# Supplementary Information (SI) for RSC Advances.
# This journal is © The Royal Society of Chemistry 2024

####################################################################### 
# 
# 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 2380427'
loop_
_audit_author_name
_audit_author_address
'Victor Marcelo Deflon'
;University of Sao Paulo
Brazil
;
_audit_update_record             
;
2024-08-28 deposited with the CCDC.	2024-11-03 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2018/3
_shelx_SHELXL_version_number     2018/3
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C41 H29 Eu F12 N2 O9 S4'
_chemical_formula_weight         1201.86

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'
Eu Eu -0.1578 3.6682 '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'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/c'
_space_group_name_Hall           '-P 2ybc'

_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+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'

_cell_length_a                   10.2374(4)
_cell_length_b                   23.0415(9)
_cell_length_c                   19.8634(8)
_cell_angle_alpha                90
_cell_angle_beta                 104.5740(10)
_cell_angle_gamma                90
_cell_volume                     4534.7(3)
_cell_formula_units_Z            4
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    9604
_cell_measurement_theta_min      2.24
_cell_measurement_theta_max      26.38

_exptl_crystal_description       prism
_exptl_crystal_colour            yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.760
_exptl_crystal_F_000             2384
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.260
_exptl_crystal_size_mid          0.060
_exptl_crystal_size_min          0.030
_exptl_absorpt_coefficient_mu    1.673
_shelx_estimated_absorpt_T_min   0.670
_shelx_estimated_absorpt_T_max   0.952
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.6243
_exptl_absorpt_correction_T_max  0.7454
_exptl_absorpt_process_details   SADABS
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      100(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            59993
_diffrn_reflns_av_unetI/netI     0.0311
_diffrn_reflns_av_R_equivalents  0.0454
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_h_max       8
_diffrn_reflns_limit_k_min       -28
_diffrn_reflns_limit_k_max       28
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_theta_min         1.379
_diffrn_reflns_theta_max         26.412
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measured_fraction_theta_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.999
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.999
_diffrn_reflns_point_group_measured_fraction_full 1.000
_reflns_number_total             9297
_reflns_number_gt                8012
_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 2014/5 (Sheldrick, 2014)'
_computing_structure_refinement  'SHELXL-2018/3 (Sheldrick, 2018)'
_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)+(0.0199P)²+9.2947P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   mixed
_refine_ls_hydrogen_treatment    mixed
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         9297
_refine_ls_number_parameters     614
_refine_ls_number_restraints     6
_refine_ls_R_factor_all          0.0366
_refine_ls_R_factor_gt           0.0289
_refine_ls_wR_factor_ref         0.0645
_refine_ls_wR_factor_gt          0.0616
_refine_ls_goodness_of_fit_ref   1.038
_refine_ls_restrained_S_all      1.040
_refine_ls_shift/su_max          0.003
_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
C1 C 0.3317(3) 0.43233(13) 0.20836(16) 0.0221(7) Uani 1 1 d . . . . .
C2 C 0.3861(3) 0.49470(12) 0.21458(15) 0.0163(6) Uani 1 1 d . . . . .
C3 C 0.4509(3) 0.51322(13) 0.16542(15) 0.0185(6) Uani 1 1 d . . . . .
H3 H 0.459787 0.487651 0.130610 0.022 Uiso 1 1 calc R U . . .
C4 C 0.5043(3) 0.56981(13) 0.16634(15) 0.0174(6) Uani 1 1 d . . . . .
C5 C 0.5812(3) 0.58593(14) 0.11616(15) 0.0206(7) Uani 1 1 d D . . . .
C6A C 0.6563(16) 0.6496(7) 0.1229(8) 0.0478(8) Uani 0.423(3) 1 d D . P A 1
H6A H 0.667348 0.679266 0.155572 0.057 Uiso 0.423(3) 1 calc R U P A 1
S1A S 0.6155(3) 0.54740(11) 0.05439(16) 0.0229(3) Uani 0.423(3) 1 d . . P A 1
C6B C 0.6099(12) 0.5409(6) 0.0635(6) 0.0478(8) Uani 0.577(3) 1 d D . P A 2
H6B H 0.589972 0.501600 0.056833 0.057 Uiso 0.577(3) 1 calc R U P A 2
S1B S 0.6365(2) 0.65094(9) 0.11169(10) 0.0229(3) Uani 0.577(3) 1 d . . P A 2
C7 C 0.7049(4) 0.6413(2) 0.0499(2) 0.0478(8) Uani 1 1 d D . . . .
