# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2018

####################################################################### 
# 
# 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. 
# 
#######################################################################

data_shelx
_database_code_depnum_ccdc_archive 'CCDC 1586255'
_audit_update_record             
;
2018-05-04 deposited with the CCDC.
2018-05-31 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/7
_shelx_SHELXL_version_number     2014/7
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C45 H21 Cu Eu F30 N4 O12'
_chemical_formula_sum            'C45 H21 Cu Eu F30 N4 O12'
_chemical_formula_weight         1595.16

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'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cu Cu 0.3201 1.2651 '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'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'

_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'
'-x, -y, -z'

_cell_length_a                   13.5009(8)
_cell_length_b                   13.9971(8)
_cell_length_c                   17.0203(9)
_cell_angle_alpha                80.448(2)
_cell_angle_beta                 73.862(2)
_cell_angle_gamma                65.595(2)
_cell_volume                     2808.8(3)
_cell_formula_units_Z            2
_cell_measurement_temperature    296(2)
_cell_measurement_reflns_used    9679
_cell_measurement_theta_min      2.48
_cell_measurement_theta_max      29.35

_exptl_crystal_description       Table
_exptl_crystal_colour            green
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.886
_exptl_crystal_F_000             1554
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.428
_exptl_crystal_size_mid          0.312
_exptl_crystal_size_min          0.152
_exptl_absorpt_coefficient_mu    1.647
_shelx_estimated_absorpt_T_min   0.539
_shelx_estimated_absorpt_T_max   0.788
_exptl_absorpt_correction_type   Numerical
_exptl_absorpt_correction_T_min  0.5058
_exptl_absorpt_correction_T_max  0.6946
_exptl_absorpt_process_details   'Bruker SADABS-2016/2'
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
1.00 1.00 1.00 0.0760
-1.00 -1.00 -1.00 0.0050
0.00 0.00 1.00 0.0800
0.00 0.00 -1.00 0.1130
2.00 -1.00 0.00 0.1820
-2.00 1.00 0.00 0.1500
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      296(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            97537
_diffrn_reflns_av_unetI/netI     0.0190
_diffrn_reflns_av_R_equivalents  0.0344
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_theta_min         2.086
_diffrn_reflns_theta_max         26.500
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measured_fraction_theta_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_point_group_measured_fraction_full 0.998
_reflns_number_total             11621
_reflns_number_gt                8790
_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       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXT (Sheldrick, 2015)'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'WinGX publication routines (Farrugia, 1999)'
_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)+(0.0774P)²+9.0146P] 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         11621
_refine_ls_number_parameters     864
_refine_ls_number_restraints     66
_refine_ls_R_factor_all          0.0731
_refine_ls_R_factor_gt           0.0537
_refine_ls_wR_factor_ref         0.1576
_refine_ls_wR_factor_gt          0.1337
_refine_ls_goodness_of_fit_ref   1.088
_refine_ls_restrained_S_all      1.085
_refine_ls_shift/su_max          0.014
_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 0.74676(2) 0.74958(2) 0.50065(2) 0.03175(10) Uani 1 1 d . . . . .
Cu1 Cu 0.5000 1.5000 0.0000 0.02860(17) Uani 1 2 d S . P . .
Cu2 Cu 1.0000 0.0000 1.0000 0.02985(18) Uani 1 2 d S . P . .
C1 C 0.1541(7) 1.5093(10) 0.0235(6) 0.095(3) Uani 1 1 d . U . . .
F1A F 0.1046(13) 1.5649(16) -0.0269(11) 0.165(14) Uani 0.495(18) 1 d G . P A 1
F2A F 0.1125(13) 1.5423(14) 0.1014(10) 0.121(7) Uani 0.495(18) 1 d G . P A 1
F3A F 0.1359(11) 1.4102(10) 0.0363(10) 0.113(6) Uani 0.495(18) 1 d G . P A 1
F1B F 0.1192(15) 1.4992(11) -0.0448(9) 0.118(7) Uani 0.505(18) 1 d G . P A 2
F2B F 0.1049(10) 1.6222(9) 0.0261(11) 0.121(6) Uani 0.505(18) 1 d G . P A 2
F3B F 0.1205(11) 1.4676(16) 0.0847(9) 0.155(12) Uani 0.505(18) 1 d G . P A 2
C2 C 0.2834(5) 1.4764(6) -0.0027(4) 0.0613(17) Uani 1 1 d . . . . .
O1 O 0.3181(4) 1.5243(4) 0.0304(3) 0.0638(12) Uani 1 1 d . . . . .
