# Electronic Supplementary Material (ESI) for ChemComm.
# 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_hirai-1
_audit_block_doi                 10.5517/cc13tmr9
_database_code_depnum_ccdc_archive 'CCDC 1037531'
loop_
_citation_id
_citation_doi
_citation_year
1 10.1021/acs.inorgchem.5b00145 2015
_audit_update_record             
;
2015-01-21 deposited with the CCDC.
2018-08-28 downloaded from the CCDC.
;

#==============================================================================
# CHEMICAL DATA

_chemical_formula_sum            'C49 H27 Eu F18 O8 P2'
_chemical_formula_moiety         'C49 H27 Eu F18 O8 P2'
_chemical_formula_weight         1299.63
_chemical_melting_point          ?

#==============================================================================
# CRYSTAL DATA
_space_group_crystal_system      monoclinic
_space_group_name_H-M_alt        'P 1 21/c 1'
_space_group_name_Hall           '-P 2ybc'
_space_group_IT_number           14
loop_
_symmetry_equiv_pos_site_id
_space_group_symop_operation_xyz
1 +X,+Y,+Z
2 -X,1/2+Y,1/2-Z
3 -X,-Y,-Z
4 +X,1/2-Y,1/2+Z
#------------------------------------------------------------------------------
_cell_length_a                   23.1941(10)
_cell_length_b                   13.4114(5)
_cell_length_c                   16.7226(6)
_cell_angle_alpha                90.0000
_cell_angle_beta                 91.6148(10)
_cell_angle_gamma                90.0000
_cell_volume                     5199.8(4)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    28709
_cell_measurement_theta_min      3.02
_cell_measurement_theta_max      27.49
_cell_measurement_temperature    123
#------------------------------------------------------------------------------
_exptl_crystal_description       block
_exptl_crystal_colour            yellow
_exptl_crystal_size_max          0.400
_exptl_crystal_size_mid          0.139
_exptl_crystal_size_min          0.094
_exptl_crystal_density_diffrn    1.660
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2560.00
_exptl_absorpt_coefficient_mu    1.381
_exptl_absorpt_correction_type   none

#==============================================================================
# EXPERIMENTAL DATA

_diffrn_ambient_temperature      123
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71075
_diffrn_measurement_device_type  'Rigaku R-AXIS RAPID'
_diffrn_measurement_method       ω
_diffrn_detector_area_resol_mean 10.000
_diffrn_reflns_number            49124
_diffrn_reflns_av_R_equivalents  0.0484
_diffrn_reflns_theta_max         27.484
_diffrn_reflns_theta_min         3.023
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measured_fraction_theta_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.995
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.995
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_limit_h_min       -30
_diffrn_reflns_limit_h_max       30
_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_standards_number         0
_diffrn_standards_interval_count .
_diffrn_standards_decay_%        ?

#==============================================================================
# REFINEMENT DATA

_refine_special_details          
;
    Refinement was performed using all reflections. The weighted 
    R-factor (wR) and goodness of fit (S) are based on F².
    R-factor (gt) are based on F. The threshold expression of
    F² > 2.0 sigma(F²) is used only for calculating R-factor (gt).
;
_reflns_number_total             11871
_reflns_number_gt                10422
_reflns_threshold_expression     F²>2.0σ(F²)
_refine_ls_structure_factor_coef Fsqd
_refine_ls_R_factor_all          0.0484
_refine_ls_R_factor_gt           0.0420
_refine_ls_wR_factor_ref         0.0998
_refine_ls_wR_factor_gt          0.0989
_refine_ls_number_restraints     0
_refine_ls_hydrogen_treatment    constr
_refine_ls_number_reflns         11871
_refine_ls_number_parameters     715
_refine_ls_goodness_of_fit_ref   2.865
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w = 1/[σ²(Fo²)+(0.0000P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_refine_ls_shift/su_max          0.001
_refine_diff_density_max         1.79
_refine_diff_density_min         -0.98
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?

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 for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
H H 0.0000 0.0000
;
International Tables for Crystallography
(Vol. C, Table 6.1.1.4)
;
Eu Eu -0.1578 3.6682
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
F F 0.0171 0.0103
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
O O 0.0106 0.0060
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
P P 0.1023 0.0942
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;

#==============================================================================
# ATOMIC COORDINATES AND THERMAL PARAMETERS

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_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Eu1 Eu 0.25055(2) 0.51636(2) 0.25765(2) 0.02356(6) Uani 1 4 d . . .
P2 P 0.10527(3) 0.45042(7) 0.31341(5) 0.02513(18) Uani 1 4 d . . .
P5 P 0.37721(3) 0.67923(6) 0.23285(5) 0.02497(19) Uani 1 4 d . . .
F34 F 0.17756(13) 0.8709(2) 0.28266(19) 0.0757(9) Uani 1 4 d . . .
F35 F 0.12176(15) 0.8777(2) 0.17995(17) 0.0953(12) Uani 1 4 d . . .
F36 F 0.09924(13) 0.7924(2) 0.2810(2) 0.0957(12) Uani 1 4 d . . .
F37 F 0.17553(14) 0.6996(2) -0.04146(15) 0.0802(9) Uani 1 4 d . . .
F38 F 0.25265(11) 0.6127(3) -0.03205(15) 0.0772(9) Uani 1 4 d . . .
F39 F 0.17069(13) 0.5443(2) -0.02919(16) 0.0754(9) Uani 1 4 d . . .
F63 F 0.42653(12) 0.3744(2) 0.1204(2) 0.0987(13) Uani 1 4 d . . .
F64 F 0.42911(13) 0.3300(4) 0.2424(2) 0.1261(17) Uani 1 4 d . . .
F65 F 0.41162(11) 0.2251(2) 0.1520(2) 0.0818(10) Uani 1 4 d . . .
F66 F 0.21301(18) 0.1487(4) 0.0946(3) 0.191(3) Uani 1 4 d . . .
F67 F 0.1833(3) 0.1525(4) 0.2060(3) 0.176(3) Uani 1 4 d . . .
F68 F 0.14662(18) 0.2355(3) 0.1265(4) 0.173(3) Uani 1 4 d . . .
F69 F 0.3617(2) 0.2300(3) 0.3721(3) 0.154(2) Uani 1 4 d . . .
F70 F 0.28408(18) 0.1982(3) 0.4232(5) 0.269(5) Uani 1 4 d . . .
F71 F 0.35667(18) 0.2465(3) 0.4879(2) 0.1156(14) Uani 1 4 d . . .
F72 F 0.3521(2) 0.5859(5) 0.5668(3) 0.194(3) Uani 1 4 d . . .
F73 F 0.2696(2) 0.6234(6) 0.5564(4) 0.226(4) Uani 1 4 d . . .
F74 F 0.3272(4) 0.6915(4) 0.4940(3) 0.266(5) Uani 1 4 d . . .
O4 O 0.31646(9) 0.64222(17) 0.23225(15) 0.0305(5) Uani 1 4 d . . .
O6 O 0.27911(10) 0.57239(18) 0.38813(14) 0.0340(6) Uani 1 4 d . . .
O7 O 0.32982(10) 0.43403(18) 0.19880(16) 0.0360(6) Uani 1 4 d . . .
O8 O 0.28107(11) 0.37616(19) 0.33883(16) 0.0391(6) Uani 1 4 d . . .
O9 O 0.21378(10) 0.36700(18) 0.19356(14) 0.0333(6) Uani 1 4 d . . .
O10 O 0.16636(10) 0.48253(17) 0.32562(15) 0.0301(5) Uani 1 4 d . . .
O11 O 0.22462(10) 0.55821(19) 0.12199(14) 0.0340(6) Uani 1 4 d . . .
O12 O 0.19248(10) 0.66750(17) 0.25604(15) 0.0328(6) Uani 1 4 d . . .
C13 C 0.33751(15) 0.3448(3) 0.1798(2) 0.0345(8) Uani 1 4 d . . .
C14 C 0.29662(16) 0.2714(3) 0.1656(2) 0.0395(9) Uani 1 4 d . . .
C15 C 0.23792(16) 0.2900(3) 0.1712(2) 0.0370(9) Uani 1 4 d . . .
C16 C 0.40182(19) 0.3182(4) 0.1737(3) 0.0549(12) Uani 1 4 d . . .
C17 C 0.1974(2) 0.2056(4) 0.1460(4) 0.0659(16) Uani 1 4 d . . .
C18 C 0.46238(18) 0.6108(3) -0.0026(3) 0.0462(11) Uani 1 4 d . . .
C19 C 0.49725(16) 0.6321(3) 0.0619(3) 0.0419(10) Uani 1 4 d . . .
C20 C 0.47294(14) 0.6529(3) 0.1364(2) 0.0353(9) Uani 1 4 d . . .
C21 C 0.41258(14) 0.6504(2) 0.1418(2) 0.0267(7) Uani 1 4 d . . .
C22 C 0.37827(16) 0.6273(3) 0.0758(2) 0.0394(9) Uani 1 4 d . . .
C23 C 0.40314(18) 0.6072(3) 0.0024(2) 0.0465(10) Uani 1 4 d . . .
C24 C 0.20123(14) 0.6310(3) 0.0865(2) 0.0325(8) Uani 1 4 d . . .
C25 C 0.17582(15) 0.7137(3) 0.1212(2) 0.0345(8) Uani 1 4 d . . .
C26 C 0.17376(14) 0.7252(3) 0.2038(2) 0.0323(8) Uani 1 4 d . . .
C27 C 0.20081(17) 0.6229(3) -0.0050(2) 0.0418(9) Uani 1 4 d . . .
C28 C 0.14271(18) 0.8172(3) 0.2363(3) 0.0471(10) Uani 1 4 d . . .
C29 C 0.30433(17) 0.3641(3) 0.4057(2) 0.0425(10) Uani 1 4 d . . .
C30 C 0.31594(18) 0.4371(3) 0.4636(2) 0.0495(11) Uani 1 4 d . . .
C31 C 0.30099(17) 0.5344(3) 0.4501(2) 0.0419(10) Uani 1 4 d . . .
C32 C 0.41944(15) 0.6264(3) 0.3095(2) 0.0336(8) Uani 1 4 d . . .
C33 C 0.44434(15) 0.5891(3) 0.3654(2) 0.0336(8) Uani 1 4 d . . .
C40 C 0.08388(16) 0.5948(3) 0.4249(2) 0.0387(9) Uani 1 4 d . . .
C41 C 0.04799(18) 0.6523(3) 0.4712(3) 0.0481(10) Uani 1 4 d . . .
C42 C -0.01137(18) 0.6422(3) 0.4661(3) 0.0460(11) Uani 1 4 d . . .
C43 C 0.05897(14) 0.5255(2) 0.3733(2) 0.0272(7) Uani 1 4 d . . .
C44 C -0.00088(15) 0.5143(3) 0.3672(3) 0.0392(9) Uani 1 4 d . . .
C45 C -0.03585(16) 0.5734(3) 0.4139(3) 0.0456(11) Uani 1 4 d . . .
C46 C 0.13384(19) 0.1773(3) 0.4070(3) 0.0601(13) Uani 1 4 d . . .
C47 C 0.13666(16) 0.2791(3) 0.3890(3) 0.0449(10) Uani 1 4 d . . .
C48 C 0.09697(14) 0.3204(3) 0.3348(2) 0.0290(8) Uani 1 4 d . . .
C49 C 0.09153(19) 0.1201(3) 0.3706(3) 0.0597(13) Uani 1 4 d . . .
C50 C 0.05415(18) 0.2630(3) 0.2997(3) 0.0447(10) Uani 1 4 d . . .
C51 C 0.0515(2) 0.1612(3) 0.3174(3) 0.0576(13) Uani 1 4 d . . .
C52 C 0.3764(2) 1.0149(3) 0.2743(3) 0.0585(13) Uani 1 4 d . . .
C53 C 0.4258(2) 0.9698(3) 0.2502(4) 0.0750(19) Uani 1 4 d . . .
C54 C 0.42674(19) 0.8678(3) 0.2377(3) 0.0584(14) Uani 1 4 d . . .
C55 C 0.37837(14) 0.8113(2) 0.2497(2) 0.0276(7) Uani 1 4 d . . .
C56 C 0.32877(17) 0.8572(3) 0.2754(3) 0.0443(10) Uani 1 4 d . . .
C57 C 0.3281(2) 0.9592(3) 0.2880(3) 0.0558(12) Uani 1 4 d . . .
C58 C 0.05702(15) 0.4746(3) 0.1503(2) 0.0325(8) Uani 1 4 d . . .
C59 C 0.07820(15) 0.4640(3) 0.2154(2) 0.0326(8) Uani 1 4 d . . .
C60 C 0.02899(16) 0.4865(3) 0.0731(2) 0.0321(8) Uani 1 4 d . . .
C61 C 0.03784(15) 0.5734(3) 0.0283(2) 0.0363(8) Uani 1 4 d . . .
C62 C -0.00900(16) 0.4143(3) 0.0440(2) 0.0355(8) Uani 1 4 d . . .
C75 C 0.3116(3) 0.6059(5) 0.5192(4) 0.0851(19) Uani 1 4 d . . .
C76 C 0.3205(3) 0.2538(4) 0.4226(3) 0.0784(19) Uani 1 4 d . . .
C77 C 0.47660(17) 0.4402(3) 0.4401(2) 0.0415(9) Uani 1 4 d . . .
C78 C 0.47328(15) 0.5442(3) 0.4331(2) 0.0324(8) Uani 1 4 d . . .
C79 C 0.49653(17) 0.6032(3) 0.4939(2) 0.0438(10) Uani 1 4 d . . .
H14 H 0.30902 0.2063 0.15162 0.0474 Uiso 1 4 calc R . .
H18 H 0.47934 0.59808 -0.05262 0.0554 Uiso 1 4 calc R . .
H19 H 0.53895 0.62369 0.05419 0.0580 Uiso 1 4 calc R . .
H20 H 0.49549 0.66465 0.17926 0.0277 Uiso 1 4 calc R . .
H22 H 0.33754 0.62508 0.08024 0.0473 Uiso 1 4 calc R . .
H23 H 0.37966 0.59125 -0.0433 0.0558 Uiso 1 4 calc R . .
H25 H 0.15939 0.76387 0.08755 0.0414 Uiso 1 4 calc R . .
H30 H 0.33445 0.41884 0.51281 0.0593 Uiso 1 4 calc R . .
H40 H 0.12283 0.60163 0.42843 0.0483 Uiso 1 4 calc R . .
H41 H 0.06456 0.69977 0.50727 0.0577 Uiso 1 4 calc R . .
H42 H -0.03361 0.6822 0.50132 0.0437 Uiso 1 4 calc R . .
H44 H -0.01752 0.46661 0.33139 0.0471 Uiso 1 4 calc R . .
H45 H -0.07659 0.5665 0.40986 0.0548 Uiso 1 4 calc R . .
H46 H 0.16081 0.14814 0.44389 0.0722 Uiso 1 4 calc R . .
H47 H 0.16556 0.31979 0.41382 0.0539 Uiso 1 4 calc R . .
H49 H 0.08976 0.05082 0.38218 0.0716 Uiso 1 4 calc R . .
H50 H 0.02726 0.28842 0.26103 0.0374 Uiso 1 4 calc R . .
H51 H 0.02002 0.11813 0.28795 0.0413 Uiso 1 4 calc R . .
H52 H 0.37547 1.08514 0.28146 0.0702 Uiso 1 4 calc R . .
H53 H 0.4595 1.00841 0.24208 0.0900 Uiso 1 4 calc R . .
H54 H 0.46108 0.83662 0.22075 0.0700 Uiso 1 4 calc R . .
H56 H 0.29517 0.81872 0.28425 0.0532 Uiso 1 4 calc R . .
H57 H 0.29414 0.99062 0.30627 0.0670 Uiso 1 4 calc R . .
H61 H 0.06361 0.6234 0.04785 0.0435 Uiso 1 4 calc R . .
H62 H -0.01515 0.35559 0.07439 0.0426 Uiso 1 4 calc R . .
H77 H 0.46025 0.39926 0.39903 0.0497 Uiso 1 4 calc R . .
H79 H 0.494 0.67375 0.49008 0.0526 Uiso 1 4 calc R . .