H7 H 0.740656 0.671472 0.029111 0.057 Uiso 1 1 calc R U . A 1
C8 C 0.6884(4) 0.5874(2) 0.0230(2) 0.0478(8) Uani 1 1 d D . . . .
H8 H 0.723007 0.576754 -0.014224 0.057 Uiso 1 1 calc R U . A 1
C9 C 0.0663(3) 0.56483(14) 0.08387(16) 0.0223(7) Uani 1 1 d . . . . .
C10 C 0.1492(3) 0.61005(12) 0.13348(15) 0.0174(6) Uani 1 1 d . . . . .
C11 C 0.2079(3) 0.65375(13) 0.10447(15) 0.0189(6) Uani 1 1 d . . . . .
H11 H 0.194904 0.654765 0.056432 0.023 Uiso 1 1 calc R U . . .
C12 C 0.2880(3) 0.69763(12) 0.14572(15) 0.0169(6) Uani 1 1 d . . . . .
C13 C 0.3655(3) 0.73828(12) 0.11434(15) 0.0188(6) Uani 1 1 d . . . . .
C14 C 0.3740(4) 0.74387(13) 0.04424(17) 0.0274(4) Uani 1 1 d . . . . .
H14 H 0.320284 0.724208 0.006372 0.033 Uiso 1 1 calc R U . . .
C15 C 0.4770(4) 0.78408(13) 0.04116(17) 0.0274(4) Uani 1 1 d . . . . .
H15 H 0.498475 0.794028 -0.000135 0.033 Uiso 1 1 calc R U . . .
C16 C 0.5418(4) 0.80691(14) 0.10392(17) 0.0274(4) Uani 1 1 d . . . . .
H16 H 0.612085 0.833508 0.109893 0.033 Uiso 1 1 calc R U . . .
C17 C 0.1137(3) 0.60392(15) 0.45274(16) 0.0228(7) Uani 1 1 d . . . . .
C18 C 0.2393(3) 0.59420(12) 0.42572(15) 0.0147(6) Uani 1 1 d . . . . .
C19 C 0.3602(3) 0.58544(12) 0.47442(14) 0.0151(6) Uani 1 1 d . . . . .
H19 H 0.359638 0.583405 0.521116 0.018 Uiso 1 1 calc R U . . .
C20 C 0.4848(3) 0.57941(11) 0.45653(14) 0.0131(6) Uani 1 1 d . . . . .
C21 C 0.6076(3) 0.56776(12) 0.51075(14) 0.0138(6) Uani 1 1 d D . . . .
C22A C 0.6273(4) 0.55213(19) 0.5794(2) 0.0195(4) Uani 0.890(3) 1 d D . P B 1
H22A H 0.556792 0.546534 0.600416 0.023 Uiso 0.890(3) 1 calc R U P B 1
S3A S 0.76078(8) 0.57340(4) 0.48960(4) 0.0186(3) Uani 0.890(3) 1 d . . P B 1
C22B C 0.7425(17) 0.5740(16) 0.5107(13) 0.0195(4) Uani 0.110(3) 1 d D . P B 2
H22B H 0.766536 0.589364 0.472229 0.023 Uiso 0.110(3) 1 calc R U P B 2
S3B S 0.6012(8) 0.5485(4) 0.5906(5) 0.0186(3) Uani 0.110(3) 1 d . . P B 2
C23 C 0.7644(3) 0.54532(13) 0.61501(16) 0.0195(4) Uani 1 1 d D . . . .
H23 H 0.794737 0.534787 0.661531 0.023 Uiso 1 1 calc R U . B 1
C24 C 0.8458(3) 0.55626(13) 0.57199(15) 0.0195(4) Uani 1 1 d D . . . .
H24 H 0.939450 0.554511 0.586409 0.023 Uiso 1 1 calc R U . B 1
C25 C 0.7423(3) 0.74810(13) 0.36617(18) 0.0240(7) Uani 1 1 d . . . . .