C3 C 0.3448(6) 1.3983(7) -0.0602(5) 0.0705(19) Uani 1 1 d . . . . .
H3 H 0.3063 1.3652 -0.0752 0.085 Uiso 1 1 calc R U . . .
C4 C 0.4569(5) 1.3677(5) -0.0956(4) 0.0564(15) Uani 1 1 d . . . . .
O2 O 0.5254(3) 1.4007(3) -0.0847(2) 0.0497(9) Uani 1 1 d . . . . .
C5 C 0.5109(7) 1.2811(8) -0.1559(7) 0.090(3) Uani 1 1 d . . . . .
F4 F 0.4450(5) 1.2407(5) -0.1661(5) 0.136(2) Uani 1 1 d . . . . .
F5 F 0.6002(6) 1.2063(6) -0.1367(6) 0.154(3) Uani 1 1 d . . . . .
F6 F 0.5486(6) 1.3208(7) -0.2286(4) 0.147(3) Uani 1 1 d . . . . .
N1 N 0.5330(3) 1.3765(3) 0.0860(3) 0.0395(9) Uani 1 1 d . . . . .
C6 C 0.4903(5) 1.3900(4) 0.1660(4) 0.0531(15) Uani 1 1 d . . . . .
H6 H 0.4465 1.4577 0.1830 0.064 Uiso 1 1 calc R U . . .
C7 C 0.5083(5) 1.3081(4) 0.2242(4) 0.0536(15) Uani 1 1 d . . . . .
H7 H 0.4772 1.3209 0.2794 0.064 Uiso 1 1 calc R U . . .
C8 C 0.5728(4) 1.2063(4) 0.2008(3) 0.0431(12) Uani 1 1 d . . . . .
C9 C 0.6175(5) 1.1925(5) 0.1176(4) 0.0567(16) Uani 1 1 d . . . . .
H9 H 0.6616 1.1255 0.0990 0.068 Uiso 1 1 calc R U . . .
C10 C 0.5961(5) 1.2784(5) 0.0630(4) 0.0591(16) Uani 1 1 d . . . . .
H10 H 0.6269 1.2679 0.0075 0.071 Uiso 1 1 calc R U . . .
C11 C 0.5887(4) 1.1145(4) 0.2618(3) 0.0439(12) Uani 1 1 d . . . . .
C12 C 0.5836(5) 1.1268(4) 0.3426(4) 0.0531(14) Uani 1 1 d . . . . .
H12 H 0.5747 1.1913 0.3578 0.064 Uiso 1 1 calc R U . . .
C13 C 0.5919(5) 1.0442(5) 0.3994(3) 0.0519(14) Uani 1 1 d . . . . .
H13 H 0.5879 1.0534 0.4532 0.062 Uiso 1 1 calc R U . . .
N2 N 0.6054(4) 0.9510(3) 0.3795(3) 0.0436(10) Uani 1 1 d . . . . .
C14 C 0.6138(6) 0.9355(5) 0.3022(4) 0.0619(17) Uani 1 1 d . . . . .
H14 H 0.6255 0.8694 0.2884 0.074 Uiso 1 1 calc R U . . .
C15 C 0.6052(6) 1.0160(5) 0.2429(4) 0.0601(16) Uani 1 1 d . . . . .
H15 H 0.6106 1.0041 0.1894 0.072 Uiso 1 1 calc R U . . .
O3 O 0.6070(3) 0.8736(3) 0.4361(2) 0.0491(9) Uani 1 1 d . . . . .
C16 C 0.4450(6) 0.6548(7) 0.5206(6) 0.078(2) Uani 1 1 d . . . . .
F7 F 0.3680(4) 0.7476(4) 0.5412(4) 0.116(2) Uani 1 1 d . . . . .
F8 F 0.4504(5) 0.5957(5) 0.5906(4) 0.129(2) Uani 1 1 d . . . . .
F9 F 0.4099(4) 0.6146(5) 0.4749(4) 0.130(2) Uani 1 1 d . . . . .
C17 C 0.5595(5) 0.6613(4) 0.4812(4) 0.0477(13) Uani 1 1 d . . . . .
O4 O 0.5900(3) 0.6993(3) 0.5256(2) 0.0432(8) Uani 1 1 d . . . . .
C18 C 0.6135(5) 0.6264(5) 0.4030(4) 0.0541(15) Uani 1 1 d . . . . .
H18 H 0.5791 0.5983 0.3782 0.065 Uiso 1 1 calc R U . . .