#==============================================================================
_computing_data_collection       'RAPID AUTO (Rigaku, ????)'
_computing_cell_refinement       'RAPID AUTO'
_computing_data_reduction        'RAPID AUTO'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_publication_material  'CrystalStructure 4.1 (Rigaku, 2014)'
_computing_molecular_graphics    'CrystalStructure 4.1'

#==============================================================================
# MOLECULAR GEOMETRY

_geom_special_details            
;
    ENTER SPECIAL DETAILS OF THE MOLECULAR GEOMETRY
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_publ_flag
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
Eu1 O4 2.324(2) yes . .
Eu1 O6 2.384(2) yes . .
Eu1 O7 2.381(2) yes . .
Eu1 O8 2.414(3) yes . .
Eu1 O9 2.416(2) yes . .
Eu1 O10 2.332(2) yes . .
Eu1 O11 2.397(2) yes . .
Eu1 O12 2.433(2) yes . .
P2 O10 1.489(2) yes . .
P2 C43 1.798(3) yes . .
P2 C48 1.791(3) yes . .
P2 C59 1.748(4) yes . .
P5 O4 1.494(2) yes . .
P5 C21 1.792(4) yes . .
P5 C32 1.742(4) yes . .
P5 C55 1.794(3) yes . .
F34 C28 1.318(5) yes . .
F35 C28 1.325(5) yes . .
F36 C28 1.315(5) yes . .
F37 C27 1.324(5) yes . .
F38 C27 1.304(5) yes . .
F39 C27 1.321(5) yes . .
F63 C16 1.311(6) yes . .
F64 C16 1.306(6) yes . .
F65 C16 1.322(6) yes . .
F66 C17 1.211(8) yes . .
F67 C17 1.280(8) yes . .
F68 C17 1.278(7) yes . .
F69 C76 1.332(8) yes . .
F70 C76 1.128(8) yes . .
F71 C76 1.362(7) yes . .
F72 C75 1.243(9) yes . .
F73 C75 1.194(9) yes . .
F74 C75 1.279(9) yes . .
O6 C31 1.250(5) yes . .
O7 C13 1.252(4) yes . .
O8 C29 1.238(5) yes . .
O9 C15 1.238(4) yes . .
O11 C24 1.257(4) yes . .
O12 C26 1.236(4) yes . .
C13 C14 1.384(5) yes . .
C13 C16 1.540(6) yes . .
C14 C15 1.390(5) yes . .
C15 C17 1.523(6) yes . .
C18 C19 1.361(6) yes . .
C18 C23 1.380(6) yes . .
C19 C20 1.410(6) yes . .
C20 C21 1.406(5) yes . .
C21 C22 1.377(5) yes . .
C22 C23 1.398(6) yes . .
C24 C25 1.391(5) yes . .
C24 C27 1.535(5) yes . .
C25 C26 1.392(5) yes . .
C26 C28 1.536(6) yes . .
C29 C30 1.397(6) yes . .
C29 C76 1.551(7) yes . .
C30 C31 1.368(6) yes . .
C31 C75 1.516(7) yes . .
C32 C33 1.195(5) yes . .
C33 C78 1.433(5) yes . .
C40 C41 1.388(6) yes . .
C40 C43 1.382(5) yes . .
C41 C42 1.384(6) yes . .
C42 C45 1.382(6) yes . .
C43 C44 1.397(5) yes . .
C44 C45 1.390(6) yes . .
C46 C47 1.401(6) yes . .
C46 C49 1.375(6) yes . .
C47 C48 1.389(5) yes . .
C48 C50 1.375(5) yes . .
C49 C51 1.383(7) yes . .
C50 C51 1.398(6) yes . .
C52 C53 1.367(7) yes . .
C52 C57 1.371(7) yes . .
C53 C54 1.384(6) yes . .
C54 C55 1.373(5) yes . .
C55 C56 1.384(5) yes . .
C56 C57 1.385(6) yes . .
C58 C59 1.191(5) yes . .
C58 C60 1.437(5) yes . .
C60 C61 1.403(5) yes . .
C60 C62 1.389(5) yes . .
C61 C62 1.376(5) yes . 3_565
C77 C78 1.401(5) yes . .
C77 C79 1.382(5) yes . 3_666
C78 C79 1.385(5) yes . .
C14 H14 0.950 no . .
C18 H18 0.950 no . .
C19 H19 0.986 no . .
C20 H20 0.889 no . .
C22 H22 0.950 no . .
C23 H23 0.950 no . .
C25 H25 0.950 no . .
C30 H30 0.950 no . .
C40 H40 0.908 no . .
C41 H41 0.950 no . .
C42 H42 0.957 no . .
C44 H44 0.950 no . .
C45 H45 0.950 no . .
C46 H46 0.950 no . .
C47 H47 0.950 no . .
C49 H49 0.950 no . .
C50 H50 0.949 no . .
C51 H51 1.043 no . .
C52 H52 0.950 no . .
C53 H53 0.950 no . .
C54 H54 0.950 no . .
C56 H56 0.950 no . .
C57 H57 0.950 no . .
C61 H61 0.950 no . .
C62 H62 0.950 no . .
C77 H77 0.950 no . .
C79 H79 0.950 no . .

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_publ_flag
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
O4 Eu1 O6 76.77(8) yes . . .
O4 Eu1 O7 75.03(8) yes . . .
O4 Eu1 O8 118.98(8) yes . . .
O4 Eu1 O9 138.31(8) yes . . .
O4 Eu1 O10 142.61(8) yes . . .
O4 Eu1 O11 78.80(8) yes . . .
O4 Eu1 O12 76.10(8) yes . . .
O6 Eu1 O7 109.06(8) yes . . .
O6 Eu1 O8 70.20(9) yes . . .
O6 Eu1 O9 138.84(8) yes . . .
O6 Eu1 O10 80.22(8) yes . . .
O6 Eu1 O11 148.02(8) yes . . .
O6 Eu1 O12 83.51(8) yes . . .
O7 Eu1 O8 69.73(9) yes . . .
O7 Eu1 O9 72.50(8) yes . . .
O7 Eu1 O10 141.10(8) yes . . .
O7 Eu1 O11 83.89(9) yes . . .
O7 Eu1 O12 144.61(8) yes . . .
O8 Eu1 O9 72.41(8) yes . . .
O8 Eu1 O10 79.08(8) yes . . .
O8 Eu1 O11 140.94(9) yes . . .
O8 Eu1 O12 143.96(9) yes . . .
O9 Eu1 O10 76.40(8) yes . . .
O9 Eu1 O11 72.44(8) yes . . .
O9 Eu1 O12 119.83(8) yes . . .
O10 Eu1 O11 108.40(8) yes . . .
O10 Eu1 O12 72.34(8) yes . . .
O11 Eu1 O12 70.76(8) yes . . .
O10 P2 C43 110.03(15) yes . . .
O10 P2 C48 111.18(14) yes . . .
O10 P2 C59 114.44(16) yes . . .
C43 P2 C48 111.39(16) yes . . .
C43 P2 C59 105.07(16) yes . . .
C48 P2 C59 104.51(17) yes . . .
O4 P5 C21 112.15(15) yes . . .
O4 P5 C32 112.36(16) yes . . .
O4 P5 C55 109.83(14) yes . . .
C21 P5 C32 106.03(16) yes . . .
C21 P5 C55 109.98(15) yes . . .
C32 P5 C55 106.27(16) yes . . .
Eu1 O4 P5 149.91(14) yes . . .
Eu1 O6 C31 136.6(3) yes . . .
Eu1 O7 C13 131.7(2) yes . . .
Eu1 O8 C29 136.3(3) yes . . .
Eu1 O9 C15 132.0(2) yes . . .
Eu1 O10 P2 142.75(15) yes . . .
Eu1 O11 C24 136.2(2) yes . . .
Eu1 O12 C26 135.4(2) yes . . .
O7 C13 C14 128.5(3) yes . . .
O7 C13 C16 112.6(3) yes . . .
C14 C13 C16 118.9(3) yes . . .
C13 C14 C15 121.9(3) yes . . .
O9 C15 C14 128.5(3) yes . . .
O9 C15 C17 115.0(3) yes . . .
C14 C15 C17 116.5(4) yes . . .
F63 C16 F64 108.5(4) yes . . .
F63 C16 F65 105.9(4) yes . . .
F63 C16 C13 110.8(4) yes . . .
F64 C16 F65 105.8(4) yes . . .
F64 C16 C13 111.1(4) yes . . .
F65 C16 C13 114.3(4) yes . . .
F66 C17 F67 107.1(5) yes . . .
F66 C17 F68 108.0(6) yes . . .
F66 C17 C15 118.0(5) yes . . .
F67 C17 F68 96.9(5) yes . . .
F67 C17 C15 111.5(5) yes . . .
F68 C17 C15 113.2(4) yes . . .
C19 C18 C23 122.0(4) yes . . .
C18 C19 C20 119.9(4) yes . . .
C19 C20 C21 118.4(3) yes . . .
P5 C21 C20 122.0(3) yes . . .
P5 C21 C22 117.5(3) yes . . .
C20 C21 C22 120.5(3) yes . . .
C21 C22 C23 120.3(3) yes . . .
C18 C23 C22 118.9(4) yes . . .
O11 C24 C25 127.2(3) yes . . .
O11 C24 C27 114.0(3) yes . . .
C25 C24 C27 118.8(3) yes . . .
C24 C25 C26 121.9(3) yes . . .
O12 C26 C25 127.7(3) yes . . .
O12 C26 C28 114.3(3) yes . . .
C25 C26 C28 118.0(3) yes . . .
F37 C27 F38 108.8(3) yes . . .
F37 C27 F39 104.8(3) yes . . .
F37 C27 C24 113.2(3) yes . . .
F38 C27 F39 107.2(3) yes . . .
F38 C27 C24 111.9(3) yes . . .
F39 C27 C24 110.5(3) yes . . .
F34 C28 F35 106.9(3) yes . . .
F34 C28 F36 105.7(4) yes . . .
F34 C28 C26 111.2(3) yes . . .
F35 C28 F36 106.7(4) yes . . .
F35 C28 C26 114.0(4) yes . . .
F36 C28 C26 111.9(3) yes . . .
O8 C29 C30 127.2(4) yes . . .
O8 C29 C76 112.7(4) yes . . .
C30 C29 C76 120.1(4) yes . . .
C29 C30 C31 120.8(4) yes . . .
O6 C31 C30 128.3(4) yes . . .
O6 C31 C75 115.4(4) yes . . .
C30 C31 C75 116.3(4) yes . . .
P5 C32 C33 174.6(3) yes . . .
C32 C33 C78 179.0(4) yes . . .
C41 C40 C43 118.4(3) yes . . .
C40 C41 C42 121.5(4) yes . . .
C41 C42 C45 119.6(4) yes . . .
P2 C43 C40 118.6(3) yes . . .
P2 C43 C44 120.4(3) yes . . .
C40 C43 C44 121.0(3) yes . . .
C43 C44 C45 119.4(3) yes . . .
C42 C45 C44 120.0(4) yes . . .
C47 C46 C49 119.1(4) yes . . .
C46 C47 C48 119.6(4) yes . . .
P2 C48 C47 116.4(3) yes . . .
P2 C48 C50 122.7(3) yes . . .
C47 C48 C50 120.8(3) yes . . .
C46 C49 C51 121.4(4) yes . . .
C48 C50 C51 119.5(4) yes . . .
C49 C51 C50 119.5(4) yes . . .
C53 C52 C57 120.3(4) yes . . .
C52 C53 C54 119.9(4) yes . . .
C53 C54 C55 120.5(4) yes . . .
P5 C55 C54 122.0(3) yes . . .
P5 C55 C56 118.6(3) yes . . .
C54 C55 C56 119.3(3) yes . . .
C55 C56 C57 120.1(4) yes . . .
C52 C57 C56 119.9(4) yes . . .
C59 C58 C60 177.4(4) yes . . .
P2 C59 C58 176.5(3) yes . . .
C58 C60 C61 120.2(3) yes . . .
C58 C60 C62 120.2(3) yes . . .
C61 C60 C62 119.5(3) yes . . .
C60 C61 C62 119.6(3) yes . . 3_565
C60 C62 C61 120.9(3) yes . . 3_565
F72 C75 F73 108.8(6) yes . . .
F72 C75 F74 100.9(7) yes . . .
F72 C75 C31 117.1(6) yes . . .
F73 C75 F74 103.8(7) yes . . .
F73 C75 C31 113.7(6) yes . . .
F74 C75 C31 110.9(5) yes . . .
F69 C76 F70 113.5(6) yes . . .
F69 C76 F71 93.2(5) yes . . .
F69 C76 C29 106.7(4) yes . . .
F70 C76 F71 112.9(6) yes . . .
F70 C76 C29 117.1(6) yes . . .
F71 C76 C29 110.8(4) yes . . .
C78 C77 C79 120.6(4) yes . . 3_666
C33 C78 C77 120.5(3) yes . . .
C33 C78 C79 120.2(3) yes . . .
C77 C78 C79 119.3(3) yes . . .
C77 C79 C78 120.2(4) yes 3_666 . .
C13 C14 H14 119.053 no . . .
C15 C14 H14 119.047 no . . .
C19 C18 H18 118.991 no . . .
C23 C18 H18 118.983 no . . .
C18 C19 H19 115.782 no . . .
C20 C19 H19 123.863 no . . .
C19 C20 H20 120.403 no . . .
C21 C20 H20 121.146 no . . .
C21 C22 H22 119.873 no . . .
C23 C22 H22 119.875 no . . .
C18 C23 H23 120.577 no . . .
C22 C23 H23 120.572 no . . .
C24 C25 H25 119.049 no . . .
C26 C25 H25 119.039 no . . .
C29 C30 H30 119.605 no . . .
C31 C30 H30 119.603 no . . .
C41 C40 H40 121.183 no . . .
C43 C40 H40 120.436 no . . .
C40 C41 H41 119.251 no . . .
C42 C41 H41 119.253 no . . .
C41 C42 H42 117.369 no . . .
C45 C42 H42 122.932 no . . .
C43 C44 H44 120.283 no . . .
C45 C44 H44 120.301 no . . .
C42 C45 H45 119.985 no . . .
C44 C45 H45 119.982 no . . .
C47 C46 H46 120.444 no . . .
C49 C46 H46 120.453 no . . .
C46 C47 H47 120.180 no . . .
C48 C47 H47 120.180 no . . .
C46 C49 H49 119.307 no . . .
C51 C49 H49 119.310 no . . .
C48 C50 H50 122.797 no . . .
C51 C50 H50 117.573 no . . .
C49 C51 H51 122.060 no . . .
C50 C51 H51 118.404 no . . .
C53 C52 H52 119.833 no . . .
C57 C52 H52 119.841 no . . .
C52 C53 H53 120.072 no . . .
C54 C53 H53 120.063 no . . .
C53 C54 H54 119.758 no . . .
C55 C54 H54 119.758 no . . .
C55 C56 H56 119.971 no . . .
C57 C56 H56 119.974 no . . .
C52 C57 H57 120.039 no . . .
C56 C57 H57 120.032 no . . .
C60 C61 H61 120.188 no . . .
C62 C61 H61 120.182 no 3_565 . .
C60 C62 H62 119.576 no . . .
C61 C62 H62 119.573 no 3_565 . .
C78 C77 H77 119.718 no . . .
C79 C77 H77 119.729 no 3_666 . .
C77 C79 H79 119.903 no 3_666 . .
C78 C79 H79 119.912 no . . .

