483(19) . ?
C37_1 H37A_1 0.9700 . ?
C37_1 H37B_1 0.9700 . ?
C1_2 N5_2 1.469(17) . ?
C1_2 C2_2 1.56(2) . ?
C1_2 H1A_2 0.9700 . ?
C1_2 H1B_2 0.9700 . ?
C2_2 O3_2 1.447(19) . ?
C2_2 H2A_2 0.9700 . ?
C2_2 H2B_2 0.9700 . ?
O3_2 C4_2 1.371(17) . ?
C4_2 N5_2 1.229(17) . ?
C4_2 C7_2 1.466(18) . ?
N6_2 C7_2 1.343(13) . ?
N6_2 C11_2 1.360(13) . ?
C7_2 C8_2 1.400(15) . ?
C8_2 C9_2 1.358(16) . ?
C8_2 H8_2 0.9300 . ?
C9_2 C10_2 1.387(15) . ?
C9_2 H9_2 0.9300 . ?
C10_2 C11_2 1.382(14) . ?
C10_2 H10_2 0.9300 . ?
C11_2 C12_2 1.465(16) . ?
C12_2 O13_2 1.217(13) . ?
C12_2 N14_2 1.315(14) . ?
N14_2 C15_2 1.503(15) . ?
N14_2 H14_2 0.8600 . ?
C15_2 C16_2 1.329(15) . ?
C15_2 C20_2 1.406(14) . ?
C16_2 C17_2 1.408(16) . ?
C16_2 H16_2 0.9300 . ?
C17_2 C18_2 1.344(15) . ?
C17_2 H17_2 0.9300 . ?
C18_2 C19_2 1.426(15) . ?
C18_2 H18_2 0.9300 . ?
C19_2 C24_2 1.374(17) . ?
C19_2 C20_2 1.383(14) . ?
C20_2 C21_2 1.411(16) . ?
C21_2 C22_2 1.418(18) . ?
C21_2 H21_2 0.9300 . ?
C22_2 C23_2 1.422(19) . ?
C22_2 H22_2 0.9300 . ?
C23_2 C24_2 1.367(18) . ?
C23_2 H23_2 0.9300 . ?
C24_2 N25_2 1.429(16) . ?
N25_2 C26_2 1.321(14) . ?
N25_2 H25_2 0.8600 . ?
C26_2 O27_2 1.241(13) . ?
C26_2 C29_2 1.484(16) . ?
N28_2 C29_2 1.330(14) . ?
N28_2 C33_2 1.350(14) . ?
C29_2 C30_2 1.402(17) . ?
C30_2 C31_2 1.367(18) . ?
C30_2 H30_2 0.9300 . ?
C31_2 C32_2 1.315(19) . ?
C31_2 H31_2 0.9300 . ?
C32_2 C33_2 1.332(18) . ?
C32_2 H32_2 0.9300 . ?
C33_2 C34_2 1.416(18) . ?
C34_2 N35_2 1.323(17) . ?
C34_2 O38_2 1.323(16) . ?
N35_2 C36_2 1.487(17) . ?
C36_2 C37_2 1.47(2) . ?
C36_2 H36A_2 0.9700 . ?
C36_2 H36B_2 0.9700 . ?
C37_2 O38_2 1.482(19) . ?
C37_2 H37A_2 0.9700 . ?
C37_2 H37B_2 0.9700 . ?
S1_3 O3_3 1.400(10) . ?
S1_3 O2_3 1.432(10) . ?
S1_3 O1_3 1.433(10) . ?
S1_3 C1_3 1.630(16) . ?
C1_3 F2_3 1.306(14) . ?
C1_3 F1_3 1.355(14) . ?
C1_3 F3_3 1.355(14) . ?
S1_4 O1_4 1.410(14) . ?
S1_4 O3_4 1.412(15) . ?
S1_4 O2_4 1.444(15) . ?
S1_4 C1_4 1.63(2) . ?
C1_4 F1_4 1.330(17) . ?
C1_4 F2_4 1.330(17) . ?
C1_4 F3_4 1.347(16) . ?
S1_5 O1_5 1.395(14) . ?
S1_5 O2_5 1.424(14) . ?
S1_5 O3_5 1.464(15) . ?
S1_5 C1_5 1.64(2) . ?
C1_5 F1_5 1.327(16) . ?
C1_5 F3_5 1.328(16) . ?
C1_5 F2_5 1.337(16) . ?
S1_6 O1_6 1.400(13) . ?
S1_6 O2_6 1.420(15) . ?
S1_6 O3_6 1.466(14) . ?
S1_6 C1_6 1.63(2) . ?
C1_6 F1_6 1.323(16) . ?
C1_6 F2_6 1.328(16) . ?
C1_6 F3_6 1.350(16) . ?
S1_7 O1_7 1.457(18) . ?
S1_7 O1_7 1.457(18) 3_575 ?
S1_7 O1_7 1.457(18) 2_775 ?
S1_7 C1_7 1.64(2) . ?
C1_7 F1_7 1.281(18) . ?
C1_7 F1_7 1.281(18) 2_775 ?
C1_7 F1_7 1.281(18) 3_575 ?

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
O27_1 Eu1 O13_2 76.4(3) 3_565 . ?
O27_1 Eu1 O13_1 79.2(3) 3_565 . ?
O13_2 Eu1 O13_1 77.9(3) . . ?
O27_1 Eu1 N5_1 149.7(4) 3_565 . ?
O13_2 Eu1 N5_1 90.5(4) . . ?
O13_1 Eu1 N5_1 125.1(4) . . ?
O27_1 Eu1 N35_1 126.8(4) 3_565 3_565 ?
O13_2 Eu1 N35_1 148.7(4) . 3_565 ?
O13_1 Eu1 N35_1 86.0(4) . 3_565 ?
N5_1 Eu1 N35_1 77.1(4) . 3_565 ?
O27_1 Eu1 N6_1 131.5(3) 3_565 . ?
O13_2 Eu1 N6_1 68.3(3) . . ?
O13_1 Eu1 N6_1 61.9(3) . . ?
N5_1 Eu1 N6_1 63.9(4) . . ?
N35_1 Eu1 N6_1 80.5(4) 3_565 . ?
O27_1 Eu1 N28_1 62.8(3) 3_565 3_565 ?
O13_2 Eu1 N28_1 133.6(4) . 3_565 ?
O13_1 Eu1 N28_1 73.8(3) . 3_565 ?
N5_1 Eu1 N28_1 135.9(4) . 3_565 ?
N35_1 Eu1 N28_1 64.0(4) 3_565 3_565 ?