C19 C 0.7145(4) 0.6302(4) 0.3594(3) 0.0430(12) Uani 1 1 d . . . . .
O5 O 0.7716(3) 0.6680(3) 0.3789(2) 0.0423(8) Uani 1 1 d . . . . .
C20 C 0.7661(6) 0.5834(6) 0.2740(5) 0.0676(19) Uani 1 1 d . . . . .
F10 F 0.8690(4) 0.5171(5) 0.2684(4) 0.112(2) Uani 1 1 d . . . . .
F11 F 0.7710(6) 0.6613(5) 0.2175(3) 0.119(2) Uani 1 1 d . . . . .
F12 F 0.7104(5) 0.5389(5) 0.2533(3) 0.1126(19) Uani 1 1 d . . . . .
C21 C 0.7014(8) 1.0397(6) 0.6320(6) 0.081(2) Uani 1 1 d . . . . .
F13 F 0.7814(7) 1.0593(5) 0.5795(6) 0.169(4) Uani 1 1 d . . . . .
F14 F 0.7076(12) 1.0618(6) 0.6999(5) 0.223(6) Uani 1 1 d . U . . .
F15 F 0.6113(6) 1.1110(4) 0.6159(7) 0.179(4) Uani 1 1 d . U . . .
C22 C 0.7086(5) 0.9299(5) 0.6288(4) 0.0569(15) Uani 1 1 d . . . . .
O6 O 0.6980(4) 0.9115(3) 0.5630(3) 0.0560(10) Uani 1 1 d . . . . .
C23 C 0.7285(7) 0.8611(6) 0.6967(4) 0.0695(19) Uani 1 1 d . . . . .
H23 H 0.7403 0.8828 0.7408 0.083 Uiso 1 1 calc R U . . .
C24 C 0.7310(5) 0.7617(5) 0.6999(4) 0.0519(14) Uani 1 1 d . . . . .
O7 O 0.7173(3) 0.7183(3) 0.6474(2) 0.0508(9) Uani 1 1 d . . . . .
C25 C 0.7570(7) 0.6913(7) 0.7780(4) 0.0706(19) Uani 1 1 d . . . . .
F16 F 0.7541(5) 0.5989(4) 0.7789(3) 0.0926(14) Uani 1 1 d . . . . .
F17 F 0.6828(6) 0.7339(5) 0.8449(3) 0.119(2) Uani 1 1 d . . . . .
F18 F 0.8546(6) 0.6793(7) 0.7859(4) 0.158(3) Uani 1 1 d . U . . .
C26 C 0.9127(8) 0.9759(7) 0.3456(6) 0.084(2) Uani 1 1 d . . . . .
F19 F 0.8564(5) 0.9940(4) 0.2897(3) 0.1056(17) Uani 1 1 d . . . . .
F20 F 1.0119(6) 0.9648(7) 0.3046(5) 0.176(4) Uani 1 1 d . U . . .
F21 F 0.8660(10) 1.0590(5) 0.3859(4) 0.208(5) Uani 1 1 d . U . . .
C27 C 0.9114(5) 0.8792(5) 0.4053(4) 0.0543(15) Uani 1 1 d . . . . .
O8 O 0.8417(3) 0.8453(3) 0.4016(2) 0.0506(9) Uani 1 1 d . . . . .
C28 C 0.9856(5) 0.8426(6) 0.4546(5) 0.0668(19) Uani 1 1 d . . . . .
H28 H 1.0368 0.8734 0.4486 0.080 Uiso 1 1 calc R U . . .
C29 C 0.9867(5) 0.7609(5) 0.5133(4) 0.0539(15) Uani 1 1 d . . . . .
O9 O 0.9218(3) 0.7135(3) 0.5305(3) 0.0544(10) Uani 1 1 d . . . . .
C30 C 1.0723(7) 0.7230(7) 0.5656(6) 0.079(2) Uani 1 1 d . . . . .
F22 F 1.1213(7) 0.6232(5) 0.5701(7) 0.185(5) Uani 1 1 d . U . . .
F23 F 1.0285(6) 0.7531(9) 0.6376(5) 0.186(4) Uani 1 1 d . U . . .
F24 F 1.1522(6) 0.7564(7) 0.5396(6) 0.175(4) Uani 1 1 d . . . . .
O10 O 0.8252(3) 0.5650(3) 0.5220(2) 0.0478(9) Uani 1 1 d . . . . .
N3 N 0.8432(4) 0.5005(3) 0.5880(3) 0.0416(10) Uani 1 1 d . . . . .