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_publ_flag
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
O4 Eu1 O6 C31 -122.6(2) no . . . .
O6 Eu1 O4 P5 72.0(3) no . . . .
O4 Eu1 O7 C13 -176.8(2) no . . . .
O7 Eu1 O4 P5 -42.2(3) no . . . .
O4 Eu1 O8 C29 53.1(3) no . . . .
O8 Eu1 O4 P5 13.9(3) no . . . .
O4 Eu1 O9 C15 59.1(3) no . . . .
O9 Eu1 O4 P5 -82.0(3) no . . . .
O4 Eu1 O10 P2 119.4(2) no . . . .
O10 Eu1 O4 P5 125.5(3) no . . . .
O4 Eu1 O11 C24 -70.0(2) no . . . .
O11 Eu1 O4 P5 -128.8(3) no . . . .
O4 Eu1 O12 C26 73.6(2) no . . . .
O12 Eu1 O4 P5 158.5(3) no . . . .
O6 Eu1 O7 C13 113.3(2) no . . . .
O7 Eu1 O6 C31 -53.8(2) no . . . .
O6 Eu1 O8 C29 -8.3(2) no . . . .
O8 Eu1 O6 C31 5.3(2) no . . . .
O6 Eu1 O9 C15 -80.5(2) no . . . .
O9 Eu1 O6 C31 31.2(3) no . . . .
O6 Eu1 O10 P2 171.9(2) no . . . .
O10 Eu1 O6 C31 87.1(2) no . . . .
O6 Eu1 O11 C24 -29.2(3) no . . . .
O11 Eu1 O6 C31 -163.70(17) no . . . .
O6 Eu1 O12 C26 151.5(2) no . . . .
O12 Eu1 O6 C31 160.2(2) no . . . .
O7 Eu1 O8 C29 111.9(3) no . . . .
O8 Eu1 O7 C13 53.9(2) no . . . .
O7 Eu1 O9 C15 18.65(19) no . . . .
O9 Eu1 O7 C13 -23.3(2) no . . . .
O7 Eu1 O10 P2 -79.8(3) no . . . .
O10 Eu1 O7 C13 15.1(3) no . . . .
O7 Eu1 O11 C24 -145.9(2) no . . . .
O11 Eu1 O7 C13 -96.8(2) no . . . .
O7 Eu1 O12 C26 37.5(3) no . . . .
O12 Eu1 O7 C13 -140.49(19) no . . . .
O8 Eu1 O9 C15 -55.0(2) no . . . .
O9 Eu1 O8 C29 -170.8(3) no . . . .
O8 Eu1 O10 P2 -116.5(2) no . . . .
O10 Eu1 O8 C29 -91.8(2) no . . . .
O8 Eu1 O11 C24 167.33(18) no . . . .
O11 Eu1 O8 C29 162.41(19) no . . . .
O8 Eu1 O12 C26 -165.88(17) no . . . .
O12 Eu1 O8 C29 -54.0(3) no . . . .
O9 Eu1 O10 P2 -42.2(2) no . . . .
O10 Eu1 O9 C15 -137.7(2) no . . . .
O9 Eu1 O11 C24 140.6(2) no . . . .
O11 Eu1 O9 C15 107.7(2) no . . . .
O9 Eu1 O12 C26 -64.6(2) no . . . .
O12 Eu1 O9 C15 162.22(18) no . . . .
O10 Eu1 O11 C24 72.0(2) no . . . .
O11 Eu1 O10 P2 23.8(2) no . . . .
O10 Eu1 O12 C26 -126.7(2) no . . . .
O12 Eu1 O10 P2 85.7(2) no . . . .
O11 Eu1 O12 C26 -9.2(2) no . . . .
O12 Eu1 O11 C24 9.0(2) no . . . .
O10 P2 C43 C40 -4.4(3) no . . . .
O10 P2 C43 C44 175.1(2) no . . . .
C43 P2 O10 Eu1 -136.4(2) no . . . .
O10 P2 C48 C47 26.8(3) no . . . .
O10 P2 C48 C50 -152.8(2) no . . . .
C48 P2 O10 Eu1 99.7(2) no . . . .
C59 P2 O10 Eu1 -18.4(3) no . . . .
C43 P2 C48 C47 -96.3(2) no . . . .
C43 P2 C48 C50 84.1(3) no . . . .
C48 P2 C43 C40 119.3(2) no . . . .
C48 P2 C43 C44 -61.2(3) no . . . .
C59 P2 C43 C40 -128.1(2) no . . . .
C59 P2 C43 C44 51.4(3) no . . . .
C59 P2 C48 C47 150.7(2) no . . . .
C59 P2 C48 C50 -28.9(3) no . . . .
O4 P5 C21 C20 -162.4(2) no . . . .
O4 P5 C21 C22 18.9(3) no . . . .
C21 P5 O4 Eu1 89.0(3) no . . . .
C32 P5 O4 Eu1 -30.4(4) no . . . .
O4 P5 C55 C54 -167.0(2) no . . . .
O4 P5 C55 C56 12.8(3) no . . . .
C55 P5 O4 Eu1 -148.4(3) no . . . .
C32 P5 C21 C20 -39.4(3) no . . . .
C32 P5 C21 C22 141.9(2) no . . . .
C21 P5 C55 C54 -43.1(3) no . . . .
C21 P5 C55 C56 136.7(2) no . . . .
C55 P5 C21 C20 75.1(3) no . . . .
C55 P5 C21 C22 -103.6(2) no . . . .
C32 P5 C55 C54 71.3(3) no . . . .
C32 P5 C55 C56 -109.0(2) no . . . .
Eu1 O6 C31 C30 -1.4(6) no . . . .
Eu1 O6 C31 C75 179.20(16) no . . . .
Eu1 O7 C13 C14 20.8(5) no . . . .
Eu1 O7 C13 C16 -158.23(17) no . . . .
Eu1 O8 C29 C30 7.7(6) no . . . .
Eu1 O8 C29 C76 -172.89(17) no . . . .
Eu1 O9 C15 C14 -10.6(6) no . . . .
Eu1 O9 C15 C17 169.99(15) no . . . .
Eu1 O11 C24 C25 -7.5(5) no . . . .
Eu1 O11 C24 C27 173.74(16) no . . . .
Eu1 O12 C26 C25 7.9(5) no . . . .
Eu1 O12 C26 C28 -174.84(15) no . . . .
O7 C13 C14 C15 0.1(6) no . . . .
O7 C13 C16 F63 -59.0(5) no . . . .
O7 C13 C16 F64 61.7(5) no . . . .
O7 C13 C16 F65 -178.6(3) no . . . .
C14 C13 C16 F63 121.9(4) no . . . .
C14 C13 C16 F64 -117.4(4) no . . . .
C14 C13 C16 F65 2.3(6) no . . . .
C16 C13 C14 C15 179.1(3) no . . . .
C13 C14 C15 O9 -5.3(6) no . . . .
C13 C14 C15 C17 174.1(3) no . . . .
O9 C15 C17 F66 149.2(4) no . . . .
O9 C15 C17 F67 -86.2(4) no . . . .
O9 C15 C17 F68 21.8(6) no . . . .
C14 C15 C17 F66 -30.2(6) no . . . .
C14 C15 C17 F67 94.3(5) no . . . .
C14 C15 C17 F68 -157.7(4) no . . . .
C19 C18 C23 C22 0.9(6) no . . . .
C23 C18 C19 C20 -1.0(6) no . . . .
C18 C19 C20 C21 0.3(5) no . . . .
C19 C20 C21 P5 -178.1(3) no . . . .
C19 C20 C21 C22 0.5(5) no . . . .
P5 C21 C22 C23 178.0(2) no . . . .
C20 C21 C22 C23 -0.7(5) no . . . .
C21 C22 C23 C18 0.0(6) no . . . .
O11 C24 C25 C26 0.2(6) no . . . .
O11 C24 C27 F37 179.4(3) no . . . .
O11 C24 C27 F38 -57.1(4) no . . . .
O11 C24 C27 F39 62.2(4) no . . . .
C25 C24 C27 F37 0.5(5) no . . . .
C25 C24 C27 F38 124.0(3) no . . . .
C25 C24 C27 F39 -116.7(4) no . . . .
C27 C24 C25 C26 178.9(3) no . . . .
C24 C25 C26 O12 -0.5(6) no . . . .
C24 C25 C26 C28 -177.7(3) no . . . .
O12 C26 C28 F34 60.4(4) no . . . .
O12 C26 C28 F35 -178.7(3) no . . . .
O12 C26 C28 F36 -57.6(4) no . . . .
C25 C26 C28 F34 -122.1(3) no . . . .
C25 C26 C28 F35 -1.2(5) no . . . .
C25 C26 C28 F36 120.0(4) no . . . .
O8 C29 C30 C31 0.6(6) no . . . .
O8 C29 C76 F69 66.6(5) no . . . .
O8 C29 C76 F70 -61.7(6) no . . . .
O8 C29 C76 F71 166.8(4) no . . . .
C30 C29 C76 F69 -113.9(4) no . . . .
C30 C29 C76 F70 117.7(5) no . . . .
C30 C29 C76 F71 -13.7(6) no . . . .
C76 C29 C30 C31 -178.8(4) no . . . .
C29 C30 C31 O6 -3.7(7) no . . . .
C29 C30 C31 C75 175.7(3) no . . . .
O6 C31 C75 F72 -151.3(4) no . . . .
O6 C31 C75 F73 80.3(6) no . . . .
O6 C31 C75 F74 -36.3(7) no . . . .
C30 C31 C75 F72 29.2(7) no . . . .
C30 C31 C75 F73 -99.1(5) no . . . .
C30 C31 C75 F74 144.3(5) no . . . .
C41 C40 C43 P2 -179.8(3) no . . . .
C41 C40 C43 C44 0.8(5) no . . . .
C43 C40 C41 C42 -0.6(6) no . . . .
C40 C41 C42 C45 0.0(6) no . . . .
C41 C42 C45 C44 0.5(6) no . . . .
P2 C43 C44 C45 -179.7(2) no . . . .
C40 C43 C44 C45 -0.3(5) no . . . .
C43 C44 C45 C42 -0.3(6) no . . . .
C47 C46 C49 C51 -0.7(7) no . . . .
C49 C46 C47 C48 -0.2(7) no . . . .
C46 C47 C48 P2 -178.2(3) no . . . .
C46 C47 C48 C50 1.4(6) no . . . .
P2 C48 C50 C51 177.9(2) no . . . .
C47 C48 C50 C51 -1.7(6) no . . . .
C46 C49 C51 C50 0.4(7) no . . . .
C48 C50 C51 C49 0.8(7) no . . . .
C53 C52 C57 C56 -1.9(7) no . . . .
C57 C52 C53 C54 1.7(8) no . . . .
C52 C53 C54 C55 -0.3(8) no . . . .
C53 C54 C55 P5 179.0(4) no . . . .
C53 C54 C55 C56 -0.7(6) no . . . .
P5 C55 C56 C57 -179.2(2) no . . . .
C54 C55 C56 C57 0.5(6) no . . . .
C55 C56 C57 C52 0.8(6) no . . . .
C58 C60 C61 C62 -177.4(3) no . . . 3_565
C58 C60 C62 C61 177.4(3) no . . . 3_565
C61 C60 C62 C61 0.3(5) no . . . 3_565
C62 C60 C61 C62 -0.3(5) no . . . 3_565
C60 C61 C62 C60 0.3(5) no . . 3_565 3_565
C78 C77 C79 C78 0.9(6) no . . 3_666 3_666
C79 C77 C78 C33 -178.7(3) no 3_666 . . .
C79 C77 C78 C79 -0.9(5) no 3_666 . . .
C33 C78 C79 C77 178.7(3) no . . . 3_666
C77 C78 C79 C77 0.9(5) no . . . 3_666