N6_1 Eu1 N28_1 124.5(3) . 3_565 ?
O27_1 Eu1 N6_2 69.6(4) 3_565 . ?
O13_2 Eu1 N6_2 62.8(3) . . ?
O13_1 Eu1 N6_2 134.1(3) . . ?
N5_1 Eu1 N6_2 80.1(5) . . ?
N35_1 Eu1 N6_2 139.8(4) 3_565 . ?
N6_1 Eu1 N6_2 117.8(3) . . ?
N28_1 Eu1 N6_2 116.9(4) 3_565 . ?
O27_1 Eu1 N5_2 86.5(4) 3_565 . ?
O13_2 Eu1 N5_2 126.1(4) . . ?
O13_1 Eu1 N5_2 148.3(4) . . ?
N5_1 Eu1 N5_2 79.3(5) . . ?
N35_1 Eu1 N5_2 80.2(5) 3_565 . ?
N6_1 Eu1 N5_2 141.4(4) . . ?
N28_1 Eu1 N5_2 74.6(4) 3_565 . ?
N6_2 Eu1 N5_2 63.3(4) . . ?
O27_1 Eu1 C12_2 70.6(4) 3_565 . ?
O13_2 Eu1 C12_2 17.6(3) . . ?
O13_1 Eu1 C12_2 93.2(3) . . ?
N5_1 Eu1 C12_2 88.7(4) . . ?
N35_1 Eu1 C12_2 161.8(4) 3_565 . ?
N6_1 Eu1 C12_2 83.1(3) . . ?
N28_1 Eu1 C12_2 133.1(4) 3_565 . ?
N6_2 Eu1 C12_2 45.4(3) . . ?
N5_2 Eu1 C12_2 108.7(4) . . ?
O27_1 Eu1 C26_1 18.1(3) 3_565 3_565 ?
O13_2 Eu1 C26_1 93.5(3) . 3_565 ?
O13_1 Eu1 C26_1 76.9(3) . 3_565 ?
N5_1 Eu1 C26_1 158.0(4) . 3_565 ?
N35_1 Eu1 C26_1 108.8(4) 3_565 3_565 ?
N6_1 Eu1 C26_1 137.3(3) . 3_565 ?
N28_1 Eu1 C26_1 44.8(3) 3_565 3_565 ?
N6_2 Eu1 C26_1 82.5(4) . 3_565 ?
N5_2 Eu1 C26_1 80.9(4) . 3_565 ?
C12_2 Eu1 C26_1 88.6(4) . 3_565 ?
O27_2 Eu2 O27_2 80.3(3) 3_565 2_665 ?
O27_2 Eu2 O27_2 80.3(3) 3_565 . ?
O27_2 Eu2 O27_2 80.3(3) 2_665 . ?
O27_2 Eu2 N35_2 84.7(4) 3_565 2_665 ?
O27_2 Eu2 N35_2 126.5(4) 2_665 2_665 ?
O27_2 Eu2 N35_2 146.4(4) . 2_665 ?
O27_2 Eu2 N35_2 126.5(4) 3_565 3_565 ?
O27_2 Eu2 N35_2 146.4(4) 2_665 3_565 ?
O27_2 Eu2 N35_2 84.7(4) . 3_565 ?
N35_2 Eu2 N35_2 80.5(5) 2_665 3_565 ?
O27_2 Eu2 N35_2 146.4(4) 3_565 . ?
O27_2 Eu2 N35_2 84.7(4) 2_665 . ?
O27_2 Eu2 N35_2 126.5(4) . . ?
N35_2 Eu2 N35_2 80.5(5) 2_665 . ?
N35_2 Eu2 N35_2 80.5(5) 3_565 . ?
O27_2 Eu2 N28_2 68.4(3) 3_565 2_665 ?
O27_2 Eu2 N28_2 62.3(3) 2_665 2_665 ?
O27_2 Eu2 N28_2 134.0(3) . 2_665 ?
N35_2 Eu2 N28_2 64.3(4) 2_665 2_665 ?
N35_2 Eu2 N28_2 141.1(4) 3_565 2_665 ?
N35_2 Eu2 N28_2 78.0(4) . 2_665 ?
O27_2 Eu2 N28_2 62.3(3) 3_565 3_565 ?
O27_2 Eu2 N28_2 134.0(3) 2_665 3_565 ?
O27_2 Eu2 N28_2 68.4(3) . 3_565 ?
N35_2 Eu2 N28_2 78.0(4) 2_665 3_565 ?
N35_2 Eu2 N28_2 64.3(4) 3_565 3_565 ?
N35_2 Eu2 N28_2 141.1(4) . 3_565 ?
N28_2 Eu2 N28_2 119.54(6) 2_665 3_565 ?
O27_2 Eu2 N28_2 134.0(3) 3_565 . ?
O27_2 Eu2 N28_2 68.4(3) 2_665 . ?
O27_2 Eu2 N28_2 62.3(3) . . ?
N35_2 Eu2 N28_2 141.1(4) 2_665 . ?
N35_2 Eu2 N28_2 78.0(4) 3_565 . ?
N35_2 Eu2 N28_2 64.3(4) . . ?
N28_2 Eu2 N28_2 119.54(6) 2_665 . ?
N28_2 Eu2 N28_2 119.54(6) 3_565 . ?
N5_1 C1_1 C2_1 101.7(14) . . ?
N5_1 C1_1 H1A_1 111.4 . . ?
C2_1 C1_1 H1A_1 111.4 . . ?
N5_1 C1_1 H1B_1 111.4 . . ?
C2_1 C1_1 H1B_1 111.4 . . ?
H1A_1 C1_1 H1B_1 109.3 . . ?
O3_1 C2_1 C1_1 107.0(13) . . ?
O3_1 C2_1 H2A_1 110.3 . . ?
C1_1 C2_1 H2A_1 110.3 . . ?
O3_1 C2_1 H2B_1 110.3 . . ?
C1_1 C2_1 H2B_1 110.3 . . ?
H2A_1 C2_1 H2B_1 108.6 . . ?
C4_1 O3_1 C2_1 102.5(14) . . ?
N5_1 C4_1 O3_1 121.9(15) . . ?
N5_1 C4_1 C7_1 125.6(14) . . ?
O3_1 C4_1 C7_1 112.4(14) . . ?
C4_1 N5_1 C1_1 106.8(14) . . ?
C4_1 N5_1 Eu1 119.5(10) . . ?
C1_1 N5_1 Eu1 133.6(11) . . ?
C7_1 N6_1 C11_1 120.0 . . ?
C7_1 N6_1 Eu1 118.6(5) . . ?