C31 C 0.7711(5) 0.4554(5) 0.6246(4) 0.0576(16) Uani 1 1 d . . . . .
H31 H 0.7074 0.4717 0.6056 0.069 Uiso 1 1 calc R U . . .
C32 C 0.7910(5) 0.3844(5) 0.6909(4) 0.0602(17) Uani 1 1 d . . . . .
H32 H 0.7399 0.3537 0.7162 0.072 Uiso 1 1 calc R U . . .
C33 C 0.8855(4) 0.3578(4) 0.7206(3) 0.0422(12) Uani 1 1 d . . . . .
C34 C 0.9570(5) 0.4075(5) 0.6804(3) 0.0488(13) Uani 1 1 d . . . . .
H34 H 1.0214 0.3930 0.6980 0.059 Uiso 1 1 calc R U . . .
C35 C 0.9341(5) 0.4783(5) 0.6148(4) 0.0491(14) Uani 1 1 d . . . . .
H35 H 0.9832 0.5110 0.5888 0.059 Uiso 1 1 calc R U . . .
C36 C 0.9121(4) 0.2781(4) 0.7889(3) 0.0415(12) Uani 1 1 d . . . . .
C37 C 0.8303(5) 0.2552(5) 0.8472(4) 0.071(2) Uani 1 1 d . . . . .
H37 H 0.7555 0.2925 0.8462 0.085 Uiso 1 1 calc R U . . .
C38 C 0.8597(5) 0.1766(6) 0.9074(5) 0.077(2) Uani 1 1 d . . . . .
H38 H 0.8029 0.1633 0.9468 0.092 Uiso 1 1 calc R U . . .
N4 N 0.9642(4) 0.1193(3) 0.9119(3) 0.0420(10) Uani 1 1 d . . . . .
C39 C 1.0436(5) 0.1428(5) 0.8569(4) 0.0584(16) Uani 1 1 d . . . . .
H39 H 1.1176 0.1054 0.8602 0.070 Uiso 1 1 calc R U . . .
C40 C 1.0212(5) 0.2199(5) 0.7955(4) 0.0556(15) Uani 1 1 d . . . . .
H40 H 1.0796 0.2332 0.7580 0.067 Uiso 1 1 calc R U . . .
C41 C 0.8629(8) 0.2532(6) 1.1732(5) 0.079(2) Uani 1 1 d . . . . .
F25 F 0.8158(7) 0.2120(5) 1.2382(4) 0.153(3) Uani 1 1 d . U . . .
F26 F 0.9054(6) 0.3133(5) 1.1926(4) 0.130(2) Uani 1 1 d . . . . .
F27 F 0.7808(5) 0.3191(4) 1.1389(4) 0.1108(17) Uani 1 1 d . . . . .
C42 C 0.9494(7) 0.1683(5) 1.1139(4) 0.0616(17) Uani 1 1 d . . . . .
O11 O 0.9099(5) 0.1139(4) 1.0928(3) 0.0677(12) Uani 1 1 d . . . . .
C43 C 1.0580(8) 0.1612(6) 1.0917(5) 0.077(2) Uani 1 1 d . . . . .
H43 H 1.0747 0.2064 1.1153 0.092 Uiso 1 1 calc R U . . .
C44 C 1.1452(7) 0.0920(6) 1.0369(5) 0.0690(19) Uani 1 1 d . . . . .
O12 O 1.1429(4) 0.0233(3) 0.9988(3) 0.0614(11) Uani 1 1 d . . . . .
C45 C 1.2560(10) 0.1016(13) 1.0174(9) 0.124(4) Uani 1 1 d . . . . .
F28 F 1.3308(10) 0.0098(13) 1.0308(14) 0.309(10) Uani 1 1 d . . . . .
F29 F 1.2950(13) 0.1117(16) 0.9423(8) 0.294(10) Uani 1 1 d . U . . .
F30 F 1.2703(8) 0.1604(12) 1.0509(9) 0.290(9) Uani 1 1 d . U . . .


_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 O10 2.360(4) . ?
Eu1 O3 2.365(4) . ?
Eu1 O9 2.386(4) . ?
Eu1 O8 2.397(4) . ?
Eu1 O4 2.406(3) . ?
Eu1 O5 2.408(4) . ?
Eu1 O7 2.412(4) . ?
Eu1 O6 2.423(4) . ?
Cu1 O2 2.030(4) 2_685 ?
Cu1 O2 2.030(4) . ?
Cu1 N1 2.053(4) 2_685 ?
Cu1 N1 2.053(4) . ?