loop_
_geom_contact_atom_site_label_1
_geom_contact_atom_site_label_2
_geom_contact_distance
_geom_contact_publ_flag
_geom_contact_site_symmetry_1
_geom_contact_site_symmetry_2
P2 O9 3.448(2) no . .
P5 O7 3.509(3) no . .
F34 O12 2.787(4) no . .
F34 C25 3.425(5) no . .
F34 C56 3.518(5) no . .
F35 O12 3.484(4) no . .
F35 C25 2.729(5) no . .
F36 O12 2.777(4) no . .
F36 C25 3.417(5) no . .
F37 O11 3.491(4) no . .
F37 C25 2.727(4) no . .
F38 O11 2.772(4) no . .
F38 C22 3.389(5) no . .
F38 C23 3.522(5) no . .
F38 C25 3.441(5) no . .
F39 O11 2.795(4) no . .
F39 C25 3.389(5) no . .
F39 C61 3.277(5) no . .
F63 O7 2.749(4) no . .
F63 C14 3.419(5) no . .
F64 F69 3.023(6) no . .
F64 O7 2.773(4) no . .
F64 C14 3.389(5) no . .
F65 O7 3.486(4) no . .
F65 C14 2.754(5) no . .
F66 O9 3.362(6) no . .
F66 C14 2.783(6) no . .
F67 O9 2.972(6) no . .
F67 C14 3.164(7) no . .
F67 C46 3.597(7) no . .
F67 C49 3.552(7) no . .
F68 O9 2.587(5) no . .
F68 C14 3.554(6) no . .
F69 O8 2.755(5) no . .
F69 C13 3.596(6) no . .
F69 C30 3.357(6) no . .
F70 O8 2.773(6) no . .
F70 C30 3.352(6) no . .
F70 C46 3.499(6) no . .
F71 O8 3.474(5) no . .
F71 C30 2.751(6) no . .
F72 O6 3.398(5) no . .
F72 C30 2.755(7) no . .
F73 O6 2.910(7) no . .
F73 C30 3.147(8) no . .
F74 O6 2.611(7) no . .
F74 C30 3.459(7) no . .
O4 C22 3.025(5) no . .
O4 C24 3.569(4) no . .
O4 C26 3.511(4) no . .
O4 C56 2.984(5) no . .
O6 C29 2.867(5) no . .
O7 C15 2.904(4) no . .
O7 C22 3.513(5) no . .
O8 C13 3.027(5) no . .
O8 C14 3.249(5) no . .
O8 C15 3.168(5) no . .
O8 C31 2.852(5) no . .
O9 C13 2.901(4) no . .
O9 C59 3.432(4) no . .
O10 C40 2.976(5) no . .
O10 C47 3.013(5) no . .
O11 C26 2.893(4) no . .
O12 C24 2.889(4) no . .
C18 C21 2.757(6) no . .
C19 C22 2.777(5) no . .
C20 C23 2.796(5) no . .
C20 C32 3.201(5) no . .
C20 C54 3.525(6) no . .
C21 C54 3.339(5) no . .
C32 C54 3.459(6) no . .
C32 C77 3.549(5) no . .
C32 C79 3.533(5) no . .
C40 C45 2.793(5) no . .
C41 C44 2.762(6) no . .
C42 C43 2.768(6) no . .
C44 C48 3.503(5) no . .
C44 C59 3.244(5) no . .
C46 C50 2.787(6) no . .
C47 C51 2.776(6) no . .
C48 C49 2.756(6) no . .
C50 C59 3.100(6) no . .
C52 C55 2.762(5) no . .
C53 C56 2.753(6) no . .
C54 C57 2.749(6) no . .
C59 C61 3.557(5) no . .
C59 C62 3.525(5) no . .
C60 C60 2.782(5) no . 3_565
C61 C61 2.786(5) no . 3_565
C62 C62 2.768(5) no . 3_565
C77 C77 2.764(6) no . 3_666
C78 C78 2.790(5) no . 3_666
C79 C79 2.780(6) no . 3_666
F34 F37 3.091(4) no . 4_565
F34 F38 3.518(4) no . 4_565
F34 F39 3.353(4) no . 4_565
F34 C27 3.577(5) no . 4_565
F35 C44 3.422(5) no . 2_555
F36 F37 3.415(5) no . 4_565
F37 F34 3.091(4) no . 4_564
F37 F36 3.415(5) no . 4_564
F37 F73 3.588(7) no . 4_564
F37 C40 3.518(5) no . 4_564
F37 C41 3.574(5) no . 4_564
F38 F34 3.518(4) no . 4_564
F38 F74 3.168(8) no . 4_564
F39 F34 3.353(4) no . 4_564
F39 C46 3.264(5) no . 4_554
F39 C49 3.297(5) no . 4_554
F63 F71 3.156(5) no . 4_554
F63 C18 3.293(5) no . 3_665
F63 C19 3.569(6) no . 3_665
F64 C54 3.389(5) no . 2_645
F65 F71 3.016(5) no . 4_554
F65 C52 3.590(5) no . 1_545
F66 C30 3.482(6) no . 4_554
F68 C45 3.419(6) no . 2_545
F69 C52 3.339(6) no . 1_545
F71 F63 3.156(5) no . 4_555
F71 F65 3.016(5) no . 4_555
F71 C13 3.474(5) no . 4_555
F71 C14 3.325(5) no . 4_555
F71 C16 3.364(6) no . 4_555
F72 C53 3.549(8) no . 4_565
F72 C54 3.357(7) no . 4_565
F72 C55 3.394(6) no . 4_565
F73 F37 3.588(7) no . 4_565
F73 C25 3.288(7) no . 4_565
F74 F38 3.168(8) no . 4_565
F74 C22 3.015(7) no . 4_565
F74 C23 3.224(8) no . 4_565
C13 F71 3.474(5) no . 4_554
C14 F71 3.325(5) no . 4_554
C16 F71 3.364(6) no . 4_554
C18 F63 3.293(5) no . 3_665
C18 C18 3.447(6) no . 3_665
C18 C19 3.540(6) no . 3_665
C19 F63 3.569(6) no . 3_665
C19 C18 3.540(6) no . 3_665
C22 F74 3.015(7) no . 4_564
C23 F74 3.224(8) no . 4_564
C25 F73 3.288(7) no . 4_564
C27 F34 3.577(5) no . 4_564
C30 F66 3.482(6) no . 4_555
C40 F37 3.518(5) no . 4_565
C41 F37 3.574(5) no . 4_565
C42 C44 3.495(6) no . 3_566
C44 F35 3.422(5) no . 2_545
C44 C42 3.495(6) no . 3_566
C45 F68 3.419(6) no . 2_555
C46 F39 3.264(5) no . 4_555
C49 F39 3.297(5) no . 4_555
C49 C60 3.472(6) no . 2_545
C49 C61 3.541(6) no . 2_545
C51 C60 3.538(6) no . 2_545
C51 C61 3.555(6) no . 2_545
C52 F65 3.590(5) no . 1_565
C52 F69 3.339(6) no . 1_565
C53 F72 3.549(8) no . 4_564
C54 F64 3.389(5) no . 2_655
C54 F72 3.357(7) no . 4_564
C55 F72 3.394(6) no . 4_564
C60 C49 3.472(6) no . 2_555
C60 C51 3.538(6) no . 2_555
C61 C49 3.541(6) no . 2_555
C61 C51 3.555(6) no . 2_555
P2 H40 2.8167 no . .
P2 H44 2.8804 no . .
P2 H47 2.7770 no . .
P2 H50 2.9449 no . .
P5 H20 2.9165 no . .
P5 H22 2.7847 no . .
P5 H54 2.8815 no . .
P5 H56 2.8198 no . .
F34 H25 3.5787 no . .
F34 H56 2.8157 no . .
F34 H57 3.1597 no . .
F35 H25 2.3574 no . .
F36 H25 3.5792 no . .
F36 H40 3.5850 no . .
F37 H25 2.3630 no . .
F37 H61 3.1986 no . .
F38 H22 2.6874 no . .
F38 H23 2.9711 no . .
F39 H25 3.5465 no . .
F39 H61 3.0221 no . .
F63 H14 3.5865 no . .
F64 H14 3.5460 no . .
F64 H77 2.8533 no . .
F65 H14 2.3928 no . .
F66 H14 2.5185 no . .
F67 H14 3.1630 no . .
F69 H30 3.5262 no . .
F69 H77 3.2434 no . .
F70 H30 3.5025 no . .
F70 H46 2.9665 no . .
F70 H47 3.1964 no . .
F71 H30 2.4064 no . .
F71 H77 3.5184 no . .
F72 H30 2.4460 no . .
F73 H30 3.2216 no . .
O4 H22 2.6122 no . .
O4 H56 2.5744 no . .
O6 H30 3.1756 no . .
O7 H14 3.1878 no . .
O7 H22 3.2478 no . .
O8 H30 3.1815 no . .
O8 H47 3.0840 no . .
O9 H14 3.1787 no . .
O10 H40 2.5738 no . .
O10 H47 2.6346 no . .
O11 H22 2.8730 no . .
O11 H25 3.1905 no . .
O12 H25 3.1743 no . .
O12 H40 3.4588 no . .
O12 H56 3.1536 no . .
C16 H14 2.6413 no . .
C17 H14 2.5878 no . .
C18 H20 3.1979 no . .
C18 H22 3.2504 no . .
C19 H23 3.2506 no . .
C20 H18 3.2533 no . .
C20 H22 3.2739 no . .
C20 H54 2.8557 no . .
C21 H19 3.3328 no . .
C21 H23 3.2650 no . .
C21 H54 3.0269 no . .
C22 H18 3.2475 no . .
C22 H20 3.2202 no . .
C23 H19 3.2508 no . .
C24 H22 3.1673 no . .
C24 H61 3.2405 no . .
C25 H61 3.0929 no . .
C26 H56 3.3317 no . .
C27 H22 3.4404 no . .
C27 H25 2.6418 no . .
C27 H61 3.3267 no . .
C28 H25 2.6272 no . .
C29 H47 3.2797 no . .
C30 H77 3.5816 no . .
C32 H20 2.8872 no . .
C32 H54 3.3417 no . .
C32 H77 3.5122 no . .
C32 H79 3.4953 no . .
C33 H20 3.5120 no . .
C33 H77 2.6314 no . .
C33 H79 2.6123 no . .
C40 H42 3.2608 no . .
C40 H44 3.2743 no . .
C41 H45 3.2497 no . .
C42 H40 3.2393 no . .
C42 H44 3.2600 no . .
C43 H41 3.2371 no . .
C43 H45 3.2664 no . .
C44 H40 3.2388 no . .
C44 H42 3.2829 no . .
C44 H50 3.5799 no . .
C45 H41 3.2451 no . .
C46 H51 3.3566 no . .
C47 H49 3.2505 no . .
C47 H50 3.2757 no . .
C48 H44 3.3002 no . .
C48 H46 3.2720 no . .
C48 H51 3.3285 no . .
C49 H47 3.2521 no . .
C49 H50 3.2436 no . .
C50 H44 3.2487 no . .
C50 H47 3.2590 no . .
C50 H49 3.2578 no . .
C51 H46 3.2612 no . .
C52 H54 3.2368 no . .
C52 H56 3.2427 no . .
C53 H57 3.2322 no . .
C54 H20 3.3179 no . .
C54 H52 3.2397 no . .
C54 H56 3.2379 no . .
C55 H20 3.5800 no . .
C55 H53 3.2496 no . .
C55 H57 3.2556 no . .
C56 H52 3.2437 no . .
C56 H54 3.2382 no . .
C57 H53 3.2329 no . .
C58 H44 3.5310 no . .
C58 H50 3.1954 no . .
C58 H61 2.6376 no . .
C58 H62 2.6151 no . .
C59 H44 2.9889 no . .
C59 H50 2.7515 no . .
C59 H61 3.5337 no . .
C59 H62 3.4750 no . .
C60 H61 3.2611 no . 3_565
C60 H62 3.2602 no . 3_565
C61 H62 3.2694 no . .
C62 H61 3.2711 no . .
C75 H30 2.5670 no . .
C76 H30 2.6929 no . .
C77 H30 3.5577 no . .
C77 H79 3.2636 no . .
C78 H77 3.2535 no . 3_666
C78 H79 3.2729 no . 3_666
C79 H77 3.2601 no . .
H18 H19 2.2540 no . .
H18 H23 2.3234 no . .
H19 H20 2.4106 no . .
H20 H54 2.5434 no . .
H22 H23 2.3541 no . .
H25 H61 2.9735 no . .
H30 H77 3.5378 no . .
H40 H41 2.3233 no . .
H41 H42 2.2885 no . .
H42 H45 2.3780 no . .
H44 H45 2.3442 no . .
H44 H50 2.8711 no . .
H46 H47 2.3596 no . .
H46 H49 2.3213 no . .
H49 H51 2.4022 no . .
H50 H51 2.3347 no . .
H50 H62 3.3686 no . .
H52 H53 2.3159 no . .
H52 H57 2.3198 no . .
H53 H54 2.3318 no . .
H56 H57 2.3349 no . .
H61 H62 2.3220 no . 3_565
H77 H79 2.3265 no . 3_666
F34 H49 3.5956 no . 1_565
F35 H41 3.3111 no . 4_564
F35 H44 2.6975 no . 2_555
F35 H45 3.1103 no . 2_555
F36 H44 3.5184 no . 2_555
F36 H50 2.9982 no . 2_555
F36 H62 3.2614 no . 2_555
F37 H40 2.9702 no . 4_564
F37 H41 3.0381 no . 4_564
F38 H56 3.3804 no . 4_564
F38 H57 3.2096 no . 4_564
F39 H46 2.6291 no . 4_554
F39 H49 2.6818 no . 4_554
F63 H18 2.5155 no . 3_665
F63 H19 3.0493 no . 3_665
F64 H20 3.0922 no . 2_645
F64 H52 3.5779 no . 1_545
F64 H53 3.5260 no . 2_645
F64 H54 2.6051 no . 2_645
F65 H20 3.5944 no . 2_645
F65 H30 3.4802 no . 4_554
F65 H52 3.0025 no . 1_545
F65 H53 3.4428 no . 1_545
F65 H79 3.3471 no . 2_645
F66 H30 3.2932 no . 4_554
F66 H45 3.3497 no . 2_545
F66 H47 3.2165 no . 4_554
F67 H45 3.3070 no . 2_545
F68 H42 3.4110 no . 2_545
F68 H45 2.8445 no . 2_545
F68 H46 3.4531 no . 4_554
F69 H19 2.9496 no . 2_645
F69 H20 3.5546 no . 2_645
F69 H52 2.4902 no . 1_545
F70 H52 3.5631 no . 1_545
F70 H57 3.4140 no . 1_545
F71 H14 3.0470 no . 4_555
F71 H19 3.0278 no . 2_645
F73 H25 3.0279 no . 4_565
F74 H22 2.8584 no . 4_565
F74 H23 3.2245 no . 4_565
C17 H45 3.4724 no . 2_545
C18 H18 3.2341 no . 3_665
C18 H19 3.2614 no . 3_665
C18 H79 2.9841 no . 4_564
C19 H18 3.1397 no . 3_665
C19 H79 2.8672 no . 4_564
C20 H53 3.1875 no . 2_645
C20 H79 3.4203 no . 4_564
C23 H19 3.5154 no . 3_665
C25 H41 3.3703 no . 4_564
C32 H53 3.3569 no . 2_645
C33 H53 3.0991 no . 2_645
C40 H45 3.5175 no . 3_566
C41 H25 3.3823 no . 4_565
C41 H45 3.5965 no . 3_566
C41 H61 3.2852 no . 4_565
C41 H62 2.9255 no . 2_555
C42 H62 3.0080 no . 2_555
C43 H42 3.5451 no . 3_566
C43 H51 3.4491 no . 2_555
C44 H42 3.5099 no . 3_566
C44 H51 2.9668 no . 2_555
C45 H51 3.4576 no . 2_555
C46 H42 3.3921 no . 3_566
C47 H42 3.0968 no . 3_566
C48 H42 3.1463 no . 3_566
C50 H42 3.4536 no . 3_566
C51 H61 3.5783 no . 2_545
C52 H23 3.3656 no . 4_565
C53 H20 3.3805 no . 2_655
C54 H77 3.5521 no . 2_655
C56 H23 3.2962 no . 4_565
C57 H23 3.1073 no . 4_565
C58 H49 3.5814 no . 2_555
C58 H51 2.8410 no . 2_555
C59 H51 3.0759 no . 2_555
C60 H49 3.0007 no . 2_555
C60 H49 3.5621 no . 4_554
C60 H51 3.1548 no . 2_555
C61 H41 3.1266 no . 4_564
C61 H49 3.3674 no . 2_555
C61 H49 3.2195 no . 4_554
C61 H51 3.4397 no . 2_555
C62 H41 3.2572 no . 2_545
C62 H42 3.3587 no . 2_545
C62 H49 2.9183 no . 2_555
C76 H52 3.5328 no . 1_545
C77 H53 3.5451 no . 2_645
C77 H54 3.3873 no . 2_645
C78 H53 3.3918 no . 2_645
H14 F71 3.0470 no . 4_554
H14 H30 2.9377 no . 4_554
H14 H52 3.0889 no . 1_545
H18 F63 2.5155 no . 3_665
H18 C18 3.2341 no . 3_665
H18 C19 3.1397 no . 3_665
H18 H18 3.2927 no . 3_665
H18 H19 3.0044 no . 3_665
H18 H79 3.1585 no . 4_564
H19 F63 3.0493 no . 3_665
H19 F69 2.9496 no . 2_655
H19 F71 3.0278 no . 2_655
H19 C18 3.2614 no . 3_665
H19 C23 3.5154 no . 3_665
H19 H18 3.0044 no . 3_665
H19 H23 3.4534 no . 3_665
H19 H52 3.3843 no . 2_645
H19 H79 3.0908 no . 4_564
H20 F64 3.0922 no . 2_655
H20 F65 3.5944 no . 2_655
H20 F69 3.5546 no . 2_655
H20 C53 3.3805 no . 2_645
H20 H52 3.2273 no . 2_645
H20 H53 2.6709 no . 2_645
H20 H77 3.5698 no . 2_655
H22 F74 2.8584 no . 4_564
H23 F74 3.2245 no . 4_564
H23 C52 3.3656 no . 4_564
H23 C56 3.2962 no . 4_564
H23 C57 3.1073 no . 4_564
H23 H19 3.4534 no . 3_665
H23 H57 3.3447 no . 4_564
H25 F73 3.0279 no . 4_564
H25 C41 3.3823 no . 4_564
H25 H40 3.3055 no . 4_564
H25 H41 2.5906 no . 4_564
H30 F65 3.4802 no . 4_555
H30 F66 3.2932 no . 4_555
H30 H14 2.9377 no . 4_555
H40 F37 2.9702 no . 4_565
H40 H25 3.3055 no . 4_565
H41 F35 3.3111 no . 4_565
H41 F37 3.0381 no . 4_565
H41 C25 3.3703 no . 4_565
H41 C61 3.1266 no . 4_565
H41 C62 3.2572 no . 2_555
H41 H25 2.5906 no . 4_565
H41 H61 2.4670 no . 4_565
H41 H62 2.7308 no . 2_555
H42 F68 3.4110 no . 2_555
H42 C43 3.5451 no . 3_566
H42 C44 3.5099 no . 3_566
H42 C46 3.3921 no . 3_566
H42 C47 3.0968 no . 3_566
H42 C48 3.1463 no . 3_566
H42 C50 3.4536 no . 3_566
H42 C62 3.3587 no . 2_555
H42 H47 3.4096 no . 3_566
H42 H61 3.5197 no . 4_565
H42 H62 2.8931 no . 2_555
H44 F35 2.6975 no . 2_545
H44 F36 3.5184 no . 2_545
H44 H51 2.8476 no . 2_555
H45 F35 3.1103 no . 2_545
H45 F66 3.3497 no . 2_555
H45 F67 3.3070 no . 2_555
H45 F68 2.8445 no . 2_555
H45 C17 3.4724 no . 2_555
H45 C40 3.5175 no . 3_566
H45 C41 3.5965 no . 3_566
H46 F39 2.6291 no . 4_555
H46 F68 3.4531 no . 4_555
H47 F66 3.2165 no . 4_555
H47 H42 3.4096 no . 3_566
H49 F34 3.5956 no . 1_545
H49 F39 2.6818 no . 4_555
H49 C58 3.5814 no . 2_545
H49 C60 3.0007 no . 2_545
H49 C60 3.5621 no . 4_555
H49 C61 3.3674 no . 2_545
H49 C61 3.2195 no . 4_555
H49 C62 2.9183 no . 2_545
H49 H62 3.2324 no . 2_545
H50 F36 2.9982 no . 2_545
H51 C43 3.4491 no . 2_545
H51 C44 2.9668 no . 2_545
H51 C45 3.4576 no . 2_545
H51 C58 2.8410 no . 2_545
H51 C59 3.0759 no . 2_545
H51 C60 3.1548 no . 2_545
H51 C61 3.4397 no . 2_545
H51 H44 2.8476 no . 2_545
H51 H61 3.4070 no . 2_545
H52 F64 3.5779 no . 1_565
H52 F65 3.0025 no . 1_565
H52 F69 2.4902 no . 1_565
H52 F70 3.5631 no . 1_565
H52 C76 3.5328 no . 1_565
H52 H14 3.0889 no . 1_565
H52 H19 3.3843 no . 2_655
H52 H20 3.2273 no . 2_655
H53 F64 3.5260 no . 2_655
H53 F65 3.4428 no . 1_565
H53 C20 3.1875 no . 2_655
H53 C32 3.3569 no . 2_655
H53 C33 3.0991 no . 2_655
H53 C77 3.5451 no . 2_655
H53 C78 3.3918 no . 2_655
H53 H20 2.6709 no . 2_655
H53 H77 3.3798 no . 2_655
H54 F64 2.6051 no . 2_655
H54 C77 3.3873 no . 2_655
H54 H77 2.8729 no . 2_655
H56 F38 3.3804 no . 4_565
H57 F38 3.2096 no . 4_565
H57 F70 3.4140 no . 1_565
H57 H23 3.3447 no . 4_565
H61 C41 3.2852 no . 4_564
H61 C51 3.5783 no . 2_555
H61 H41 2.4670 no . 4_564
H61 H42 3.5197 no . 4_564
H61 H51 3.4070 no . 2_555
H62 F36 3.2614 no . 2_545
H62 C41 2.9255 no . 2_545
H62 C42 3.0080 no . 2_545
H62 H41 2.7308 no . 2_545
H62 H42 2.8931 no . 2_545
H62 H49 3.2324 no . 2_555
H77 C54 3.5521 no . 2_645
H77 H20 3.5698 no . 2_645
H77 H53 3.3798 no . 2_645
H77 H54 2.8729 no . 2_645
H79 F65 3.3471 no . 2_655
H79 C18 2.9841 no . 4_565
H79 C19 2.8672 no . 4_565
H79 C20 3.4203 no . 4_565
H79 H18 3.1585 no . 4_565
H79 H19 3.0908 no . 4_565