C11_1 N6_1 Eu1 118.3(5) . . ?
N6_1 C7_1 C8_1 120.0 . . ?
N6_1 C7_1 C4_1 110.5(9) . . ?
C8_1 C7_1 C4_1 129.3(9) . . ?
C9_1 C8_1 C7_1 120.0 . . ?
C9_1 C8_1 H8_1 120.0 . . ?
C7_1 C8_1 H8_1 120.0 . . ?
C8_1 C9_1 C10_1 120.0 . . ?
C8_1 C9_1 H9_1 120.0 . . ?
C10_1 C9_1 H9_1 120.0 . . ?
C9_1 C10_1 C11_1 120.0 . . ?
C9_1 C10_1 H10_1 120.0 . . ?
C11_1 C10_1 H10_1 120.0 . . ?
C10_1 C11_1 N6_1 120.0 . . ?
C10_1 C11_1 C12_1 128.2(8) . . ?
N6_1 C11_1 C12_1 111.7(8) . . ?
O13_1 C12_1 N14_1 122.2(12) . . ?
O13_1 C12_1 C11_1 119.6(11) . . ?
N14_1 C12_1 C11_1 118.2(11) . . ?
C12_1 O13_1 Eu1 124.4(8) . . ?
C12_1 N14_1 C15_1 125.1(11) . . ?
C12_1 N14_1 H14_1 117.5 . . ?
C15_1 N14_1 H14_1 117.5 . . ?
C16_1 C15_1 C20_1 120.0 . . ?
C16_1 C15_1 N14_1 118.9(7) . . ?
C20_1 C15_1 N14_1 121.0(7) . . ?
C15_1 C16_1 C17_1 120.0 . . ?
C15_1 C16_1 H16_1 120.0 . . ?
C17_1 C16_1 H16_1 120.0 . . ?
C16_1 C17_1 C18_1 120.0 . . ?
C16_1 C17_1 H17_1 120.0 . . ?
C18_1 C17_1 H17_1 120.0 . . ?
C19_1 C18_1 C17_1 120.0 . . ?
C19_1 C18_1 H18_1 120.0 . . ?
C17_1 C18_1 H18_1 120.0 . . ?
C24_1 C19_1 C20_1 120.8(8) . . ?
C24_1 C19_1 C18_1 119.2(8) . . ?
C20_1 C19_1 C18_1 120.0 . . ?
C19_1 C20_1 C15_1 120.0 . . ?
C19_1 C20_1 C21_1 119.1(8) . . ?
C15_1 C20_1 C21_1 120.8(8) . . ?
C22_1 C21_1 C20_1 119.1(11) . . ?
C22_1 C21_1 H21_1 120.4 . . ?
C20_1 C21_1 H21_1 120.4 . . ?
C21_1 C22_1 C23_1 120.7(13) . . ?
C21_1 C22_1 H22_1 119.7 . . ?
C23_1 C22_1 H22_1 119.7 . . ?
C24_1 C23_1 C22_1 118.9(13) . . ?
C24_1 C23_1 H23_1 120.5 . . ?
C22_1 C23_1 H23_1 120.5 . . ?
C23_1 C24_1 C19_1 121.2(11) . . ?
C23_1 C24_1 N25_1 116.8(13) . . ?
C19_1 C24_1 N25_1 122.0(12) . . ?
C26_1 N25_1 C24_1 123.1(12) . . ?
C26_1 N25_1 H25_1 118.5 . . ?
C24_1 N25_1 H25_1 118.5 . . ?
O27_1 C26_1 N25_1 119.5(12) . . ?
O27_1 C26_1 C29_1 119.5(13) . . ?
N25_1 C26_1 C29_1 121.0(13) . . ?
O27_1 C26_1 Eu1 36.0(6) . 2_665 ?
N25_1 C26_1 Eu1 154.8(10) . 2_665 ?
C29_1 C26_1 Eu1 83.7(8) . 2_665 ?
C26_1 O27_1 Eu1 125.9(8) . 2_665 ?
C29_1 N28_1 C33_1 119.5(12) . . ?
C29_1 N28_1 Eu1 120.0(8) . 2_665 ?
C33_1 N28_1 Eu1 120.5(9) . 2_665 ?
N28_1 C29_1 C30_1 119.6(12) . . ?
N28_1 C29_1 C26_1 111.4(12) . . ?
C30_1 C29_1 C26_1 128.5(14) . . ?
C31_1 C30_1 C29_1 116.5(15) . . ?
C31_1 C30_1 H30_1 121.7 . . ?
C29_1 C30_1 H30_1 121.7 . . ?
C32_1 C31_1 C30_1 124.0(16) . . ?
C32_1 C31_1 H31_1 118.0 . . ?
C30_1 C31_1 H31_1 118.0 . . ?
C31_1 C32_1 C33_1 115.9(15) . . ?
C31_1 C32_1 H32_1 122.0 . . ?
C33_1 C32_1 H32_1 122.0 . . ?
C32_1 C33_1 N28_1 123.8(14) . . ?
C32_1 C33_1 C34_1 122.4(14) . . ?
N28_1 C33_1 C34_1 113.7(13) . . ?
N35_1 C34_1 O38_1 117.9(15) . . ?
N35_1 C34_1 C33_1 123.4(14) . . ?
O38_1 C34_1 C33_1 118.4(14) . . ?
C34_1 N35_1 C36_1 104.4(13) . . ?
C34_1 N35_1 Eu1 118.3(10) . 2_665 ?
C36_1 N35_1 Eu1 137.2(11) . 2_665 ?
N35_1 C36_1 C37_1 108.0(14) . . ?
N35_1 C36_1 H36A_1 110.1 . . ?
C37_1 C36_1 H36A_1 110.1 . . ?
N35_1 C36_1 H36B_1 110.1 . . ?
C37_1 C36_1 H36B_1 110.1 . . ?
H36A_1 C36_1 H36B_1 108.4 . . ?
C36_1 C37_1 O38_1 103.4(13) . . ?
C36_1 C37_1 H37A_1 111.1 . . ?
O38_1 C37_1 H37A_1 111.1 . . ?
C36_1 C37_1 H37B_1 111.1 . . ?
O38_1 C37_1 H37B_1 111.1 . . ?
H37A_1 C37_1 H37B_1 109.0 . . ?
C34_1 O38_1 C37_1 105.8(13) . . ?
N5_2 C1_2 C2_2 101.7(14) . . ?
N5_2 C1_2 H1A_2 111.4 . . ?
C2_2 C1_2 H1A_2 111.4 . . ?
N5_2 C1_2 H1B_2 111.4 . . ?
C2_2 C1_2 H1B_2 111.4 . . ?