Cu1 O1 2.253(5) . ?
Cu1 O1 2.253(5) 2_685 ?
Cu2 N4 2.043(4) . ?
Cu2 N4 2.043(4) 2_757 ?
Cu2 O12 2.080(5) 2_757 ?
Cu2 O12 2.080(5) . ?
Cu2 O11 2.164(5) . ?
Cu2 O11 2.164(5) 2_757 ?
C1 F3B 1.177(14) . ?
C1 F1A 1.205(15) . ?
C1 F2A 1.364(16) . ?
C1 F1B 1.417(16) . ?
C1 F2B 1.442(16) . ?
C1 F3A 1.478(16) . ?
C1 C2 1.559(10) . ?
C2 O1 1.232(8) . ?
C2 C3 1.413(11) . ?
C3 C4 1.370(9) . ?
C3 H3 0.9300 . ?
C4 O2 1.258(7) . ?
C4 C5 1.524(11) . ?
C5 F4 1.295(9) . ?
C5 F5 1.310(11) . ?
C5 F6 1.325(12) . ?
N1 C6 1.334(7) . ?
N1 C10 1.339(7) . ?
C6 C7 1.372(7) . ?
C6 H6 0.9300 . ?
C7 C8 1.384(8) . ?
C7 H7 0.9300 . ?
C8 C9 1.387(8) . ?
C8 C11 1.494(7) . ?
C9 C10 1.373(8) . ?
C9 H9 0.9300 . ?
C10 H10 0.9300 . ?
C11 C15 1.380(8) . ?
C11 C12 1.394(8) . ?
C12 C13 1.367(8) . ?
C12 H12 0.9300 . ?
C13 N2 1.329(8) . ?
C13 H13 0.9300 . ?
N2 O3 1.322(5) . ?
N2 C14 1.336(8) . ?
C14 C15 1.371(8) . ?
C14 H14 0.9300 . ?
C15 H15 0.9300 . ?
C16 F9 1.311(9) . ?
C16 F7 1.313(9) . ?
C16 F8 1.333(11) . ?
C16 C17 1.539(9) . ?
C17 O4 1.229(7) . ?
C17 C18 1.387(9) . ?
C18 C19 1.377(8) . ?
C18 H18 0.9300 . ?
C19 O5 1.233(6) . ?
C19 C20 1.551(9) . ?
C20 F12 1.298(8) . ?
C20 F10 1.300(8) . ?
C20 F11 1.339(10) . ?
C21 F14 1.277(11) . ?
C21 F15 1.281(11) . ?
C21 F13 1.291(10) . ?
C21 C22 1.508(9) . ?
C22 O6 1.248(7) . ?
C22 C23 1.387(10) . ?
C23 C24 1.369(9) . ?
C23 H23 0.9300 . ?
C24 O7 1.252(7) . ?
C24 C25 1.549(9) . ?
C25 F18 1.299(9) . ?
C25 F16 1.308(9) . ?
C25 F17 1.324(9) . ?
C26 F21 1.280(10) . ?
C26 F20 1.284(10) . ?
C26 F19 1.309(10) . ?
C26 C27 1.556(10) . ?
C27 O8 1.236(7) . ?
C27 C28 1.368(10) . ?
C28 C29 1.387(10) . ?
C28 H28 0.9300 . ?
C29 O9 1.251(7) . ?
C29 C30 1.523(9) . ?
C30 F23 1.261(10) . ?
C30 F22 1.274(10) . ?
C30 F24 1.288(10) . ?
O10 N3 1.330(5) . ?
N3 C35 1.327(7) . ?
N3 C31 1.333(7) . ?
C31 C32 1.382(8) . ?
C31 H31 0.9300 . ?
C32 C33 1.386(8) . ?
C32 H32 0.9300 . ?
C33 C34 1.384(7) . ?
C33 C36 1.482(7) . ?
C34 C35 1.377(8) . ?
C34 H34 0.9300 . ?
C35 H35 0.9300 . ?
C36 C37 1.372(8) . ?
C36 C40 1.383(8) . ?
C37 C38 1.382(9) . ?
C37 H37 0.9300 . ?
C38 N4 1.321(8) . ?
C38 H38 0.9300 . ?
N4 C39 1.329(7) . ?
C39 C40 1.372(8) . ?
C39 H39 0.9300 . ?
C40 H40 0.9300 . ?
C41 F25 1.289(10) . ?
C41 F26 1.320(10) . ?
C41 F27 1.326(10) . ?
C41 C42 1.547(11) . ?
C42 O11 1.234(8) . ?