C26 C 0.5941(3) 0.73061(12) 0.35275(14) 0.0141(6) Uani 1 1 d . . . . .
C27 C 0.5064(3) 0.77048(12) 0.36803(15) 0.0166(6) Uani 1 1 d . . . . .
H27 H 0.539514 0.807129 0.382925 0.020 Uiso 1 1 calc R U . . .
C28 C 0.3673(3) 0.75881(12) 0.36231(14) 0.0141(6) Uani 1 1 d . . . . .
C29 C 0.2803(3) 0.80613(12) 0.37516(14) 0.0150(6) Uani 1 1 d D . . . .
C30A C 0.3089(13) 0.8646(6) 0.3952(8) 0.0235(6) Uani 0.346(3) 1 d D . P C 1
H30A H 0.393140 0.881795 0.400772 0.028 Uiso 0.346(3) 1 calc R U P C 1
S4A S 0.1143(3) 0.79222(12) 0.36746(19) 0.0215(3) Uani 0.346(3) 1 d . . P C 1
C30B C 0.1429(7) 0.8026(3) 0.3691(4) 0.0235(6) Uani 0.654(3) 1 d D . P C 2
H30B H 0.091537 0.769715 0.353649 0.028 Uiso 0.654(3) 1 calc R U P C 2
S4B S 0.33850(13) 0.87432(7) 0.40250(10) 0.0215(3) Uani 0.654(3) 1 d . . P C 2
C32 C 0.0874(3) 0.85612(14) 0.38970(16) 0.0235(6) Uani 1 1 d D . . . .
H32 H 0.000475 0.866718 0.391132 0.028 Uiso 1 1 calc R U . C 1
C31 C 0.1873(3) 0.89554(14) 0.40659(17) 0.0268(7) Uani 1 1 d D . . . .
H31 H 0.182156 0.933429 0.421863 0.032 Uiso 1 1 calc R U . C 1
C33 C -0.1288(3) 0.62076(14) 0.27179(16) 0.0227(7) Uani 1 1 d . . . . .
H33 H -0.108972 0.659697 0.266989 0.027 Uiso 1 1 calc R U . . .
C34 C -0.2241(3) 0.54067(13) 0.29848(15) 0.0175(6) Uani 1 1 d . . . . .
C35 C -0.1220(3) 0.52512(14) 0.26684(15) 0.0201(6) Uani 1 1 d . . . . .
C36 C -0.0941(3) 0.46736(15) 0.25614(16) 0.0256(7) Uani 1 1 d . . . . .
H36 H -0.026624 0.456874 0.234720 0.031 Uiso 1 1 calc R U . . .
C37 C -0.1711(3) 0.42642(14) 0.27870(17) 0.0282(8) Uani 1 1 d . . . . .
H37 H -0.155447 0.387300 0.272226 0.034 Uiso 1 1 calc R U . . .
C38 C -0.2724(3) 0.44207(14) 0.31113(17) 0.0255(7) Uani 1 1 d . . . . .
H38 H -0.322000 0.413062 0.325831 0.031 Uiso 1 1 calc R U . . .
C39 C -0.3006(3) 0.49926(13) 0.32191(16) 0.0198(6) Uani 1 1 d . . . . .
H39 H -0.367541 0.509590 0.343786 0.024 Uiso 1 1 calc R U . . .
C40 C -0.0208(5) 0.7841(2) 0.1126(3) 0.0635(14) Uani 1 1 d . . . . .
H40A H 0.073892 0.792452 0.121760 0.095 Uiso 1 1 calc R U . . .
H40B H -0.071557 0.816935 0.090307 0.095 Uiso 1 1 calc R U . . .
H40C H -0.041712 0.750842 0.082810 0.095 Uiso 1 1 calc R U . . .
C41 C -0.0565(4) 0.77210(16) 0.1789(2) 0.0424(10) Uani 1 1 d . . . . .
H41A H -0.027705 0.804594 0.210174 0.051 Uiso 1 1 calc R U . . .
H41B H -0.153835 0.769154 0.169952 0.051 Uiso 1 1 calc R U . . .