#==============================================================================

#==============================================================================
# Additional structures and associated data_? identifiers
# should be added at this point if there is more than one 
# structure analysis in the CIF.

#==============================================================================
#     End of CIF
#==============================================================================
_chemical_name_common            '[Eu(hfa)3(p-dpeb)]n'
_exptl_crystal_recrystallization_method 
'Re-crystallisation from solvent: methanol'
_exptl_crystal_preparation       Luminescent
####################################################################### 
# 
# 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_SX342
_audit_block_doi                 10.5517/cc13tmp7
_database_code_depnum_ccdc_archive 'CCDC 1037529'
loop_
_citation_id
_citation_doi
_citation_year
1 10.1021/acs.inorgchem.5b00145 2015
_audit_update_record             
;
2014-12-04 deposited with the CCDC.
2018-08-28 downloaded from the CCDC.
;

#==============================================================================
# CHEMICAL DATA

_chemical_formula_sum            'C98 H54 Eu2 F36 O16 P4'
_chemical_formula_moiety         'C98 H54 Eu2 F36 O16 P4'
_chemical_formula_weight         2599.25
_chemical_melting_point          ?

#==============================================================================
# CRYSTAL DATA
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_Int_Tables_number      14
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1 +X,+Y,+Z
2 1/2-X,1/2+Y,1/2-Z
3 -X,-Y,-Z
4 1/2+X,1/2-Y,1/2+Z
#------------------------------------------------------------------------------
_cell_length_a                   12.5432(9)
_cell_length_b                   30.3644(15)
_cell_length_c                   12.9212(9)
_cell_angle_alpha                90.0000
_cell_angle_beta                 90.378(6)
_cell_angle_gamma                90.0000
_cell_volume                     4921.1(5)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    34458
_cell_measurement_theta_min      3.02
_cell_measurement_theta_max      27.49
_cell_measurement_temperature    296
#------------------------------------------------------------------------------
_exptl_crystal_description       block
_exptl_crystal_colour            colourless
_exptl_crystal_size_max          0.100
_exptl_crystal_size_mid          0.100
_exptl_crystal_size_min          0.100
_exptl_crystal_density_diffrn    1.754
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2560.00
_exptl_absorpt_coefficient_mu    1.459
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'ABSCOR (Rigaku, 1995)'
_exptl_absorpt_correction_T_min  0.611
_exptl_absorpt_correction_T_max  0.864

#==============================================================================
# EXPERIMENTAL DATA

_diffrn_ambient_temperature      296
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71075
_diffrn_measurement_device_type  'Rigaku R-AXIS RAPID'
_diffrn_measurement_method       ω
_diffrn_detector_area_resol_mean 10.000
_diffrn_reflns_number            48310
_diffrn_reflns_av_R_equivalents  0.0853
_diffrn_reflns_theta_max         27.48
_diffrn_reflns_theta_min         3.02
_diffrn_reflns_theta_full        27.48
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measured_fraction_theta_full 0.998
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_k_min       -39
_diffrn_reflns_limit_k_max       39
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_limit_l_max       16
_diffrn_standards_number         0
_diffrn_standards_interval_count .
_diffrn_standards_decay_%        ?

#==============================================================================
# REFINEMENT DATA

_refine_special_details          
;
    Refinement was performed using all reflections. The weighted 
    R-factor (wR) and goodness of fit (S) are based on F².
    R-factor (gt) are based on F. The threshold expression of
    F² > 2.0 sigma(F²) is used only for calculating R-factor (gt).
;
_reflns_number_total             11257
_reflns_number_gt                8255
_reflns_threshold_expression     F²>2.0σ(F²)
_refine_ls_structure_factor_coef Fsqd
_refine_ls_R_factor_gt           0.0439
_refine_ls_wR_factor_ref         0.0728
_refine_ls_number_restraints     228
_refine_ls_hydrogen_treatment    constr
_refine_ls_number_reflns         11256
_refine_ls_number_parameters     759
_refine_ls_goodness_of_fit_ref   1.008
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w = 1/[σ²(Fo²)+(0.0289P)²+0.5786P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_refine_ls_shift/su_max          0.002
_refine_diff_density_max         0.81
_refine_diff_density_min         -0.71
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?

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 for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
H H 0.0000 0.0000
;
International Tables for Crystallography
(1992, Vol. C, Table 6.1.1.4)
;
Eu Eu -0.1578 3.6682
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
F F 0.0171 0.0103
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
O O 0.0106 0.0060
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
P P 0.1023 0.0942
;
International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;

#==============================================================================
# ATOMIC COORDINATES AND THERMAL PARAMETERS