C42 C43 1.373(11) . ?
C43 C44 1.395(11) . ?
C43 H43 0.9300 . ?
C44 O12 1.259(8) . ?
C44 C45 1.497(13) . ?
C45 F30 1.180(12) . ?
C45 F29 1.248(17) . ?
C45 F28 1.297(18) . ?

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
O10 Eu1 O3 136.44(14) . . ?
O10 Eu1 O9 75.76(14) . . ?
O3 Eu1 O9 143.82(13) . . ?
O10 Eu1 O8 122.78(14) . . ?
O3 Eu1 O8 75.74(13) . . ?
O9 Eu1 O8 70.99(14) . . ?
O10 Eu1 O4 76.02(13) . . ?
O3 Eu1 O4 69.31(13) . . ?
O9 Eu1 O4 146.57(13) . . ?
O8 Eu1 O4 140.99(13) . . ?
O10 Eu1 O5 70.03(13) . . ?
O3 Eu1 O5 75.89(14) . . ?
O9 Eu1 O5 111.52(14) . . ?
O8 Eu1 O5 80.67(13) . . ?
O4 Eu1 O5 74.61(12) . . ?
O10 Eu1 O7 75.28(13) . . ?
O3 Eu1 O7 122.75(14) . . ?
O9 Eu1 O7 74.43(14) . . ?
O8 Eu1 O7 133.83(14) . . ?
O4 Eu1 O7 81.38(13) . . ?
O5 Eu1 O7 141.50(13) . . ?
O10 Eu1 O6 142.65(14) . . ?
O3 Eu1 O6 76.79(15) . . ?
O9 Eu1 O6 81.09(15) . . ?
O8 Eu1 O6 74.74(14) . . ?
O4 Eu1 O6 112.26(14) . . ?
O5 Eu1 O6 146.88(13) . . ?
O7 Eu1 O6 70.46(14) . . ?
O2 Cu1 O2 180.0 2_685 . ?
O2 Cu1 N1 90.25(17) 2_685 2_685 ?
O2 Cu1 N1 89.75(17) . 2_685 ?
O2 Cu1 N1 89.75(17) 2_685 . ?
O2 Cu1 N1 90.25(17) . . ?
N1 Cu1 N1 180.0 2_685 . ?
O2 Cu1 O1 92.89(17) 2_685 . ?
O2 Cu1 O1 87.12(17) . . ?
N1 Cu1 O1 88.66(17) 2_685 . ?
N1 Cu1 O1 91.34(17) . . ?
O2 Cu1 O1 87.11(17) 2_685 2_685 ?
O2 Cu1 O1 92.89(17) . 2_685 ?
N1 Cu1 O1 91.34(17) 2_685 2_685 ?
N1 Cu1 O1 88.66(17) . 2_685 ?
O1 Cu1 O1 180.0 . 2_685 ?
N4 Cu2 N4 180.0 . 2_757 ?
N4 Cu2 O12 90.29(18) . 2_757 ?
N4 Cu2 O12 89.71(18) 2_757 2_757 ?
N4 Cu2 O12 89.71(18) . . ?
N4 Cu2 O12 90.29(18) 2_757 . ?
O12 Cu2 O12 180.0 2_757 . ?
N4 Cu2 O11 89.19(18) . . ?
N4 Cu2 O11 90.80(17) 2_757 . ?
O12 Cu2 O11 92.34(19) 2_757 . ?
O12 Cu2 O11 87.66(19) . . ?
N4 Cu2 O11 90.81(17) . 2_757 ?
N4 Cu2 O11 89.19(18) 2_757 2_757 ?
O12 Cu2 O11 87.66(19) 2_757 2_757 ?
O12 Cu2 O11 92.34(19) . 2_757 ?
O11 Cu2 O11 180.0(2) . 2_757 ?
F1A C1 F2A 115.9(12) . . ?
F3B C1 F1B 113.9(12) . . ?
F3B C1 F2B 112.1(11) . . ?
F1B C1 F2B 99.3(8) . . ?
F1A C1 F3A 108.2(11) . . ?
F2A C1 F3A 100.0(9) . . ?
F3B C1 C2 115.7(10) . . ?
F1A C1 C2 114.5(10) . . ?
F2A C1 C2 111.1(10) . . ?
F1B C1 C2 107.3(10) . . ?
F2B C1 C2 107.0(9) . . ?
F3A C1 C2 105.6(9) . . ?
O1 C2 C3 128.6(6) . . ?
O1 C2 C1 113.9(8) . . ?
C3 C2 C1 117.6(7) . . ?