Eu1 Eu 0.36078(2) 0.62399(2) 0.29130(2) 0.01132(4) Uani 1 1 d . . . . .
N2 N -0.2244(3) 0.60128(12) 0.30011(14) 0.0193(5) Uani 1 1 d . . . . .
N1 N -0.0659(3) 0.57669(12) 0.25141(14) 0.0226(6) Uani 1 1 d . . . . .
O1 O 0.3649(2) 0.52160(8) 0.26623(10) 0.0159(4) Uani 1 1 d . . . . .
O2 O 0.4902(2) 0.60885(8) 0.20915(10) 0.0173(4) Uani 1 1 d . . . . .
O3 O 0.16080(19) 0.59951(9) 0.19819(10) 0.0169(4) Uani 1 1 d . . . . .
O4 O 0.2999(2) 0.70239(8) 0.21039(10) 0.0178(4) Uani 1 1 d . . . . .
O5 O 0.21563(19) 0.59674(8) 0.36014(10) 0.0148(4) Uani 1 1 d . . . . .
O6 O 0.49760(19) 0.58481(8) 0.39492(10) 0.0157(4) Uani 1 1 d . . . . .
O7 O 0.57081(19) 0.67962(8) 0.32721(10) 0.0159(4) Uani 1 1 d . . . . .
O8 O 0.31424(19) 0.70949(8) 0.34888(10) 0.0148(4) Uani 1 1 d . . . . .
O9 O 0.0026(3) 0.72031(11) 0.21243(15) 0.0382(6) Uani 1 1 d . . . . .
F1 F 0.1984(2) 0.43179(8) 0.20141(11) 0.0369(5) Uani 1 1 d . . . . .
F2 F 0.3533(2) 0.40331(9) 0.15386(11) 0.0417(5) Uani 1 1 d . . . . .
F3 F 0.3868(2) 0.40113(8) 0.26490(10) 0.0363(5) Uani 1 1 d . . . . .
F4 F -0.0259(2) 0.53935(9) 0.11082(9) 0.0337(5) Uani 1 1 d . . . . .
F5 F 0.1447(2) 0.52287(10) 0.06919(12) 0.0481(6) Uani 1 1 d . . . . .
F6 F -0.00015(19) 0.58770(9) 0.02276(9) 0.0306(5) Uani 1 1 d . . . . .
F7 F 0.01262(18) 0.56868(9) 0.42133(10) 0.0349(5) Uani 1 1 d . . . . .
F8 F 0.13273(19) 0.59525(11) 0.52113(10) 0.0404(5) Uani 1 1 d . . . . .
F9 F 0.0687(2) 0.65795(9) 0.43986(13) 0.0466(6) Uani 1 1 d . . . . .
F10 F 0.8216(2) 0.70775(9) 0.40154(16) 0.0649(8) Uani 1 1 d . . . . .
F11 F 0.77462(19) 0.79712(8) 0.40118(12) 0.0384(5) Uani 1 1 d . . . . .
F12 F 0.7790(2) 0.75393(14) 0.30683(14) 0.0707(9) Uani 1 1 d . . . . .
S2 S 0.48014(9) 0.78153(4) 0.17006(4) 0.02781(19) Uani 1 1 d . . . . .
H9A H 0.082(4) 0.7250(18) 0.214(2) 0.044(13) Uiso 1 1 d . . . . .
H1A H 0.001(4) 0.5789(15) 0.2352(17) 0.022(9) Uiso 1 1 d . . . . .
H2A H -0.279(4) 0.6229(15) 0.3113(18) 0.026(10) 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
C1 F3 1.333(4) . ?
C1 F1 1.337(4) . ?
C1 F2 1.337(3) . ?
C1 C2 1.535(4) . ?
C2 O1 1.263(3) . ?
C2 C3 1.379(4) . ?
C3 C4 1.412(4) . ?
C3 H3 0.9300 . ?
C4 O2 1.271(3) . ?
C4 C5 1.465(4) . ?
C5 C6B 1.553(13) . ?
C5 S1B 1.611(4) . ?
C5 S1A 1.623(4) . ?
C5 C6A 1.645(16) . ?
C6A C7 1.659(16) . ?