H1A_2 C1_2 H1B_2 109.3 . . ?
O3_2 C2_2 C1_2 104.1(13) . . ?
O3_2 C2_2 H2A_2 110.9 . . ?
C1_2 C2_2 H2A_2 110.9 . . ?
O3_2 C2_2 H2B_2 110.9 . . ?
C1_2 C2_2 H2B_2 110.9 . . ?
H2A_2 C2_2 H2B_2 109.0 . . ?
C4_2 O3_2 C2_2 104.4(13) . . ?
N5_2 C4_2 O3_2 118.7(15) . . ?
N5_2 C4_2 C7_2 126.1(14) . . ?
O3_2 C4_2 C7_2 114.8(14) . . ?
C4_2 N5_2 C1_2 109.0(13) . . ?
C4_2 N5_2 Eu1 117.3(10) . . ?
C1_2 N5_2 Eu1 133.7(11) . . ?
C7_2 N6_2 C11_2 119.0(11) . . ?
C7_2 N6_2 Eu1 121.8(8) . . ?
C11_2 N6_2 Eu1 119.1(8) . . ?
N6_2 C7_2 C8_2 122.4(12) . . ?
N6_2 C7_2 C4_2 111.0(12) . . ?
C8_2 C7_2 C4_2 126.1(13) . . ?
C9_2 C8_2 C7_2 117.2(14) . . ?
C9_2 C8_2 H8_2 121.4 . . ?
C7_2 C8_2 H8_2 121.4 . . ?
C8_2 C9_2 C10_2 121.9(14) . . ?
C8_2 C9_2 H9_2 119.1 . . ?
C10_2 C9_2 H9_2 119.1 . . ?
C11_2 C10_2 C9_2 117.9(13) . . ?
C11_2 C10_2 H10_2 121.1 . . ?
C9_2 C10_2 H10_2 121.1 . . ?
N6_2 C11_2 C10_2 121.5(12) . . ?
N6_2 C11_2 C12_2 111.2(11) . . ?
C10_2 C11_2 C12_2 127.3(12) . . ?
O13_2 C12_2 N14_2 121.4(12) . . ?
O13_2 C12_2 C11_2 120.2(12) . . ?
N14_2 C12_2 C11_2 117.8(12) . . ?
O13_2 C12_2 Eu1 36.1(6) . . ?
N14_2 C12_2 Eu1 155.0(10) . . ?
C11_2 C12_2 Eu1 84.3(7) . . ?
C12_2 O13_2 Eu1 126.3(9) . . ?
C12_2 N14_2 C15_2 118.9(11) . . ?
C12_2 N14_2 H14_2 120.6 . . ?
C15_2 N14_2 H14_2 120.6 . . ?
C16_2 C15_2 C20_2 122.9(14) . . ?
C16_2 C15_2 N14_2 121.4(14) . . ?
C20_2 C15_2 N14_2 115.5(12) . . ?
C15_2 C16_2 C17_2 117.1(16) . . ?
C15_2 C16_2 H16_2 121.5 . . ?
C17_2 C16_2 H16_2 121.5 . . ?
C18_2 C17_2 C16_2 122.5(16) . . ?
C18_2 C17_2 H17_2 118.8 . . ?
C16_2 C17_2 H17_2 118.8 . . ?
C17_2 C18_2 C19_2 120.2(15) . . ?
C17_2 C18_2 H18_2 119.9 . . ?
C19_2 C18_2 H18_2 119.9 . . ?
C24_2 C19_2 C20_2 122.6(13) . . ?
C24_2 C19_2 C18_2 120.1(14) . . ?
C20_2 C19_2 C18_2 117.1(12) . . ?
C19_2 C20_2 C15_2 119.9(12) . . ?
C19_2 C20_2 C21_2 119.5(13) . . ?
C15_2 C20_2 C21_2 120.4(13) . . ?
C20_2 C21_2 C22_2 117.2(14) . . ?
C20_2 C21_2 H21_2 121.4 . . ?
C22_2 C21_2 H21_2 121.4 . . ?
C21_2 C22_2 C23_2 121.6(16) . . ?
C21_2 C22_2 H22_2 119.2 . . ?
C23_2 C22_2 H22_2 119.2 . . ?
C24_2 C23_2 C22_2 118.6(16) . . ?
C24_2 C23_2 H23_2 120.7 . . ?
C22_2 C23_2 H23_2 120.7 . . ?
C23_2 C24_2 C19_2 120.3(14) . . ?
C23_2 C24_2 N25_2 120.1(15) . . ?
C19_2 C24_2 N25_2 119.5(14) . . ?
C26_2 N25_2 C24_2 120.5(12) . . ?
C26_2 N25_2 H25_2 119.7 . . ?
C24_2 N25_2 H25_2 119.7 . . ?
O27_2 C26_2 N25_2 120.3(12) . . ?
O27_2 C26_2 C29_2 117.9(12) . . ?
N25_2 C26_2 C29_2 121.7(12) . . ?
C26_2 O27_2 Eu2 126.8(8) . . ?
C29_2 N28_2 C33_2 119.4(11) . . ?
C29_2 N28_2 Eu2 119.9(8) . . ?
C33_2 N28_2 Eu2 119.7(9) . . ?
N28_2 C29_2 C30_2 121.9(12) . . ?
N28_2 C29_2 C26_2 111.6(11) . . ?
C30_2 C29_2 C26_2 126.5(13) . . ?
C31_2 C30_2 C29_2 113.8(14) . . ?
C31_2 C30_2 H30_2 123.1 . . ?
C29_2 C30_2 H30_2 123.1 . . ?
C32_2 C31_2 C30_2 125.1(15) . . ?
C32_2 C31_2 H31_2 117.5 . . ?
C30_2 C31_2 H31_2 117.5 . . ?
C31_2 C32_2 C33_2 118.3(15) . . ?
C31_2 C32_2 H32_2 120.8 . . ?
C33_2 C32_2 H32_2 120.8 . . ?
C32_2 C33_2 N28_2 121.4(14) . . ?
C32_2 C33_2 C34_2 124.8(14) . . ?
N28_2 C33_2 C34_2 113.8(13) . . ?
N35_2 C34_2 O38_2 117.7(15) . . ?
N35_2 C34_2 C33_2 123.7(13) . . ?
O38_2 C34_2 C33_2 118.6(15) . . ?
C34_2 N35_2 C36_2 104.7(13) . . ?
C34_2 N35_2 Eu2 117.8(10) . . ?
C36_2 N35_2 Eu2 137.2(10) . . ?
C37_2 C36_2 N35_2 106.4(14) . . ?