C2 O1 Cu1 122.1(5) . . ?
C4 C3 C2 125.1(7) . . ?
C4 C3 H3 117.5 . . ?
C2 C3 H3 117.5 . . ?
O2 C4 C3 128.7(7) . . ?
O2 C4 C5 112.8(6) . . ?
C3 C4 C5 118.5(7) . . ?
C4 O2 Cu1 127.8(4) . . ?
F4 C5 F5 109.8(9) . . ?
F4 C5 F6 106.7(9) . . ?
F5 C5 F6 104.6(8) . . ?
F4 C5 C4 115.2(7) . . ?
F5 C5 C4 111.4(8) . . ?
F6 C5 C4 108.4(8) . . ?
C6 N1 C10 117.6(5) . . ?
C6 N1 Cu1 121.9(4) . . ?
C10 N1 Cu1 120.5(4) . . ?
N1 C6 C7 122.8(5) . . ?
N1 C6 H6 118.6 . . ?
C7 C6 H6 118.6 . . ?
C6 C7 C8 119.9(5) . . ?
C6 C7 H7 120.0 . . ?
C8 C7 H7 120.0 . . ?
C7 C8 C9 117.3(5) . . ?
C7 C8 C11 121.5(5) . . ?
C9 C8 C11 121.1(5) . . ?
C10 C9 C8 119.4(6) . . ?
C10 C9 H9 120.3 . . ?
C8 C9 H9 120.3 . . ?
N1 C10 C9 123.0(6) . . ?
N1 C10 H10 118.5 . . ?
C9 C10 H10 118.5 . . ?
C15 C11 C12 117.0(5) . . ?
C15 C11 C8 122.9(5) . . ?
C12 C11 C8 120.0(5) . . ?
C13 C12 C11 119.9(6) . . ?
C13 C12 H12 120.0 . . ?
C11 C12 H12 120.0 . . ?
N2 C13 C12 121.5(6) . . ?
N2 C13 H13 119.2 . . ?
C12 C13 H13 119.2 . . ?
O3 N2 C13 120.7(5) . . ?
O3 N2 C14 119.1(5) . . ?
C13 N2 C14 120.1(5) . . ?
N2 C14 C15 120.7(6) . . ?
N2 C14 H14 119.7 . . ?
C15 C14 H14 119.7 . . ?
C14 C15 C11 120.7(6) . . ?
C14 C15 H15 119.7 . . ?
C11 C15 H15 119.7 . . ?
N2 O3 Eu1 133.6(3) . . ?
F9 C16 F7 108.4(7) . . ?
F9 C16 F8 107.6(7) . . ?
F7 C16 F8 105.5(8) . . ?
F9 C16 C17 114.4(7) . . ?
F7 C16 C17 111.1(6) . . ?
F8 C16 C17 109.4(7) . . ?
O4 C17 C18 128.7(5) . . ?
O4 C17 C16 112.8(6) . . ?
C18 C17 C16 118.5(6) . . ?
C17 O4 Eu1 131.4(4) . . ?
C19 C18 C17 124.8(5) . . ?
C19 C18 H18 117.6 . . ?
C17 C18 H18 117.6 . . ?
O5 C19 C18 128.3(5) . . ?
O5 C19 C20 113.4(5) . . ?
C18 C19 C20 118.4(5) . . ?
C19 O5 Eu1 131.9(3) . . ?
F12 C20 F10 109.2(7) . . ?
F12 C20 F11 107.3(7) . . ?
F10 C20 F11 105.7(7) . . ?
F12 C20 C19 114.8(6) . . ?
F10 C20 C19 111.1(6) . . ?
F11 C20 C19 108.4(6) . . ?
F14 C21 F15 106.0(9) . . ?
F14 C21 F13 103.2(9) . . ?
F15 C21 F13 105.0(9) . . ?
F14 C21 C22 115.8(8) . . ?
F15 C21 C22 112.9(7) . . ?
F13 C21 C22 112.9(7) . . ?
O6 C22 C23 127.5(6) . . ?
O6 C22 C21 114.6(7) . . ?
C23 C22 C21 117.8(7) . . ?
C22 O6 Eu1 132.6(4) . . ?
C24 C23 C22 121.3(6) . . ?
C24 C23 H23 119.4 . . ?
C22 C23 H23 119.4 . . ?
O7 C24 C23 128.9(6) . . ?
O7 C24 C25 114.7(6) . . ?
C23 C24 C25 116.4(6) . . ?
C24 O7 Eu1 130.9(4) . . ?