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_multiplicity
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Eu1 Eu 0.72794(2) 0.12274(2) 0.75873(2) 0.01854(5) Uani 1 4 0 d . . .
P1 P 0.70667(7) -0.00004(3) 0.82111(8) 0.02065(19) Uani 1 4 0 d . . .
P2 P 0.49065(7) 0.14711(3) 0.91807(8) 0.0224(2) Uani 1 4 0 d . . .
F4 F 1.08178(19) 0.18138(8) 0.6336(2) 0.0484(6) Uani 1 4 0 d . . .
F5 F 0.7100(3) 0.28526(8) 0.5339(2) 0.0760(10) Uani 1 4 0 d . . .
F6 F 0.7345(2) 0.30347(7) 0.9015(2) 0.0504(7) Uani 1 4 0 d . . .
F7 F 0.7240(3) 0.22290(10) 0.4639(2) 0.0725(9) Uani 1 4 0 d . . .
F8 F 0.7341(2) 0.24921(7) 1.0058(2) 0.0503(7) Uani 1 4 0 d . . .
F9 F 1.0067(2) 0.23641(8) 0.7031(3) 0.0678(9) Uani 1 4 0 d . . .
F10 F 0.57512(19) 0.24394(10) 0.5169(2) 0.0706(9) Uani 1 4 0 d . . .
F11 F 0.8724(2) 0.13191(10) 1.1118(2) 0.0694(9) Uani 1 4 0 d . . .
F13 F 0.87621(18) 0.26553(8) 0.9238(2) 0.0539(7) Uani 1 4 0 d . . .
F14 F 1.0377(2) 0.13907(10) 1.0857(2) 0.0679(9) Uani 1 4 0 d . . .
F42 F 0.9175(7) 0.1086(3) 0.4391(8) 0.056(2) Uani 0.515(13) 4 0 d . . .
F53 F 0.4121(5) 0.13666(16) 0.5190(6) 0.073(2) Uani 0.666(11) 4 0 d . . .
F60 F 0.9638(3) 0.07729(8) 1.0648(2) 0.0691(9) Uani 1 4 0 d . . .
F61 F 0.4403(8) 0.0811(3) 0.4233(4) 0.0522(17) Uani 0.666(11) 4 0 d . . .
F70 F 0.8634(10) 0.04289(18) 0.4161(8) 0.083(3) Uani 0.515(13) 4 0 d . . .
F71 F 0.7947(5) 0.0958(4) 0.3316(4) 0.062(2) Uani 0.515(13) 4 0 d . . .
F72 F 0.3893(4) 0.0727(3) 0.5809(4) 0.074(2) Uani 0.666(11) 4 0 d . . .
F73 F 1.1407(2) 0.20577(10) 0.7771(2) 0.0712(9) Uani 1 4 0 d . . .
O62 O 0.84002(18) 0.11167(7) 0.9059(2) 0.0245(5) Uani 1 4 0 d . . .
O63 O 0.89814(18) 0.15502(7) 0.7238(2) 0.0252(5) Uani 1 4 0 d . . .
O64 O 0.68662(18) 0.18158(7) 0.6439(2) 0.0271(6) Uani 1 4 0 d . . .
O65 O 0.73687(18) 0.19186(7) 0.85280(19) 0.0236(5) Uani 1 4 0 d . . .
O66 O 0.79360(18) 0.09441(7) 0.5979(2) 0.0255(5) Uani 1 4 0 d . . .
O67 O 0.57743(18) 0.10194(7) 0.6504(2) 0.0266(6) Uani 1 4 0 d . . .
O68 O 0.58340(17) 0.12392(7) 0.86996(19) 0.0258(5) Uani 1 4 0 d . . .
O69 O 0.72570(17) 0.04652(7) 0.79000(19) 0.0228(5) Uani 1 4 0 d . . .
C1 C 0.0557(3) 0.02469(12) 0.8486(3) 0.0279(8) Uani 1 4 0 d . . .
C2 C 0.4664(3) 0.20101(11) 0.8670(3) 0.0247(8) Uani 1 4 0 d . . .
C3 C 0.8039(3) -0.02816(11) 1.0183(3) 0.0230(8) Uani 1 4 0 d . . .
C6 C 0.7642(3) -0.01488(11) 0.9399(3) 0.0246(8) Uani 1 4 0 d . . .
C11 C 0.9243(3) 0.13010(11) 0.9368(3) 0.0253(8) Uani 1 4 0 d . . .
C12 C 0.4176(3) -0.04730(11) 0.9118(3) 0.0290(9) Uani 1 4 0 d . . .
C13 C 0.5251(3) -0.03720(11) 0.9108(3) 0.0278(8) Uani 1 4 0 d . . .
C15 C 0.5062(3) 0.15187(10) 1.0546(3) 0.0233(8) Uani 1 4 0 d . . .
C16 C 0.6088(3) 0.15983(11) 1.0929(3) 0.0284(9) Uani 1 4 0 d . . .
C17 C 0.2957(3) 0.09761(11) 0.8651(3) 0.0236(8) Uani 1 4 0 d . . .
C18 C 0.2016(3) 0.07575(11) 0.8271(3) 0.0227(8) Uani 1 4 0 d . . .
C19 C 0.7538(3) 0.08988(11) 0.5096(3) 0.0287(8) Uani 1 4 0 d . . .
C20 C 0.6981(3) 0.22245(11) 0.6456(3) 0.0265(8) Uani 1 4 0 d . . .
C21 C 0.9738(3) 0.16749(11) 0.7798(3) 0.0265(8) Uani 1 4 0 d . . .
C22 C 0.1503(3) 0.04276(10) 0.8861(3) 0.0217(7) Uani 1 4 0 d . . .
C23 C 0.7657(3) -0.03661(10) 0.7294(3) 0.0226(8) Uani 1 4 0 d . . .
C24 C 0.5677(3) -0.01282(10) 0.8307(3) 0.0237(8) Uani 1 4 0 d . . .
C25 C 0.1577(3) 0.08813(11) 0.7331(3) 0.0250(8) Uani 1 4 0 d . . .
C26 C 0.0643(3) 0.06963(12) 0.6972(3) 0.0295(8) Uani 1 4 0 d . . .
C27 C 0.3726(3) 0.11764(11) 0.8936(3) 0.0270(8) Uani 1 4 0 d . . .
C28 C 0.6235(3) 0.16512(12) 1.1979(3) 0.0345(9) Uani 1 4 0 d . . .
C29 C 0.7737(3) -0.02340(11) 0.6279(3) 0.0288(9) Uani 1 4 0 d . . .
C30 C 0.9504(3) 0.11974(12) 1.0501(3) 0.0320(9) Uani 1 4 0 d . . .
C31 C 0.8015(3) -0.07873(11) 0.7576(3) 0.0299(9) Uani 1 4 0 d . . .
C32 C 0.7404(3) 0.23127(11) 0.8272(3) 0.0232(8) Uani 1 4 0 d . . .
C33 C 0.4205(3) 0.14941(11) 1.1226(3) 0.0278(8) Uani 1 4 0 d . . .
C35 C 0.0135(3) 0.03817(12) 0.7547(3) 0.0324(9) Uani 1 4 0 d . . .
C36 C 0.3529(3) -0.03365(11) 0.8320(3) 0.0303(9) Uani 1 4 0 d . . .
C37 C 0.4372(3) 0.15419(12) 1.2271(3) 0.0327(9) Uani 1 4 0 d . . .
C38 C 0.5674(3) 0.09581(11) 0.5562(3) 0.0287(9) Uani 1 4 0 d . . .
C39 C 0.8425(3) -0.10653(12) 0.6833(3) 0.0331(9) Uani 1 4 0 d . . .
C40 C 0.5017(3) 0.00188(13) 0.7517(3) 0.0344(9) Uani 1 4 0 d . . .
C41 C 0.3945(3) -0.00897(13) 0.7530(4) 0.0368(10) Uani 1 4 0 d . . .
C43 C 0.7706(3) 0.26257(11) 0.9149(3) 0.0315(9) Uani 1 4 0 d . . .
C44 C 0.4627(3) 0.27953(13) 0.8882(4) 0.0423(11) Uani 1 4 0 d . . .
C45 C 0.6766(3) 0.24422(13) 0.5399(4) 0.0348(10) Uani 1 4 0 d . . .
C46 C 0.4510(3) 0.09383(14) 0.5191(3) 0.0469(11) Uani 1 4 0 d . . .
C47 C 0.9922(3) 0.15772(11) 0.8827(3) 0.0280(8) Uani 1 4 0 d . . .
C48 C 0.4368(3) 0.20599(14) 0.7641(4) 0.0385(10) Uani 1 4 0 d . . .
C49 C 0.6463(3) 0.09061(13) 0.4823(3) 0.0348(9) Uani 1 4 0 d . . .
C50 C 0.8152(3) -0.05145(13) 0.5540(3) 0.0333(9) Uani 1 4 0 d . . .
C51 C 0.8480(3) -0.09311(12) 0.5820(3) 0.0343(9) Uani 1 4 0 d . . .
C52 C 0.8356(3) 0.08237(13) 0.4252(3) 0.0429(10) Uani 1 4 0 d . . .
C54 C 0.4327(3) 0.28424(14) 0.7876(4) 0.0439(11) Uani 1 4 0 d . . .
C55 C 0.7243(3) 0.24910(11) 0.7293(3) 0.0281(9) Uani 1 4 0 d . . .
C56 C 0.4789(3) 0.23773(12) 0.9290(3) 0.0348(9) Uani 1 4 0 d . . .
C57 C 0.5386(3) 0.16257(12) 1.2649(3) 0.0358(9) Uani 1 4 0 d . . .
C58 C 1.0521(3) 0.19805(13) 0.7240(4) 0.0369(10) Uani 1 4 0 d . . .
C59 C 0.4194(3) 0.24808(15) 0.7246(4) 0.0472(12) Uani 1 4 0 d . . .
H1 H 0.02053 0.00334 0.88711 0.0335 Uiso 1 4 0 calc R . .
H12 H 0.38925 -0.06332 0.96642 0.0348 Uiso 1 4 0 calc R . .
H13 H 0.5691 -0.04688 0.96437 0.0333 Uiso 1 4 0 calc R . .
H16 H 0.66635 0.16154 1.04815 0.0341 Uiso 1 4 0 calc R . .
H25 H 0.19181 0.10934 0.69337 0.0300 Uiso 1 4 0 calc R . .
H26 H 0.03568 0.0785 0.63397 0.0354 Uiso 1 4 0 calc R . .
H28 H 0.69153 0.17048 1.22392 0.0414 Uiso 1 4 0 calc R . .
H29 H 0.75103 0.00463 0.6088 0.0345 Uiso 1 4 0 calc R . .
H31 H 0.7975 -0.08791 0.8261 0.0359 Uiso 1 4 0 calc R . .
H33 H 0.352 0.14453 1.09718 0.0333 Uiso 1 4 0 calc R . .
H35 H -0.04973 0.0258 0.73041 0.0389 Uiso 1 4 0 calc R . .
H36 H 0.28099 -0.0411 0.83147 0.0363 Uiso 1 4 0 calc R . .
H37 H 0.38031 0.1518 1.27248 0.0392 Uiso 1 4 0 calc R . .
H39 H 0.8666 -0.13441 0.70188 0.0397 Uiso 1 4 0 calc R . .
H40 H 0.52906 0.01887 0.69819 0.0413 Uiso 1 4 0 calc R . .
H41 H 0.35013 0.00061 0.69967 0.0442 Uiso 1 4 0 calc R . .
H44 H 0.47235 0.30425 0.92963 0.0508 Uiso 1 4 0 calc R . .
H47 H 1.05103 0.16985 0.91625 0.0336 Uiso 1 4 0 calc R . .
H48 H 0.42864 0.18143 0.72183 0.0462 Uiso 1 4 0 calc R . .
H49 H 0.62692 0.08755 0.41303 0.0418 Uiso 1 4 0 calc R . .
H50 H 0.8209 -0.04221 0.48563 0.0399 Uiso 1 4 0 calc R . .
H51 H 0.87392 -0.11226 0.53192 0.0411 Uiso 1 4 0 calc R . .
H54 H 0.42093 0.31229 0.76099 0.0527 Uiso 1 4 0 calc R . .
H55 H 0.73129 0.27931 0.71965 0.0338 Uiso 1 4 0 calc R . .
H56 H 0.49813 0.23446 0.99821 0.0418 Uiso 1 4 0 calc R . .
H57 H 0.54953 0.16649 1.33552 0.0429 Uiso 1 4 0 calc R . .
H59 H 0.39892 0.25173 0.65585 0.0566 Uiso 1 4 0 calc R . .
F53B F 0.4223(10) 0.0499(3) 0.5399(11) 0.074(3) Uani 0.334(11) 4 0 d . . .
F61B F 0.3836(7) 0.1168(5) 0.5718(10) 0.081(3) Uani 0.334(11) 4 0 d . . .
F72B F 0.4292(16) 0.0972(4) 0.4195(6) 0.050(3) Uani 0.334(11) 4 0 d . . .
F42B F 0.9090(6) 0.0500(2) 0.4583(7) 0.052(2) Uani 0.485(13) 4 0 d . . .
F70B F 0.8021(6) 0.0652(5) 0.3374(6) 0.088(3) Uani 0.485(13) 4 0 d . . .
F71B F 0.8962(8) 0.1158(2) 0.4059(10) 0.056(2) Uani 0.485(13) 4 0 d . . .



#==============================================================================
_computing_data_collection       'RAPID AUTO (Rigaku, ????)'
_computing_cell_refinement       'RAPID AUTO'
_computing_data_reduction        'RAPID AUTO'
_computing_structure_solution    'SIR2011 (Burla, et al., 2012)'
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2013)'
_computing_publication_material  'CrystalStructure 4.1 (Rigaku, 2013)'
_computing_molecular_graphics    'CrystalStructure 4.1'

#==============================================================================
# MOLECULAR GEOMETRY

_geom_special_details            
;
    ENTER SPECIAL DETAILS OF THE MOLECULAR GEOMETRY
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_publ_flag
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
Eu1 O62 2.381(2) yes . .
Eu1 O63 2.395(2) yes . .
Eu1 O64 2.378(2) yes . .
Eu1 O65 2.428(2) yes . .
Eu1 O66 2.400(3) yes . .
Eu1 O67 2.427(2) yes . .
Eu1 O68 2.321(2) yes . .
Eu1 O69 2.350(2) yes . .
P1 O69 1.489(2) yes . .
P1 C6 1.751(4) yes . .
P1 C23 1.788(4) yes . .
P1 C24 1.790(3) yes . .
P2 O68 1.498(2) yes . .
P2 C2 1.790(4) yes . .
P2 C15 1.780(4) yes . .
P2 C27 1.757(3) yes . .
F4 C58 1.329(5) yes . .
F5 C45 1.317(5) yes . .
F6 C43 1.333(4) yes . .
F7 C45 1.321(5) yes . .
F8 C43 1.327(5) yes . .
F9 C58 1.323(5) yes . .
F10 C45 1.305(5) yes . .
F11 C30 1.320(5) yes . .
F13 C43 1.332(4) yes . .
F14 C30 1.322(5) yes . .
F42 C52 1.311(10) yes . .
F53 C46 1.389(7) yes . .
F60 C30 1.314(4) yes . .
F61 C46 1.303(7) yes . .
F70 C52 1.254(8) yes . .
F71 C52 1.373(8) yes . .
F72 C46 1.287(8) yes . .
F73 C58 1.324(5) yes . .
O62 C11 1.259(4) yes . .
O63 C21 1.248(4) yes . .
O64 C20 1.250(4) yes . .
O65 C32 1.242(4) yes . .
O66 C19 1.249(5) yes . .
O67 C38 1.236(5) yes . .
C1 C22 1.391(5) yes . .
C1 C35 1.383(6) yes . .
C2 C48 1.386(6) yes . .
C2 C56 1.381(5) yes . .
C3 C6 1.196(5) yes . .
C3 C22 1.429(5) yes . 3_657
C11 C30 1.530(5) yes . .
C11 C47 1.388(5) yes . .
C12 C13 1.383(5) yes . .
C12 C36 1.372(6) yes . .
C13 C24 1.382(5) yes . .
C15 C16 1.396(5) yes . .
C15 C33 1.395(5) yes . .
C16 C28 1.377(6) yes . .
C17 C18 1.438(5) yes . .
C17 C27 1.197(5) yes . .
C18 C22 1.417(5) yes . .
C18 C25 1.382(5) yes . .
C19 C49 1.392(5) yes . .
C19 C52 1.519(6) yes . .
C20 C45 1.539(6) yes . .
C20 C55 1.388(5) yes . .
C21 C47 1.380(6) yes . .
C21 C58 1.534(5) yes . .
C23 C29 1.375(6) yes . .
C23 C31 1.403(5) yes . .
C24 C40 1.385(5) yes . .
C25 C26 1.377(5) yes . .
C26 C35 1.370(5) yes . .
C28 C57 1.379(6) yes . .
C29 C50 1.384(5) yes . .
C31 C39 1.381(6) yes . .
C32 C43 1.525(5) yes . .
C32 C55 1.389(5) yes . .
C33 C37 1.372(6) yes . .
C36 C41 1.372(6) yes . .
C37 C57 1.383(6) yes . .
C38 C46 1.535(5) yes . .
C38 C49 1.389(6) yes . .
C39 C51 1.373(6) yes . .
C40 C41 1.384(5) yes . .
C44 C54 1.357(7) yes . .
C44 C56 1.389(6) yes . .
C46 F53B 1.408(11) yes . .
C46 F61B 1.294(13) yes . .
C46 F72B 1.318(9) yes . .
C48 C59 1.393(6) yes . .
C50 C51 1.378(5) yes . .
C52 F42B 1.410(8) yes . .
C52 F70B 1.315(10) yes . .
C52 F71B 1.295(9) yes . .
C54 C59 1.376(6) yes . .
C1 H1 0.930 no . .
C12 H12 0.930 no . .
C13 H13 0.930 no . .
C16 H16 0.930 no . .
C25 H25 0.930 no . .
C26 H26 0.930 no . .
C28 H28 0.930 no . .
C29 H29 0.930 no . .
C31 H31 0.930 no . .
C33 H33 0.930 no . .
C35 H35 0.930 no . .
C36 H36 0.930 no . .
C37 H37 0.930 no . .
C39 H39 0.930 no . .
C40 H40 0.930 no . .
C41 H41 0.930 no . .
C44 H44 0.930 no . .
C47 H47 0.930 no . .
C48 H48 0.930 no . .
C49 H49 0.930 no . .
C50 H50 0.930 no . .
C51 H51 0.930 no . .
C54 H54 0.930 no . .
C55 H55 0.930 no . .
C56 H56 0.930 no . .
C57 H57 0.930 no . .
C59 H59 0.930 no . .