C37_2 C36_2 H36A_2 110.4 . . ?
N35_2 C36_2 H36A_2 110.4 . . ?
C37_2 C36_2 H36B_2 110.4 . . ?
N35_2 C36_2 H36B_2 110.4 . . ?
H36A_2 C36_2 H36B_2 108.6 . . ?
C36_2 C37_2 O38_2 104.2(13) . . ?
C36_2 C37_2 H37A_2 110.9 . . ?
O38_2 C37_2 H37A_2 110.9 . . ?
C36_2 C37_2 H37B_2 110.9 . . ?
O38_2 C37_2 H37B_2 110.9 . . ?
H37A_2 C37_2 H37B_2 108.9 . . ?
C34_2 O38_2 C37_2 106.2(13) . . ?
O3_3 S1_3 O2_3 115.5(8) . . ?
O3_3 S1_3 O1_3 108.9(9) . . ?
O2_3 S1_3 O1_3 119.1(9) . . ?
O3_3 S1_3 C1_3 104.3(9) . . ?
O2_3 S1_3 C1_3 102.6(8) . . ?
O1_3 S1_3 C1_3 104.4(9) . . ?
F2_3 C1_3 F1_3 102.3(16) . . ?
F2_3 C1_3 F3_3 103.0(16) . . ?
F1_3 C1_3 F3_3 103.1(15) . . ?
F2_3 C1_3 S1_3 115.7(12) . . ?
F1_3 C1_3 S1_3 116.9(13) . . ?
F3_3 C1_3 S1_3 114.0(12) . . ?
O1_4 S1_4 O3_4 109.7(18) . . ?
O1_4 S1_4 O2_4 118(2) . . ?
O3_4 S1_4 O2_4 116(2) . . ?
O1_4 S1_4 C1_4 105.3(16) . . ?
O3_4 S1_4 C1_4 104.3(18) . . ?
O2_4 S1_4 C1_4 102.2(19) . . ?
F1_4 C1_4 F2_4 104(2) . . ?
F1_4 C1_4 F3_4 109(2) . . ?
F2_4 C1_4 F3_4 109(3) . . ?
F1_4 C1_4 S1_4 112.3(17) . . ?
F2_4 C1_4 S1_4 112.5(17) . . ?
F3_4 C1_4 S1_4 110.2(16) . . ?
O1_5 S1_5 O2_5 127(2) . . ?
O1_5 S1_5 O3_5 110(2) . . ?
O2_5 S1_5 O3_5 111(2) . . ?
O1_5 S1_5 C1_5 106.0(16) . . ?
O2_5 S1_5 C1_5 104.2(16) . . ?
O3_5 S1_5 C1_5 92.7(18) . . ?
F1_5 C1_5 F3_5 114(2) . . ?
F1_5 C1_5 F2_5 99.5(19) . . ?
F3_5 C1_5 F2_5 118(2) . . ?
F1_5 C1_5 S1_5 109.9(16) . . ?
F3_5 C1_5 S1_5 107.0(15) . . ?
F2_5 C1_5 S1_5 108.9(16) . . ?
O1_6 S1_6 O2_6 123.8(17) . . ?
O1_6 S1_6 O3_6 110.9(16) . . ?
O2_6 S1_6 O3_6 109.0(17) . . ?
O1_6 S1_6 C1_6 108.5(13) . . ?
O2_6 S1_6 C1_6 106.4(15) . . ?
O3_6 S1_6 C1_6 93.9(13) . . ?
F1_6 C1_6 F2_6 108(2) . . ?
F1_6 C1_6 F3_6 108(2) . . ?
F2_6 C1_6 F3_6 107(2) . . ?
F1_6 C1_6 S1_6 112.3(15) . . ?
F2_6 C1_6 S1_6 110.7(15) . . ?
F3_6 C1_6 S1_6 110.1(15) . . ?
O1_7 S1_7 O1_7 119.2(7) . 3_575 ?
O1_7 S1_7 O1_7 119.2(7) . 2_775 ?
O1_7 S1_7 O1_7 119.2(7) 3_575 2_775 ?
O1_7 S1_7 C1_7 95(2) . . ?
O1_7 S1_7 C1_7 95(2) 3_575 . ?
O1_7 S1_7 C1_7 95(2) 2_775 . ?
F1_7 C1_7 F1_7 104(3) . 2_775 ?
F1_7 C1_7 F1_7 104(3) . 3_575 ?
F1_7 C1_7 F1_7 104(3) 2_775 3_575 ?
F1_7 C1_7 S1_7 115(2) . . ?
F1_7 C1_7 S1_7 115(2) 2_775 . ?
F1_7 C1_7 S1_7 115(2) 3_575 . ?

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_1 C1_1 C2_1 O3_1 -2(2) . . . . ?
C1_1 C2_1 O3_1 C4_1 1(2) . . . . ?
C2_1 O3_1 C4_1 N5_1 0(2) . . . . ?
C2_1 O3_1 C4_1 C7_1 177.5(15) . . . . ?
O3_1 C4_1 N5_1 C1_1 -2(2) . . . . ?
C7_1 C4_1 N5_1 C1_1 -178.7(16) . . . . ?
O3_1 C4_1 N5_1 Eu1 177.8(11) . . . . ?
C7_1 C4_1 N5_1 Eu1 1(2) . . . . ?
C2_1 C1_1 N5_1 C4_1 2(2) . . . . ?
C2_1 C1_1 N5_1 Eu1 -177.2(13) . . . . ?
C11_1 N6_1 C7_1 C8_1 0.0 . . . . ?
Eu1 N6_1 C7_1 C8_1 159.8(5) . . . . ?
C11_1 N6_1 C7_1 C4_1 -175.2(11) . . . . ?
Eu1 N6_1 C7_1 C4_1 -15.5(10) . . . . ?
N5_1 C4_1 C7_1 N6_1 10(2) . . . . ?
O3_1 C4_1 C7_1 N6_1 -167.1(11) . . . . ?
N5_1 C4_1 C7_1 C8_1 -164.8(14) . . . . ?
O3_1 C4_1 C7_1 C8_1 18.2(19) . . . . ?
N6_1 C7_1 C8_1 C9_1 0.0 . . . . ?
C4_1 C7_1 C8_1 C9_1 174.2(13) . . . . ?
C7_1 C8_1 C9_1 C10_1 0.0 . . . . ?
C8_1 C9_1 C10_1 C11_1 0.0 . . . . ?
C9_1 C10_1 C11_1 N6_1 0.0 . . . . ?
C9_1 C10_1 C11_1 C12_1 -178.3(10) . . . . ?