F18 C25 F16 109.2(8) . . ?
F18 C25 F17 107.4(7) . . ?
F16 C25 F17 105.0(7) . . ?
F18 C25 C24 109.9(6) . . ?
F16 C25 C24 113.5(6) . . ?
F17 C25 C24 111.6(7) . . ?
F21 C26 F20 111.3(9) . . ?
F21 C26 F19 105.3(9) . . ?
F20 C26 F19 104.3(8) . . ?
F21 C26 C27 109.4(7) . . ?
F20 C26 C27 112.3(8) . . ?
F19 C26 C27 114.0(6) . . ?
O8 C27 C28 128.4(6) . . ?
O8 C27 C26 114.4(6) . . ?
C28 C27 C26 117.3(6) . . ?
C27 O8 Eu1 131.7(4) . . ?
C27 C28 C29 121.8(5) . . ?
C27 C28 H28 119.1 . . ?
C29 C28 H28 119.1 . . ?
O9 C29 C28 126.9(6) . . ?
O9 C29 C30 113.9(6) . . ?
C28 C29 C30 119.2(6) . . ?
C29 O9 Eu1 133.7(4) . . ?
F23 C30 F22 107.9(10) . . ?
F23 C30 F24 104.4(8) . . ?
F22 C30 F24 104.8(8) . . ?
F23 C30 C29 111.9(7) . . ?
F22 C30 C29 112.4(6) . . ?
F24 C30 C29 114.9(8) . . ?
N3 O10 Eu1 133.5(3) . . ?
C35 N3 O10 120.3(4) . . ?
C35 N3 C31 120.6(5) . . ?
O10 N3 C31 119.1(5) . . ?
N3 C31 C32 120.0(5) . . ?
N3 C31 H31 120.0 . . ?
C32 C31 H31 120.0 . . ?
C31 C32 C33 121.6(5) . . ?
C31 C32 H32 119.2 . . ?
C33 C32 H32 119.2 . . ?
C34 C33 C32 115.9(5) . . ?
C34 C33 C36 121.2(5) . . ?
C32 C33 C36 122.9(5) . . ?
C35 C34 C33 120.9(5) . . ?
C35 C34 H34 119.5 . . ?
C33 C34 H34 119.5 . . ?
N3 C35 C34 121.0(5) . . ?
N3 C35 H35 119.5 . . ?
C34 C35 H35 119.5 . . ?
C37 C36 C40 116.5(5) . . ?
C37 C36 C33 121.8(5) . . ?
C40 C36 C33 121.7(5) . . ?
C36 C37 C38 119.7(6) . . ?
C36 C37 H37 120.2 . . ?
C38 C37 H37 120.2 . . ?
N4 C38 C37 123.6(6) . . ?
N4 C38 H38 118.2 . . ?
C37 C38 H38 118.2 . . ?
C38 N4 C39 117.0(5) . . ?
C38 N4 Cu2 120.8(4) . . ?
C39 N4 Cu2 122.2(4) . . ?
N4 C39 C40 122.9(6) . . ?
N4 C39 H39 118.6 . . ?
C40 C39 H39 118.6 . . ?
C39 C40 C36 120.3(5) . . ?
C39 C40 H40 119.8 . . ?
C36 C40 H40 119.8 . . ?
F25 C41 F26 110.7(8) . . ?
F25 C41 F27 105.8(9) . . ?
F26 C41 F27 104.7(7) . . ?
F25 C41 C42 111.3(7) . . ?
F26 C41 C42 113.1(8) . . ?
F27 C41 C42 110.8(6) . . ?
O11 C42 C43 128.2(7) . . ?
O11 C42 C41 113.8(7) . . ?
C43 C42 C41 118.0(7) . . ?
C42 O11 Cu2 124.4(5) . . ?
C42 C43 C44 125.4(7) . . ?
C42 C43 H43 117.3 . . ?
C44 C43 H43 117.3 . . ?
O12 C44 C43 128.6(8) . . ?
O12 C44 C45 114.6(8) . . ?
C43 C44 C45 116.8(7) . . ?
C44 O12 Cu2 125.2(5) . . ?
F30 C45 F29 108.4(16) . . ?
F30 C45 F28 105.5(15) . . ?
F29 C45 F28 97.4(14) . . ?
F30 C45 C44 121.3(10) . . ?
F29 C45 C44 113.1(11) . . ?
F28 C45 C44 108.1(13) . . ?

_refine_diff_density_max         2.963
_refine_diff_density_min         -0.687
_refine_diff_density_rms         0.162