C6A H6A 0.9300 . ?
S1A C8 1.424(5) . ?
C6B C8 1.663(12) . ?
C6B H6B 0.9300 . ?
S1B C7 1.575(5) . ?
C7 C8 1.345(7) . ?
C7 H7 0.9300 . ?
C8 H8 0.9300 . ?
C9 F4 1.333(4) . ?
C9 F5 1.335(4) . ?
C9 F6 1.341(4) . ?
C9 C10 1.535(4) . ?
C10 O3 1.284(3) . ?
C10 C11 1.371(4) . ?
C11 C12 1.424(4) . ?
C11 H11 0.9300 . ?
C12 O4 1.264(3) . ?
C12 C13 1.464(4) . ?
C13 C14 1.423(4) . ?
C13 S2 1.715(3) . ?
C14 C15 1.417(5) . ?
C14 H14 0.9300 . ?
C15 C16 1.362(5) . ?
C15 H15 0.9300 . ?
C16 S2 1.698(3) . ?
C16 H16 0.9300 . ?
C17 F9 1.330(4) . ?
C17 F8 1.338(3) . ?
C17 F7 1.340(4) . ?
C17 C18 1.529(4) . ?
C18 O5 1.265(3) . ?
C18 C19 1.380(4) . ?
C19 C20 1.415(4) . ?
C19 H19 0.9300 . ?
C20 O6 1.269(3) . ?
C20 C21 1.460(4) . ?
C21 C22A 1.375(5) . ?
C21 C22B 1.389(18) . ?
C21 S3B 1.664(9) . ?
C21 S3A 1.728(3) . ?
C22A C23 1.412(5) . ?
C22A H22A 0.9300 . ?
S3A C24 1.696(3) . ?
C22B C24 1.455(18) . ?
C22B H22B 0.9300 . ?
S3B C23 1.620(9) . ?
C23 C24 1.359(4) . ?
C23 H23 0.9300 . ?
C24 H24 0.9300 . ?
C25 F10 1.315(4) . ?
C25 F11 1.324(4) . ?
C25 F12 1.331(4) . ?
C25 C26 1.527(4) . ?
C26 O7 1.278(3) . ?
C26 C27 1.370(4) . ?
C27 C28 1.425(4) . ?
C27 H27 0.9300 . ?
C28 O8 1.259(3) . ?
C28 C29 1.471(4) . ?
C29 C30B 1.384(7) . ?
C29 C30A 1.414(13) . ?
C29 S4A 1.698(4) . ?
C29 S4B 1.719(3) . ?
C30A C31 1.500(12) . ?
C30A H30A 0.9300 . ?
S4A C32 1.581(4) . ?
C30B C32 1.458(7) . ?
C30B H30B 0.9300 . ?
S4B C31 1.645(4) . ?
C32 C31 1.346(5) . ?
C32 H32 0.9300 . ?
C31 H31 0.9300 . ?
C33 N1 1.320(4) . ?
C33 N2 1.324(4) . ?
C33 H33 0.9300 . ?
C34 C39 1.387(4) . ?
C34 C35 1.395(4) . ?
C34 N2 1.397(4) . ?
C35 N1 1.387(4) . ?
C35 C36 1.389(4) . ?
C36 C37 1.375(5) . ?
C36 H36 0.9300 . ?
C37 C38 1.399(5) . ?
C37 H37 0.9300 . ?
C38 C39 1.377(4) . ?
C38 H38 0.9300 . ?
C39 H39 0.9300 . ?
C40 C41 1.478(6) . ?
C40 H40A 0.9600 . ?
C40 H40B 0.9600 . ?
C40 H40C 0.9600 . ?
C41 O9 1.425(4) . ?
C41 H41A 0.9700 . ?
C41 H41B 0.9700 . ?
Eu1 O5 2.3440(19) . ?
Eu1 O6 2.3585(19) . ?
Eu1 O2 2.3722(19) . ?
Eu1 O8 2.3855(19) . ?
Eu1 O4 2.3939(19) . ?
Eu1 O1 2.4136(19) . ?
Eu1 O7 2.4502(19) . ?
Eu1 O3 2.4545(19) . ?
N2 H2A 0.82(4) . ?