C7_1 N6_1 C11_1 C10_1 0.0 . . . . ?
Eu1 N6_1 C11_1 C10_1 -159.8(5) . . . . ?
C7_1 N6_1 C11_1 C12_1 178.6(9) . . . . ?
Eu1 N6_1 C11_1 C12_1 18.8(8) . . . . ?
C10_1 C11_1 C12_1 O13_1 173.0(9) . . . . ?
N6_1 C11_1 C12_1 O13_1 -5.5(14) . . . . ?
C10_1 C11_1 C12_1 N14_1 -8.3(15) . . . . ?
N6_1 C11_1 C12_1 N14_1 173.2(9) . . . . ?
N14_1 C12_1 O13_1 Eu1 169.7(8) . . . . ?
C11_1 C12_1 O13_1 Eu1 -11.7(15) . . . . ?
O13_1 C12_1 N14_1 C15_1 -7.7(19) . . . . ?
C11_1 C12_1 N14_1 C15_1 173.6(9) . . . . ?
C12_1 N14_1 C15_1 C16_1 -47.3(14) . . . . ?
C12_1 N14_1 C15_1 C20_1 136.6(11) . . . . ?
C20_1 C15_1 C16_1 C17_1 0.0 . . . . ?
N14_1 C15_1 C16_1 C17_1 -176.1(9) . . . . ?
C15_1 C16_1 C17_1 C18_1 0.0 . . . . ?
C16_1 C17_1 C18_1 C19_1 0.0 . . . . ?
C17_1 C18_1 C19_1 C24_1 178.9(11) . . . . ?
C17_1 C18_1 C19_1 C20_1 0.0 . . . . ?
C24_1 C19_1 C20_1 C15_1 -178.8(11) . . . . ?
C18_1 C19_1 C20_1 C15_1 0.0 . . . . ?
C24_1 C19_1 C20_1 C21_1 4.0(12) . . . . ?
C18_1 C19_1 C20_1 C21_1 -177.1(10) . . . . ?
C16_1 C15_1 C20_1 C19_1 0.0 . . . . ?
N14_1 C15_1 C20_1 C19_1 176.0(9) . . . . ?
C16_1 C15_1 C20_1 C21_1 177.1(11) . . . . ?
N14_1 C15_1 C20_1 C21_1 -6.9(12) . . . . ?
C19_1 C20_1 C21_1 C22_1 -1.2(17) . . . . ?
C15_1 C20_1 C21_1 C22_1 -178.3(11) . . . . ?
C20_1 C21_1 C22_1 C23_1 -2(2) . . . . ?
C21_1 C22_1 C23_1 C24_1 2(2) . . . . ?
C22_1 C23_1 C24_1 C19_1 1(2) . . . . ?
C22_1 C23_1 C24_1 N25_1 -179.6(13) . . . . ?
C20_1 C19_1 C24_1 C23_1 -3.9(18) . . . . ?
C18_1 C19_1 C24_1 C23_1 177.2(11) . . . . ?
C20_1 C19_1 C24_1 N25_1 176.6(9) . . . . ?
C18_1 C19_1 C24_1 N25_1 -2.2(16) . . . . ?
C23_1 C24_1 N25_1 C26_1 72.4(19) . . . . ?
C19_1 C24_1 N25_1 C26_1 -108.1(17) . . . . ?
C24_1 N25_1 C26_1 O27_1 2(2) . . . . ?
C24_1 N25_1 C26_1 C29_1 -176.6(14) . . . . ?
C24_1 N25_1 C26_1 Eu1 -9(3) . . . 2_665 ?
N25_1 C26_1 O27_1 Eu1 -172.1(10) . . . 2_665 ?
C29_1 C26_1 O27_1 Eu1 7(2) . . . 2_665 ?
C33_1 N28_1 C29_1 C30_1 -5(2) . . . . ?
Eu1 N28_1 C29_1 C30_1 176.5(13) 2_665 . . . ?
C33_1 N28_1 C29_1 C26_1 -178.3(13) . . . . ?
Eu1 N28_1 C29_1 C26_1 3.0(17) 2_665 . . . ?
O27_1 C26_1 C29_1 N28_1 -6(2) . . . . ?
N25_1 C26_1 C29_1 N28_1 172.7(14) . . . . ?
Eu1 C26_1 C29_1 N28_1 -2.1(12) 2_665 . . . ?
O27_1 C26_1 C29_1 C30_1 -178.8(18) . . . . ?
N25_1 C26_1 C29_1 C30_1 0(3) . . . . ?
Eu1 C26_1 C29_1 C30_1 -174.8(19) 2_665 . . . ?
N28_1 C29_1 C30_1 C31_1 7(3) . . . . ?
C26_1 C29_1 C30_1 C31_1 179.4(18) . . . . ?
C29_1 C30_1 C31_1 C32_1 -9(3) . . . . ?
C30_1 C31_1 C32_1 C33_1 7(3) . . . . ?
C31_1 C32_1 C33_1 N28_1 -4(3) . . . . ?
C31_1 C32_1 C33_1 C34_1 -179.4(19) . . . . ?
C29_1 N28_1 C33_1 C32_1 3(2) . . . . ?
Eu1 N28_1 C33_1 C32_1 -178.2(14) 2_665 . . . ?
C29_1 N28_1 C33_1 C34_1 179.0(15) . . . . ?
Eu1 N28_1 C33_1 C34_1 -2.3(18) 2_665 . . . ?
C32_1 C33_1 C34_1 N35_1 179.7(17) . . . . ?
N28_1 C33_1 C34_1 N35_1 4(3) . . . . ?
C32_1 C33_1 C34_1 O38_1 -5(3) . . . . ?
N28_1 C33_1 C34_1 O38_1 179.0(14) . . . . ?
O38_1 C34_1 N35_1 C36_1 2(2) . . . . ?
C33_1 C34_1 N35_1 C36_1 177.4(18) . . . . ?
O38_1 C34_1 N35_1 Eu1 -178.6(11) . . . 2_665 ?
C33_1 C34_1 N35_1 Eu1 -3(2) . . . 2_665 ?
C34_1 N35_1 C36_1 C37_1 2(2) . . . . ?
Eu1 N35_1 C36_1 C37_1 -176.9(15) 2_665 . . . ?
N35_1 C36_1 C37_1 O38_1 -5(2) . . . . ?
N35_1 C34_1 O38_1 C37_1 -5(2) . . . . ?
C33_1 C34_1 O38_1 C37_1 179.1(18) . . . . ?
C36_1 C37_1 O38_1 C34_1 6(2) . . . . ?