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_publ_flag
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
O62 Eu1 O63 71.70(8) yes . . .
O62 Eu1 O64 136.86(8) yes . . .
O62 Eu1 O65 72.37(8) yes . . .
O62 Eu1 O66 115.90(8) yes . . .
O62 Eu1 O67 151.28(8) yes . . .
O62 Eu1 O68 88.12(8) yes . . .
O62 Eu1 O69 74.41(8) yes . . .
O63 Eu1 O64 76.45(8) yes . . .
O63 Eu1 O65 72.68(8) yes . . .
O63 Eu1 O66 70.85(8) yes . . .
O63 Eu1 O67 133.54(9) yes . . .
O63 Eu1 O68 144.23(8) yes . . .
O63 Eu1 O69 116.57(8) yes . . .
O64 Eu1 O65 70.85(8) yes . . .
O64 Eu1 O66 78.66(8) yes . . .
O64 Eu1 O67 70.72(8) yes . . .
O64 Eu1 O68 101.94(8) yes . . .
O64 Eu1 O69 147.64(8) yes . . .
O65 Eu1 O66 136.76(8) yes . . .
O65 Eu1 O67 123.17(8) yes . . .
O65 Eu1 O68 73.16(8) yes . . .
O65 Eu1 O69 140.00(8) yes . . .
O66 Eu1 O67 71.17(8) yes . . .
O66 Eu1 O68 144.64(8) yes . . .
O66 Eu1 O69 78.49(8) yes . . .
O67 Eu1 O68 75.72(8) yes . . .
O67 Eu1 O69 80.37(8) yes . . .
O68 Eu1 O69 84.17(8) yes . . .
O69 P1 C6 114.51(15) yes . . .
O69 P1 C23 110.04(15) yes . . .
O69 P1 C24 112.47(14) yes . . .
C6 P1 C23 104.54(17) yes . . .
C6 P1 C24 106.22(17) yes . . .
C23 P1 C24 108.60(16) yes . . .
O68 P2 C2 114.01(15) yes . . .
O68 P2 C15 111.65(15) yes . . .
O68 P2 C27 109.97(15) yes . . .
C2 P2 C15 107.98(16) yes . . .
C2 P2 C27 104.99(16) yes . . .
C15 P2 C27 107.87(17) yes . . .
Eu1 O62 C11 132.9(2) yes . . .
Eu1 O63 C21 133.6(2) yes . . .
Eu1 O64 C20 135.3(2) yes . . .
Eu1 O65 C32 134.5(2) yes . . .
Eu1 O66 C19 133.8(2) yes . . .
Eu1 O67 C38 132.9(2) yes . . .
Eu1 O68 P2 151.14(14) yes . . .
Eu1 O69 P1 169.57(14) yes . . .
C22 C1 C35 120.6(3) yes . . .
P2 C2 C48 119.8(3) yes . . .
P2 C2 C56 120.4(3) yes . . .
C48 C2 C56 119.8(3) yes . . .
C6 C3 C22 178.0(4) yes . . 3_657
P1 C6 C3 175.1(3) yes . . .
O62 C11 C30 112.7(3) yes . . .
O62 C11 C47 128.7(3) yes . . .
C30 C11 C47 118.6(3) yes . . .
C13 C12 C36 119.9(4) yes . . .
C12 C13 C24 120.5(3) yes . . .
P2 C15 C16 117.4(3) yes . . .
P2 C15 C33 122.7(3) yes . . .
C16 C15 C33 119.9(3) yes . . .
C15 C16 C28 119.1(4) yes . . .
C18 C17 C27 176.6(4) yes . . .
C17 C18 C22 121.1(3) yes . . .
C17 C18 C25 119.8(3) yes . . .
C22 C18 C25 119.1(3) yes . . .
O66 C19 C49 127.7(4) yes . . .
O66 C19 C52 113.8(3) yes . . .
C49 C19 C52 118.5(4) yes . . .
O64 C20 C45 113.0(3) yes . . .
O64 C20 C55 128.3(4) yes . . .
C45 C20 C55 118.7(3) yes . . .
O63 C21 C47 127.9(3) yes . . .
O63 C21 C58 113.5(3) yes . . .
C47 C21 C58 118.6(3) yes . . .
C1 C22 C3 121.0(3) yes . . 3_657
C1 C22 C18 118.7(3) yes . . .
C3 C22 C18 120.2(3) yes 3_657 . .
P1 C23 C29 118.9(2) yes . . .
P1 C23 C31 121.8(3) yes . . .
C29 C23 C31 119.2(3) yes . . .
P1 C24 C13 123.3(3) yes . . .
P1 C24 C40 117.2(3) yes . . .
C13 C24 C40 119.5(3) yes . . .
C18 C25 C26 121.2(3) yes . . .
C25 C26 C35 120.0(4) yes . . .
P2 C27 C17 172.4(3) yes . . .
C16 C28 C57 120.9(4) yes . . .
C23 C29 C50 120.6(3) yes . . .
F11 C30 F14 106.3(3) yes . . .
F11 C30 F60 106.4(3) yes . . .
F11 C30 C11 111.4(3) yes . . .
F14 C30 F60 106.3(3) yes . . .
F14 C30 C11 114.4(3) yes . . .
F60 C30 C11 111.5(3) yes . . .
C23 C31 C39 119.8(4) yes . . .
O65 C32 C43 114.3(3) yes . . .
O65 C32 C55 127.8(3) yes . . .
C43 C32 C55 117.9(3) yes . . .
C15 C33 C37 120.0(3) yes . . .
C1 C35 C26 120.4(3) yes . . .
C12 C36 C41 119.9(3) yes . . .
C33 C37 C57 120.1(4) yes . . .
O67 C38 C46 113.8(3) yes . . .
O67 C38 C49 128.7(3) yes . . .
C46 C38 C49 117.5(4) yes . . .
C31 C39 C51 120.2(3) yes . . .
C24 C40 C41 119.4(4) yes . . .
C36 C41 C40 120.9(4) yes . . .
F6 C43 F8 106.3(3) yes . . .
F6 C43 F13 106.6(3) yes . . .
F6 C43 C32 113.7(3) yes . . .
F8 C43 F13 107.0(3) yes . . .
F8 C43 C32 112.5(3) yes . . .
F13 C43 C32 110.4(3) yes . . .
C54 C44 C56 119.9(4) yes . . .
F5 C45 F7 105.9(3) yes . . .
F5 C45 F10 107.6(3) yes . . .
F5 C45 C20 113.9(3) yes . . .
F7 C45 F10 105.7(4) yes . . .
F7 C45 C20 111.8(3) yes . . .
F10 C45 C20 111.4(3) yes . . .
F53 C46 F61 104.0(6) yes . . .
F53 C46 F72 104.8(5) yes . . .
F53 C46 C38 107.3(4) yes . . .
F61 C46 F72 112.5(6) yes . . .
F61 C46 C38 113.6(5) yes . . .
F72 C46 C38 113.6(4) yes . . .
C38 C46 F53B 102.8(6) yes . . .
C38 C46 F61B 116.0(6) yes . . .
C38 C46 F72B 119.5(9) yes . . .
F53B C46 F61B 104.0(9) yes . . .
F53B C46 F72B 102.0(9) yes . . .
F61B C46 F72B 109.9(10) yes . . .
C11 C47 C21 121.1(3) yes . . .
C2 C48 C59 119.5(4) yes . . .
C19 C49 C38 121.3(4) yes . . .
C29 C50 C51 119.8(4) yes . . .
C39 C51 C50 120.4(4) yes . . .
F42 C52 F70 112.0(8) yes . . .
F42 C52 F71 103.2(6) yes . . .
F42 C52 C19 110.1(5) yes . . .
F70 C52 F71 107.6(7) yes . . .
F70 C52 C19 113.6(6) yes . . .
F71 C52 C19 109.8(4) yes . . .
C19 C52 F42B 109.3(5) yes . . .
C19 C52 F70B 117.8(4) yes . . .
C19 C52 F71B 114.9(6) yes . . .
F42B C52 F70B 101.0(7) yes . . .
F42B C52 F71B 102.8(6) yes . . .
F70B C52 F71B 109.2(8) yes . . .
C44 C54 C59 120.9(4) yes . . .
C20 C55 C32 120.9(3) yes . . .
C2 C56 C44 120.1(4) yes . . .
C28 C57 C37 120.0(4) yes . . .
F4 C58 F9 106.2(4) yes . . .
F4 C58 F73 106.5(3) yes . . .
F4 C58 C21 111.5(3) yes . . .
F9 C58 F73 108.0(3) yes . . .
F9 C58 C21 110.6(3) yes . . .
F73 C58 C21 113.7(4) yes . . .
C48 C59 C54 119.8(4) yes . . .
C22 C1 H1 119.671 no . . .
C35 C1 H1 119.686 no . . .
C13 C12 H12 120.066 no . . .
C36 C12 H12 120.061 no . . .
C12 C13 H13 119.756 no . . .
C24 C13 H13 119.744 no . . .
C15 C16 H16 120.453 no . . .
C28 C16 H16 120.435 no . . .
C18 C25 H25 119.392 no . . .
C26 C25 H25 119.387 no . . .
C25 C26 H26 120.003 no . . .
C35 C26 H26 120.022 no . . .
C16 C28 H28 119.580 no . . .
C57 C28 H28 119.566 no . . .
C23 C29 H29 119.719 no . . .
C50 C29 H29 119.720 no . . .
C23 C31 H31 120.110 no . . .
C39 C31 H31 120.089 no . . .
C15 C33 H33 119.996 no . . .
C37 C33 H33 119.980 no . . .
C1 C35 H35 119.815 no . . .
C26 C35 H35 119.821 no . . .
C12 C36 H36 120.081 no . . .
C41 C36 H36 120.068 no . . .
C33 C37 H37 119.959 no . . .
C57 C37 H37 119.961 no . . .
C31 C39 H39 119.925 no . . .
C51 C39 H39 119.910 no . . .
C24 C40 H40 120.316 no . . .
C41 C40 H40 120.314 no . . .
C36 C41 H41 119.555 no . . .
C40 C41 H41 119.544 no . . .
C54 C44 H44 120.054 no . . .
C56 C44 H44 120.024 no . . .
C11 C47 H47 119.432 no . . .
C21 C47 H47 119.449 no . . .
C2 C48 H48 120.266 no . . .
C59 C48 H48 120.259 no . . .
C19 C49 H49 119.324 no . . .
C38 C49 H49 119.341 no . . .
C29 C50 H50 120.104 no . . .
C51 C50 H50 120.089 no . . .
C39 C51 H51 119.803 no . . .
C50 C51 H51 119.801 no . . .
C44 C54 H54 119.538 no . . .
C59 C54 H54 119.550 no . . .
C20 C55 H55 119.527 no . . .
C32 C55 H55 119.535 no . . .
C2 C56 H56 119.954 no . . .
C44 C56 H56 119.956 no . . .
C28 C57 H57 119.976 no . . .
C37 C57 H57 119.983 no . . .
C48 C59 H59 120.084 no . . .
C54 C59 H59 120.117 no . . .