N1 H1A 0.83(4) . ?
O9 H9A 0.82(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
F3 C1 F1 106.7(3) . . ?
F3 C1 F2 106.9(3) . . ?
F1 C1 F2 106.5(3) . . ?
F3 C1 C2 111.7(2) . . ?
F1 C1 C2 110.9(2) . . ?
F2 C1 C2 113.8(3) . . ?
O1 C2 C3 129.4(3) . . ?
O1 C2 C1 113.1(3) . . ?
C3 C2 C1 117.5(3) . . ?
C2 C3 C4 122.0(3) . . ?
C2 C3 H3 119.0 . . ?
C4 C3 H3 119.0 . . ?
O2 C4 C3 123.6(3) . . ?
O2 C4 C5 116.5(3) . . ?
C3 C4 C5 119.9(3) . . ?
C4 C5 C6B 120.9(5) . . ?
C4 C5 S1B 122.0(2) . . ?
C6B C5 S1B 117.1(5) . . ?
C4 C5 S1A 129.1(3) . . ?
C4 C5 C6A 119.4(6) . . ?
S1A C5 C6A 111.3(6) . . ?
C5 C6A C7 93.6(8) . . ?
C5 C6A H6A 133.2 . . ?
C7 C6A H6A 133.2 . . ?
C8 S1A C5 102.3(3) . . ?
C5 C6B C8 95.2(7) . . ?
C5 C6B H6B 132.4 . . ?
C8 C6B H6B 132.4 . . ?
C7 S1B C5 98.2(2) . . ?
C8 C7 S1B 113.8(4) . . ?
C8 C7 C6A 114.7(7) . . ?
C8 C7 H7 122.6 . . ?
C6A C7 H7 122.6 . . ?
C7 C8 S1A 116.8(4) . . ?
C7 C8 C6B 115.5(6) . . ?
C7 C8 H8 121.6 . . ?
S1A C8 H8 121.6 . . ?
F4 C9 F5 107.1(3) . . ?
F4 C9 F6 106.7(2) . . ?
F5 C9 F6 106.4(3) . . ?
F4 C9 C10 112.0(2) . . ?
F5 C9 C10 111.5(2) . . ?
F6 C9 C10 112.8(3) . . ?
O3 C10 C11 128.3(3) . . ?
O3 C10 C9 114.3(3) . . ?
C11 C10 C9 117.3(3) . . ?
C10 C11 C12 121.9(3) . . ?
C10 C11 H11 119.0 . . ?
C12 C11 H11 119.0 . . ?
O4 C12 C11 122.7(3) . . ?
O4 C12 C13 116.9(3) . . ?
C11 C12 C13 120.3(3) . . ?
C14 C13 C12 130.4(3) . . ?
C14 C13 S2 112.2(2) . . ?
C12 C13 S2 116.9(2) . . ?
C15 C14 C13 109.3(3) . . ?
C15 C14 H14 125.3 . . ?
C13 C14 H14 125.3 . . ?
C16 C15 C14 114.2(3) . . ?
C16 C15 H15 122.9 . . ?
C14 C15 H15 122.9 . . ?
C15 C16 S2 112.6(3) . . ?
C15 C16 H16 123.7 . . ?
S2 C16 H16 123.7 . . ?
F9 C17 F8 106.9(3) . . ?
F9 C17 F7 106.7(2) . . ?
F8 C17 F7 106.3(3) . . ?
F9 C17 C18 110.5(3) . . ?
F8 C17 C18 114.5(2) . . ?
F7 C17 C18 111.5(3) . . ?
O5 C18 C19 129.4(3) . . ?
O5 C18 C17 113.2(2) . . ?
C19 C18 C17 117.4(3) . . ?
C18 C19 C20 123.0(3) . . ?
C18 C19 H19 118.5 . . ?
C20 C19 H19 118.5 . . ?
O6 C20 C19 123.4(3) . . ?
O6 C20 C21 116.8(2) . . ?
C19 C20 C21 119.8(2) . . ?
C22A C21 C20 131.6(3) . . ?
C22B C21 C20 130.7(9) . . ?
C22B C21 S3B 107.8(10) . . ?
C20 C21 S3B 121.3(4) . . ?