N5_2 C1_2 C2_2 O3_2 14(3) . . . . ?
C1_2 C2_2 O3_2 C4_2 -13(3) . . . . ?
C2_2 O3_2 C4_2 N5_2 9(3) . . . . ?
C2_2 O3_2 C4_2 C7_2 -178(2) . . . . ?
O3_2 C4_2 N5_2 C1_2 1(3) . . . . ?
C7_2 C4_2 N5_2 C1_2 -171(2) . . . . ?
O3_2 C4_2 N5_2 Eu1 -178.5(15) . . . . ?
C7_2 C4_2 N5_2 Eu1 9(3) . . . . ?
C2_2 C1_2 N5_2 C4_2 -9(3) . . . . ?
C2_2 C1_2 N5_2 Eu1 169.9(15) . . . . ?
C11_2 N6_2 C7_2 C8_2 -1(3) . . . . ?
Eu1 N6_2 C7_2 C8_2 174.9(15) . . . . ?
C11_2 N6_2 C7_2 C4_2 -173.5(17) . . . . ?
Eu1 N6_2 C7_2 C4_2 2(2) . . . . ?
N5_2 C4_2 C7_2 N6_2 -8(3) . . . . ?
O3_2 C4_2 C7_2 N6_2 179.7(18) . . . . ?
N5_2 C4_2 C7_2 C8_2 180(2) . . . . ?
O3_2 C4_2 C7_2 C8_2 7(3) . . . . ?
N6_2 C7_2 C8_2 C9_2 4(3) . . . . ?
C4_2 C7_2 C8_2 C9_2 176(2) . . . . ?
C7_2 C8_2 C9_2 C10_2 -5(3) . . . . ?
C8_2 C9_2 C10_2 C11_2 3(3) . . . . ?
C7_2 N6_2 C11_2 C10_2 -2(2) . . . . ?
Eu1 N6_2 C11_2 C10_2 -177.9(12) . . . . ?
C7_2 N6_2 C11_2 C12_2 179.5(16) . . . . ?
Eu1 N6_2 C11_2 C12_2 3.8(18) . . . . ?
C9_2 C10_2 C11_2 N6_2 1(3) . . . . ?
C9_2 C10_2 C11_2 C12_2 179.1(18) . . . . ?
N6_2 C11_2 C12_2 O13_2 1(2) . . . . ?
C10_2 C11_2 C12_2 O13_2 -177.3(17) . . . . ?
N6_2 C11_2 C12_2 N14_2 -170.3(15) . . . . ?
C10_2 C11_2 C12_2 N14_2 12(3) . . . . ?
N6_2 C11_2 C12_2 Eu1 -2.6(12) . . . . ?
C10_2 C11_2 C12_2 Eu1 179.2(17) . . . . ?
N14_2 C12_2 O13_2 Eu1 164.9(12) . . . . ?
C11_2 C12_2 O13_2 Eu1 -6(2) . . . . ?
O13_2 C12_2 N14_2 C15_2 -7(2) . . . . ?
C11_2 C12_2 N14_2 C15_2 164.1(14) . . . . ?
Eu1 C12_2 N14_2 C15_2 15(4) . . . . ?
C12_2 N14_2 C15_2 C16_2 -87(2) . . . . ?
C12_2 N14_2 C15_2 C20_2 88.5(18) . . . . ?
C20_2 C15_2 C16_2 C17_2 -3(3) . . . . ?
N14_2 C15_2 C16_2 C17_2 172.3(16) . . . . ?
C15_2 C16_2 C17_2 C18_2 5(3) . . . . ?
C16_2 C17_2 C18_2 C19_2 -1(3) . . . . ?
C17_2 C18_2 C19_2 C24_2 -179.9(18) . . . . ?
C17_2 C18_2 C19_2 C20_2 -5(3) . . . . ?
C24_2 C19_2 C20_2 C15_2 -178.1(14) . . . . ?
C18_2 C19_2 C20_2 C15_2 7(2) . . . . ?
C24_2 C19_2 C20_2 C21_2 -3(2) . . . . ?
C18_2 C19_2 C20_2 C21_2 -178.2(15) . . . . ?
C16_2 C15_2 C20_2 C19_2 -3(2) . . . . ?
N14_2 C15_2 C20_2 C19_2 -178.4(12) . . . . ?
C16_2 C15_2 C20_2 C21_2 -178.2(17) . . . . ?
N14_2 C15_2 C20_2 C21_2 6(2) . . . . ?
C19_2 C20_2 C21_2 C22_2 2(3) . . . . ?
C15_2 C20_2 C21_2 C22_2 177.1(17) . . . . ?
C20_2 C21_2 C22_2 C23_2 1(3) . . . . ?
C21_2 C22_2 C23_2 C24_2 -4(3) . . . . ?
C22_2 C23_2 C24_2 C19_2 3(3) . . . . ?
C22_2 C23_2 C24_2 N25_2 -174.6(17) . . . . ?
C20_2 C19_2 C24_2 C23_2 0(2) . . . . ?
C18_2 C19_2 C24_2 C23_2 175.6(17) . . . . ?
C20_2 C19_2 C24_2 N25_2 177.9(13) . . . . ?
C18_2 C19_2 C24_2 N25_2 -7(2) . . . . ?
C23_2 C24_2 N25_2 C26_2 92(2) . . . . ?
C19_2 C24_2 N25_2 C26_2 -85.6(19) . . . . ?
C24_2 N25_2 C26_2 O27_2 13(2) . . . . ?
C24_2 N25_2 C26_2 C29_2 -163.3(14) . . . . ?
N25_2 C26_2 O27_2 Eu2 -172.5(10) . . . . ?
C29_2 C26_2 O27_2 Eu2 4.3(19) . . . . ?
C33_2 N28_2 C29_2 C30_2 1(2) . . . . ?
Eu2 N28_2 C29_2 C30_2 -167.2(11) . . . . ?
C33_2 N28_2 C29_2 C26_2 -177.9(12) . . . . ?
Eu2 N28_2 C29_2 C26_2 13.9(15) . . . . ?
O27_2 C26_2 C29_2 N28_2 -12.0(19) . . . . ?
N25_2 C26_2 C29_2 N28_2 164.8(14) . . . . ?
O27_2 C26_2 C29_2 C30_2 169.3(15) . . . . ?
N25_2 C26_2 C29_2 C30_2 -14(2) . . . . ?
N28_2 C29_2 C30_2 C31_2 -2(2) . . . . ?
C26_2 C29_2 C30_2 C31_2 176.8(16) . . . . ?
C29_2 C30_2 C31_2 C32_2 0(3) . . . . ?