C22A C21 S3A 110.2(3) . . ?
C20 C21 S3A 118.2(2) . . ?
C21 C22A C23 113.9(4) . . ?
C21 C22A H22A 123.0 . . ?
C23 C22A H22A 123.0 . . ?
C24 S3A C21 91.41(14) . . ?
C21 C22B C24 118.9(16) . . ?
C21 C22B H22B 120.5 . . ?
C24 C22B H22B 120.5 . . ?
C23 S3B C21 90.7(4) . . ?
C24 C23 C22A 110.7(3) . . ?
C24 C23 S3B 123.6(4) . . ?
C24 C23 H23 124.7 . . ?
C22A C23 H23 124.7 . . ?
C23 C24 C22B 98.4(9) . . ?
C23 C24 S3A 113.8(2) . . ?
C23 C24 H24 123.1 . . ?
S3A C24 H24 123.1 . . ?
F10 C25 F11 106.4(3) . . ?
F10 C25 F12 105.7(3) . . ?
F11 C25 F12 106.8(3) . . ?
F10 C25 C26 111.1(3) . . ?
F11 C25 C26 115.0(3) . . ?
F12 C25 C26 111.2(3) . . ?
O7 C26 C27 129.6(3) . . ?
O7 C26 C25 112.9(2) . . ?
C27 C26 C25 117.5(3) . . ?
C26 C27 C28 123.5(3) . . ?
C26 C27 H27 118.2 . . ?
C28 C27 H27 118.2 . . ?
O8 C28 C27 123.8(3) . . ?
O8 C28 C29 117.2(2) . . ?
C27 C28 C29 118.9(3) . . ?
C30B C29 C28 126.1(4) . . ?
C30A C29 C28 131.6(6) . . ?
C30A C29 S4A 109.7(6) . . ?
C28 C29 S4A 118.7(2) . . ?
C30B C29 S4B 110.2(3) . . ?
C28 C29 S4B 123.7(2) . . ?
C29 C30A C31 112.0(9) . . ?
C29 C30A H30A 124.0 . . ?
C31 C30A H30A 124.0 . . ?
C32 S4A C29 92.3(2) . . ?
C29 C30B C32 112.7(5) . . ?
C29 C30B H30B 123.7 . . ?
C32 C30B H30B 123.7 . . ?
C31 S4B C29 91.81(16) . . ?
C31 C32 C30B 108.4(4) . . ?
C31 C32 S4A 121.6(3) . . ?
C31 C32 H32 119.2 . . ?
S4A C32 H32 119.2 . . ?
C32 C31 C30A 104.4(6) . . ?
C32 C31 S4B 116.9(3) . . ?
C32 C31 H31 127.8 . . ?
C30A C31 H31 127.8 . . ?
N1 C33 N2 109.8(3) . . ?
N1 C33 H33 125.1 . . ?
N2 C33 H33 125.1 . . ?
C39 C34 C35 121.7(3) . . ?
C39 C34 N2 132.5(3) . . ?
C35 C34 N2 105.9(3) . . ?
N1 C35 C36 132.4(3) . . ?
N1 C35 C34 106.2(3) . . ?
C36 C35 C34 121.4(3) . . ?
C37 C36 C35 116.8(3) . . ?
C37 C36 H36 121.6 . . ?
C35 C36 H36 121.6 . . ?
C36 C37 C38 121.7(3) . . ?
C36 C37 H37 119.2 . . ?
C38 C37 H37 119.2 . . ?
C39 C38 C37 121.8(3) . . ?
C39 C38 H38 119.1 . . ?
C37 C38 H38 119.1 . . ?
C38 C39 C34 116.6(3) . . ?
C38 C39 H39 121.7 . . ?
C34 C39 H39 121.7 . . ?
C41 C40 H40A 109.5 . . ?
C41 C40 H40B 109.5 . . ?
H40A C40 H40B 109.5 . . ?
C41 C40 H40C 109.5 . . ?
H40A C40 H40C 109.5 . . ?
H40B C40 H40C 109.5 . . ?
O9 C41 C40 113.8(3) . . ?
O9 C41 H41A 108.8 . . ?
C40 C41 H41A 108.8 . . ?
O9 C41 H41B 108.8 . . ?
C40 C41 H41B 108.8 . . ?
H41A C41 H41B 107.7 . . ?
O5 Eu1 O6 73.31(7) . . ?
O5 Eu1 O2 155.18(7) . . ?
O6 Eu1 O2 103.43(7) . . ?
O5 Eu1 O8 73.09(7) . . ?
O6 Eu1 O8 92.53(7) . . ?
O2 Eu1 O8 131.66(7) . . ?
O5 Eu1 O4 119.84(7) . . ?
O6 Eu1 O4 150.68(7) . . ?
O2 Eu1 O4 75.24(7) . . ?
O8 Eu1 O4 69.44(7) . . ?
O5 Eu1 O1 84.56(7) . . ?
O6 Eu1 O1 76.62(7) . . ?
O2 Eu1 O1 70.88(7) . . ?
O8 Eu1 O1 157.24(7) . . ?
O4 Eu1 O1 127.89(6) . . ?
O5 Eu1 O7 127.52(6) . . ?
O6 Eu1 O7 70.20(7) . . ?
O2 Eu1 O7 71.10(7) . . ?
O8 Eu1 O7 72.23(6) . . ?
O4 Eu1 O7 82.06(7) . . ?
O1 Eu1 O7 120.78(7) . . ?
O5 Eu1 O3 81.20(6) . . ?
O6 Eu1 O3 140.29(7) . . ?
O2 Eu1 O3 87.25(7) . . ?
O8 Eu1 O3 108.76(7) . . ?
O4 Eu1 O3 68.93(7) . . ?
O1 Eu1 O3 71.01(7) . . ?
O7 Eu1 O3 147.56(7) . . ?
C33 N2 C34 108.8(3) . . ?
C33 N2 H2A 122(3) . . ?
C34 N2 H2A 128(3) . . ?
C33 N1 C35 109.3(3) . . ?
C33 N1 H1A 126(2) . . ?
C35 N1 H1A 124(2) . . ?
C2 O1 Eu1 131.51(18) . . ?
C4 O2 Eu1 137.87(19) . . ?
C10 O3 Eu1 124.07(18) . . ?
C12 O4 Eu1 123.98(17) . . ?
C18 O5 Eu1 128.88(17) . . ?
C20 O6 Eu1 134.13(17) . . ?
C26 O7 Eu1 131.20(18) . . ?
C28 O8 Eu1 136.01(18) . . ?
C41 O9 H9A 102(3) . . ?
C16 S2 C13 91.60(16) . . ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
_geom_hbond_publ_flag
C16 H16 S3B^b 0.93 2.74 3.409(11) 129.2 4_575 yes
C33 H33 O9 0.93 2.25 3.043(4) 143.1 . yes
C36 H36 F1 0.93 2.62 3.530(4) 167.4 . yes
C39 H39 O6 0.93 2.58 3.430(4) 152.5 1_455 yes
O9 H9A O4 0.82(4) 2.31(4) 3.082(3) 159(4) . yes
N1 H1A O3 0.83(4) 2.01(4) 2.831(3) 170(3) . yes
N1 H1A F4 0.83(4) 2.58(3) 3.047(3) 117(3) . yes
N2 H2A O7 0.82(4) 2.10(4) 2.917(3) 173(3) 1_455 yes
C16 H16 S3B^b 0.93 2.74 3.409(11) 129.2 4_575 yes
C33 H33 O9 0.93 2.25 3.043(4) 143.1 . yes
C36 H36 F1 0.93 2.62 3.530(4) 167.4 . yes
C39 H39 O6 0.93 2.58 3.430(4) 152.5 1_455 yes
O9 H9A O4 0.82(4) 2.31(4) 3.082(3) 159(4) . yes
N1 H1A O3 0.83(4) 2.01(4) 2.831(3) 170(3) . yes
N1 H1A F4 0.83(4) 2.58(3) 3.047(3) 117(3) . yes
N2 H2A O7 0.82(4) 2.10(4) 2.917(3) 173(3) 1_455 yes

_refine_diff_density_max         1.032
_refine_diff_density_min         -0.856
_refine_diff_density_rms         0.085