C30_2 C31_2 C32_2 C33_2 2(3) . . . . ?
C31_2 C32_2 C33_2 N28_2 -3(3) . . . . ?
C31_2 C32_2 C33_2 C34_2 176.6(19) . . . . ?
C29_2 N28_2 C33_2 C32_2 2(2) . . . . ?
Eu2 N28_2 C33_2 C32_2 169.9(14) . . . . ?
C29_2 N28_2 C33_2 C34_2 -178.0(14) . . . . ?
Eu2 N28_2 C33_2 C34_2 -9.9(18) . . . . ?
C32_2 C33_2 C34_2 N35_2 -173.4(19) . . . . ?
N28_2 C33_2 C34_2 N35_2 6(3) . . . . ?
C32_2 C33_2 C34_2 O38_2 5(3) . . . . ?
N28_2 C33_2 C34_2 O38_2 -174.7(15) . . . . ?
O38_2 C34_2 N35_2 C36_2 -4(2) . . . . ?
C33_2 C34_2 N35_2 C36_2 175.2(18) . . . . ?
O38_2 C34_2 N35_2 Eu2 -178.5(13) . . . . ?
C33_2 C34_2 N35_2 Eu2 0(3) . . . . ?
C34_2 N35_2 C36_2 C37_2 -2(2) . . . . ?
Eu2 N35_2 C36_2 C37_2 170.9(15) . . . . ?
N35_2 C36_2 C37_2 O38_2 7(2) . . . . ?
N35_2 C34_2 O38_2 C37_2 8(3) . . . . ?
C33_2 C34_2 O38_2 C37_2 -170.9(19) . . . . ?
C36_2 C37_2 O38_2 C34_2 -9(2) . . . . ?
O3_3 S1_3 C1_3 F2_3 49.5(18) . . . . ?
O2_3 S1_3 C1_3 F2_3 170.3(16) . . . . ?
O1_3 S1_3 C1_3 F2_3 -64.8(18) . . . . ?
O3_3 S1_3 C1_3 F1_3 170.1(12) . . . . ?
O2_3 S1_3 C1_3 F1_3 -69.1(14) . . . . ?
O1_3 S1_3 C1_3 F1_3 55.8(15) . . . . ?
O3_3 S1_3 C1_3 F3_3 -69.7(16) . . . . ?
O2_3 S1_3 C1_3 F3_3 51.1(16) . . . . ?
O1_3 S1_3 C1_3 F3_3 176.0(15) . . . . ?
O1_4 S1_4 C1_4 F1_4 177(2) . . . . ?
O3_4 S1_4 C1_4 F1_4 62(3) . . . . ?
O2_4 S1_4 C1_4 F1_4 -59(3) . . . . ?
O1_4 S1_4 C1_4 F2_4 60(3) . . . . ?
O3_4 S1_4 C1_4 F2_4 -55(3) . . . . ?
O2_4 S1_4 C1_4 F2_4 -176(3) . . . . ?
O1_4 S1_4 C1_4 F3_4 -61(2) . . . . ?
O3_4 S1_4 C1_4 F3_4 -177(3) . . . . ?
O2_4 S1_4 C1_4 F3_4 62(3) . . . . ?
O1_5 S1_5 C1_5 F1_5 162(2) . . . . ?
O2_5 S1_5 C1_5 F1_5 -62(2) . . . . ?
O3_5 S1_5 C1_5 F1_5 51(2) . . . . ?
O1_5 S1_5 C1_5 F3_5 -74(2) . . . . ?
O2_5 S1_5 C1_5 F3_5 62(2) . . . . ?
O3_5 S1_5 C1_5 F3_5 174(3) . . . . ?
O1_5 S1_5 C1_5 F2_5 54(2) . . . . ?
O2_5 S1_5 C1_5 F2_5 -170(2) . . . . ?
O3_5 S1_5 C1_5 F2_5 -57(2) . . . . ?
O1_6 S1_6 C1_6 F1_6 63(2) . . . . ?
O2_6 S1_6 C1_6 F1_6 -73(2) . . . . ?
O3_6 S1_6 C1_6 F1_6 176(2) . . . . ?
O1_6 S1_6 C1_6 F2_6 -58(2) . . . . ?
O2_6 S1_6 C1_6 F2_6 167(2) . . . . ?
O3_6 S1_6 C1_6 F2_6 55(2) . . . . ?
O1_6 S1_6 C1_6 F3_6 -177(2) . . . . ?
O2_6 S1_6 C1_6 F3_6 48(2) . . . . ?
O3_6 S1_6 C1_6 F3_6 -63(2) . . . . ?
O1_7 S1_7 C1_7 F1_7 167(2) . . . . ?
O1_7 S1_7 C1_7 F1_7 47(2) 3_575 . . . ?
O1_7 S1_7 C1_7 F1_7 -73(2) 2_775 . . . ?
O1_7 S1_7 C1_7 F1_7 47(2) . . . 2_775 ?
O1_7 S1_7 C1_7 F1_7 -73(2) 3_575 . . 2_775 ?
O1_7 S1_7 C1_7 F1_7 167(2) 2_775 . . 2_775 ?
O1_7 S1_7 C1_7 F1_7 -73(2) . . . 3_575 ?
O1_7 S1_7 C1_7 F1_7 167(2) 3_575 . . 3_575 ?
O1_7 S1_7 C1_7 F1_7 47(2) 2_775 . . 3_575 ?

_refine_diff_density_max         0.830
_refine_diff_density_min         -0.665
_refine_diff_density_rms         0.120

_shelxl_version_number           2014/6



# start Validation Reply Form
_vrf_THETM01_r-3                 
;
PROBLEM: The value of sine(theta_max)/wavelength is less than 0.550
RESPONSE: The crystals of this giant supramolecular assembly diffract very weekly in nature, possibly due to the big unit cell and the very large solvent accessible void existing in the crystal. There was just no significant diffraction intensity at Theta > 27.473 ( or Resolution above 1.06 Angstrom) even though we optimized the measurement based on synchrotron radiations.
;
_vrf_PLAT602_r-3                 
;
PROBLEM: VERY LARGE Solvent Accessible VOID(S) in Structure ! Info
RESPONSE: A very large solvent accessibly VOID of 5021 cubic Angstroms was determined based on PLATON calculations, which is possibly occupied by amorphous solvents. As the refined parameters obtained seems reasonably good enough so no SQUEEZE routine applied in this case.
;
# end Validation Reply Form
_exptl_crystal_recrystallization_method 'Vapour deposition'
_chemical_properties_physical    ', Air-sensitive'
_exptl_crystal_preparation       ', Luminescent'