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_publ_flag
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
O62 Eu1 O63 C21 -19.95(18) no . . . .
O63 Eu1 O62 C11 19.35(19) no . . . .
O62 Eu1 O64 C20 -17.1(3) no . . . .
O64 Eu1 O62 C11 -25.1(3) no . . . .
O62 Eu1 O65 C32 142.5(2) no . . . .
O65 Eu1 O62 C11 -57.71(19) no . . . .
O62 Eu1 O66 C19 171.06(17) no . . . .
O66 Eu1 O62 C11 76.3(2) no . . . .
O62 Eu1 O67 C38 -129.38(19) no . . . .
O67 Eu1 O62 C11 174.36(15) no . . . .
O62 Eu1 O68 P2 117.1(3) no . . . .
O68 Eu1 O62 C11 -130.6(2) no . . . .
O69 Eu1 O62 C11 144.9(2) no . . . .
O63 Eu1 O64 C20 -60.2(2) no . . . .
O64 Eu1 O63 C21 130.5(2) no . . . .
O63 Eu1 O65 C32 66.7(2) no . . . .
O65 Eu1 O63 C21 56.70(19) no . . . .
O63 Eu1 O66 C19 -131.5(2) no . . . .
O66 Eu1 O63 C21 -147.0(2) no . . . .
O63 Eu1 O67 C38 17.0(2) no . . . .
O67 Eu1 O63 C21 176.31(15) no . . . .
O63 Eu1 O68 P2 62.8(3) no . . . .
O68 Eu1 O63 C21 38.8(3) no . . . .
O69 Eu1 O63 C21 -81.1(2) no . . . .
O64 Eu1 O65 C32 -14.54(19) no . . . .
O65 Eu1 O64 C20 15.8(2) no . . . .
O64 Eu1 O66 C19 -52.06(19) no . . . .
O66 Eu1 O64 C20 -133.0(2) no . . . .
O64 Eu1 O67 C38 64.59(19) no . . . .
O67 Eu1 O64 C20 153.1(2) no . . . .
O64 Eu1 O68 P2 -20.6(3) no . . . .
O68 Eu1 O64 C20 83.1(2) no . . . .
O69 Eu1 O64 C20 -178.88(16) no . . . .
O65 Eu1 O66 C19 -97.5(2) no . . . .
O66 Eu1 O65 C32 33.2(3) no . . . .
O65 Eu1 O67 C38 114.53(18) no . . . .
O67 Eu1 O65 C32 -64.4(2) no . . . .
O65 Eu1 O68 P2 45.0(3) no . . . .
O68 Eu1 O65 C32 -124.1(2) no . . . .
O69 Eu1 O65 C32 177.67(16) no . . . .
O66 Eu1 O67 C38 -19.63(18) no . . . .
O67 Eu1 O66 C19 21.24(18) no . . . .
O66 Eu1 O68 P2 -107.8(3) no . . . .
O68 Eu1 O66 C19 42.6(3) no . . . .
O69 Eu1 O66 C19 104.9(2) no . . . .
O67 Eu1 O68 P2 -86.9(3) no . . . .
O68 Eu1 O67 C38 173.0(2) no . . . .
O69 Eu1 O67 C38 -100.65(19) no . . . .
O69 Eu1 O68 P2 -168.4(3) no . . . .
O69 P1 C23 C29 -29.9(3) no . . . .
O69 P1 C23 C31 151.8(2) no . . . .
O69 P1 C24 C13 -136.9(2) no . . . .
O69 P1 C24 C40 44.8(3) no . . . .
C6 P1 C23 C29 -153.3(2) no . . . .
C6 P1 C23 C31 28.4(3) no . . . .
C6 P1 C24 C13 -10.9(3) no . . . .
C6 P1 C24 C40 170.8(2) no . . . .
C23 P1 C24 C13 101.1(3) no . . . .
C23 P1 C24 C40 -77.2(2) no . . . .
C24 P1 C23 C29 93.6(2) no . . . .
C24 P1 C23 C31 -84.7(3) no . . . .
O68 P2 C2 C48 64.2(3) no . . . .
O68 P2 C2 C56 -114.7(2) no . . . .
C2 P2 O68 Eu1 4.7(4) no . . . .
O68 P2 C15 C16 37.2(2) no . . . .
O68 P2 C15 C33 -145.0(2) no . . . .
C15 P2 O68 Eu1 -118.0(3) no . . . .
C27 P2 O68 Eu1 122.3(3) no . . . .
C2 P2 C15 C16 -88.9(2) no . . . .
C2 P2 C15 C33 88.9(2) no . . . .
C15 P2 C2 C48 -171.1(2) no . . . .
C15 P2 C2 C56 10.0(3) no . . . .
C27 P2 C2 C48 -56.2(3) no . . . .
C27 P2 C2 C56 124.9(2) no . . . .
C27 P2 C15 C16 158.1(2) no . . . .
C27 P2 C15 C33 -24.0(3) no . . . .
Eu1 O62 C11 C30 164.60(15) no . . . .
Eu1 O62 C11 C47 -14.7(5) no . . . .
Eu1 O63 C21 C47 15.4(5) no . . . .
Eu1 O63 C21 C58 -163.23(15) no . . . .
Eu1 O64 C20 C45 168.54(16) no . . . .
Eu1 O64 C20 C55 -13.2(5) no . . . .
Eu1 O65 C32 C43 -166.83(15) no . . . .
Eu1 O65 C32 C55 10.4(5) no . . . .
Eu1 O66 C19 C49 -17.1(5) no . . . .
Eu1 O66 C19 C52 163.50(15) no . . . .
Eu1 O67 C38 C46 -166.05(14) no . . . .
Eu1 O67 C38 C49 14.0(5) no . . . .
C22 C1 C35 C26 -0.1(5) no . . . .
C35 C1 C22 C3 -178.2(3) no . . . 3_657
C35 C1 C22 C18 1.0(5) no . . . .
P2 C2 C48 C59 -179.2(2) no . . . .
P2 C2 C56 C44 178.3(2) no . . . .
C48 C2 C56 C44 -0.6(5) no . . . .
C56 C2 C48 C59 -0.3(5) no . . . .
O62 C11 C30 F11 -58.4(4) no . . . .
O62 C11 C30 F14 -179.1(3) no . . . .
O62 C11 C30 F60 60.3(4) no . . . .
O62 C11 C47 C21 -2.0(6) no . . . .
C30 C11 C47 C21 178.7(3) no . . . .
C47 C11 C30 F11 121.0(3) no . . . .
C47 C11 C30 F14 0.3(5) no . . . .
C47 C11 C30 F60 -120.3(3) no . . . .
C13 C12 C36 C41 -1.8(5) no . . . .
C36 C12 C13 C24 1.0(5) no . . . .
C12 C13 C24 P1 -177.6(3) no . . . .
C12 C13 C24 C40 0.6(5) no . . . .
P2 C15 C16 C28 177.9(2) no . . . .
P2 C15 C33 C37 -178.7(2) no . . . .
C16 C15 C33 C37 -0.9(5) no . . . .
C33 C15 C16 C28 0.0(5) no . . . .
C15 C16 C28 C57 0.1(5) no . . . .
C17 C18 C22 C1 175.9(3) no . . . .
C17 C18 C22 C3 -4.8(5) no . . . 3_657
C17 C18 C25 C26 -176.3(3) no . . . .
C22 C18 C25 C26 1.3(5) no . . . .
C25 C18 C22 C1 -1.6(5) no . . . .
C25 C18 C22 C3 177.6(3) no . . . 3_657
O66 C19 C49 C38 -1.6(6) no . . . .
O66 C19 C52 F42 -42.0(4) no . . . .
O66 C19 C52 F70 84.5(4) no . . . .
O66 C19 C52 F71 -155.0(3) no . . . .
O66 C19 C52 F42B 47.0(4) no . . . .
O66 C19 C52 F70B 161.3(3) no . . . .
O66 C19 C52 F71B -67.9(4) no . . . .
C49 C19 C52 F42 138.5(3) no . . . .
C49 C19 C52 F70 -95.0(4) no . . . .
C49 C19 C52 F71 25.6(4) no . . . .
C49 C19 C52 F42B -132.5(3) no . . . .
C49 C19 C52 F70B -18.2(5) no . . . .
C49 C19 C52 F71B 112.7(4) no . . . .
C52 C19 C49 C38 177.8(3) no . . . .
O64 C20 C45 F5 -166.1(3) no . . . .
O64 C20 C45 F7 -46.0(4) no . . . .
O64 C20 C45 F10 72.0(4) no . . . .
O64 C20 C55 C32 -0.8(6) no . . . .
C45 C20 C55 C32 177.4(3) no . . . .
C55 C20 C45 F5 15.4(5) no . . . .
C55 C20 C45 F7 135.5(3) no . . . .
C55 C20 C45 F10 -106.5(4) no . . . .
O63 C21 C47 C11 1.7(5) no . . . .
O63 C21 C58 F4 -49.5(4) no . . . .
O63 C21 C58 F9 68.4(4) no . . . .
O63 C21 C58 F73 -169.9(3) no . . . .
C47 C21 C58 F4 131.7(3) no . . . .
C47 C21 C58 F9 -110.4(4) no . . . .
C47 C21 C58 F73 11.3(5) no . . . .
C58 C21 C47 C11 -179.7(3) no . . . .
P1 C23 C29 C50 -177.5(2) no . . . .
P1 C23 C31 C39 177.3(2) no . . . .
C29 C23 C31 C39 -1.0(5) no . . . .
C31 C23 C29 C50 0.8(5) no . . . .
P1 C24 C40 C41 176.9(2) no . . . .
C13 C24 C40 C41 -1.5(5) no . . . .
C18 C25 C26 C35 -0.4(5) no . . . .
C25 C26 C35 C1 -0.3(5) no . . . .
C16 C28 C57 C37 0.6(5) no . . . .
C23 C29 C50 C51 0.5(5) no . . . .
C23 C31 C39 C51 -0.3(5) no . . . .
O65 C32 C43 F6 -154.6(3) no . . . .
O65 C32 C43 F8 -33.8(4) no . . . .
O65 C32 C43 F13 85.7(4) no . . . .
O65 C32 C55 C20 1.9(5) no . . . .
C43 C32 C55 C20 179.1(3) no . . . .
C55 C32 C43 F6 27.8(4) no . . . .
C55 C32 C43 F8 148.7(3) no . . . .
C55 C32 C43 F13 -91.9(4) no . . . .
C15 C33 C37 C57 1.7(5) no . . . .
C12 C36 C41 C40 1.0(6) no . . . .
C33 C37 C57 C28 -1.5(5) no . . . .
O67 C38 C46 F53 75.0(4) no . . . .
O67 C38 C46 F61 -170.6(3) no . . . .
O67 C38 C46 F72 -40.3(4) no . . . .
O67 C38 C46 F53B -82.9(3) no . . . .
O67 C38 C46 F61B 29.9(5) no . . . .
O67 C38 C46 F72B 165.1(3) no . . . .
O67 C38 C49 C19 3.0(6) no . . . .
C46 C38 C49 C19 -177.0(3) no . . . .
C49 C38 C46 F53 -105.1(4) no . . . .
C49 C38 C46 F61 9.3(5) no . . . .
C49 C38 C46 F72 139.6(3) no . . . .
C49 C38 C46 F53B 97.0(4) no . . . .
C49 C38 C46 F61B -150.2(3) no . . . .
C49 C38 C46 F72B -14.9(5) no . . . .
C31 C39 C51 C50 1.7(5) no . . . .
C24 C40 C41 C36 0.7(6) no . . . .
C54 C44 C56 C2 1.2(6) no . . . .
C56 C44 C54 C59 -0.9(6) no . . . .
C2 C48 C59 C54 0.6(6) no . . . .
C29 C50 C51 C39 -1.8(5) no . . . .
C44 C54 C59 C48 0.1(6) no . . . .

loop_
_geom_contact_atom_site_label_1
_geom_contact_atom_site_label_2
_geom_contact_distance
_geom_contact_publ_flag
_geom_contact_site_symmetry_1
_geom_contact_site_symmetry_2
P2 O65 3.483(2) no . .
F4 O63 2.709(3) no . .
F4 C47 3.490(5) no . .
F5 O64 3.467(3) no . .
F5 C55 2.758(5) no . .
F6 O65 3.447(3) no . .
F6 C44 3.490(5) no . .
F6 C55 2.774(4) no . .
F7 O64 2.686(4) no . .
F7 C55 3.520(5) no . .
F8 O65 2.635(3) no . .
F8 C16 3.336(4) no . .
F8 C55 3.575(5) no . .
F8 C56 3.364(5) no . .
F9 F13 3.414(4) no . .
F9 O63 2.835(3) no . .
F9 C47 3.336(5) no . .
F9 C55 3.581(4) no . .
F10 O64 2.864(4) no . .
F10 C55 3.316(5) no . .
F10 C59 3.332(5) no . .
F11 O62 2.758(4) no . .
F11 C16 3.421(4) no . .
F11 C28 3.471(5) no . .
F11 C47 3.420(5) no . .
F13 O65 2.980(3) no . .
F13 C55 3.183(5) no . .
F14 O62 3.487(4) no . .
F14 C47 2.740(5) no . .
F42 O66 2.618(10) no . .
F42 C49 3.494(10) no . .
F53 O67 2.872(7) no . .
F53 C49 3.290(7) no . .
F60 O62 2.770(4) no . .
F60 C1 3.302(4) no . 3_657
F60 C47 3.412(5) no . .
F61 O67 3.450(7) no . .
F61 C49 2.705(10) no . .
F70 O66 2.959(10) no . .
F70 C29 3.584(10) no . .
F70 C49 3.205(12) no . .
F70 C50 3.429(9) no . .
F71 O66 3.441(6) no . .
F71 C49 2.707(7) no . .
F72 O67 2.671(6) no . .
F72 C25 3.551(6) no . .
F72 C40 3.382(8) no . .
F72 C41 3.331(9) no . .
F72 C49 3.516(6) no . .
F73 O63 3.476(3) no . .
F73 C47 2.738(5) no . .
O62 C21 2.895(4) no . .
O63 C11 2.872(5) no . .
O63 C20 3.387(4) no . .
O63 C32 3.331(4) no . .
O63 C55 3.594(4) no . .
O64 C19 3.390(4) no . .
O64 C32 2.884(4) no . .
O64 C38 3.206(4) no . .
O64 C48 3.584(5) no . .
O64 C49 3.498(5) no . .
O65 C2 3.409(4) no . .
O65 C11 3.192(4) no . .
O65 C20 2.872(5) no . .
O65 C21 3.211(4) no . .
O65 C47 3.386(4) no . .
O66 C38 2.885(4) no . .
O66 F42B 2.683(8) no . .
O66 F70B 3.483(9) no . .
O66 F71B 2.876(12) no . .
O67 C19 2.896(5) no . .
O67 C40 3.444(5) no . .
O67 F53B 2.878(13) no . .
O67 F61B 2.667(10) no . .
O67 F72B 3.508(12) no . .
O68 C16 3.095(5) no . .
O68 C48 3.380(5) no . .
O69 C29 3.045(4) no . .
O69 C40 3.156(4) no . .
C1 C6 3.546(5) no . 3_657
C1 C25 2.757(5) no . .
C2 C32 3.597(5) no . .
C2 C54 2.759(6) no . .
C3 C17 2.881(5) no . 3_657
C3 C36 3.344(5) no . 3_657
C6 C12 3.536(5) no . 3_657
C6 C13 3.095(5) no . .
C6 C18 3.557(5) no . 3_657
C6 C31 3.089(5) no . .
C12 C13 3.512(5) no . 3_657
C12 C15 3.343(5) no . 3_657
C12 C16 3.433(5) no . 3_657
C12 C40 2.766(6) no . .
C13 C13 3.292(5) no . 3_657
C13 C15 3.533(5) no . 3_657
C13 C33 3.502(5) no . 3_657
C13 C41 2.744(6) no . .
C15 C56 3.089(5) no . .
C15 C57 2.763(6) no . .
C16 C37 2.777(6) no . .
C16 C56 3.562(5) no . .
C18 C35 2.778(5) no . .
C21 C32 3.567(5) no . .
C22 C26 2.785(5) no . .
C22 C27 3.599(5) no . .
C22 C36 3.515(5) no . .
C23 C40 3.526(5) no . .
C23 C51 2.768(5) no . .
C24 C36 2.768(5) no . .
C25 C27 3.507(5) no . .
C27 C33 3.167(5) no . .
C27 C48 3.265(6) no . .
C28 C33 2.760(5) no . .
C29 C39 2.761(5) no . .
C29 F42B 3.565(9) no . .
C31 C50 2.764(6) no . .
C32 C56 3.547(5) no . .
C40 F53B 3.251(14) no . .
C41 F53B 3.303(14) no . .
C44 C48 2.766(6) no . .
C49 F53B 3.163(13) no . .
C49 F61B 3.589(11) no . .
C49 F72B 2.844(19) no . .
C49 F42B 3.534(9) no . .
C49 F70B 2.822(9) no . .
C49 F71B 3.381(11) no . .
C50 F42B 3.526(8) no . .
C56 C59 2.757(6) no . .
F4 F6 3.598(4) no . 4_554
F4 F8 3.296(3) no . 4_554
F4 C25 3.250(4) no . 1_655
F4 C26 3.499(4) no . 1_655
F5 F14 3.228(4) no . 4_454
F5 F73 3.435(4) no . 4_454
F5 C33 3.490(5) no . 4_554
F6 F4 3.598(4) no . 4_455
F6 F53 3.244(7) no . 4_555
F6 C39 3.097(4) no . 2_656
F6 C51 3.314(4) no . 2_656
F7 F73 3.402(4) no . 4_454
F7 C44 3.157(5) no . 4_554
F7 C54 3.488(6) no . 4_554
F7 C56 3.446(5) no . 4_554
F8 F4 3.296(3) no . 4_455
F9 C28 3.330(4) no . 4_554
F9 C37 3.449(4) no . 4_554
F9 C57 3.194(4) no . 4_554
F10 F13 2.777(3) no . 4_454
F10 F73 3.556(4) no . 4_454
F11 F71 3.202(7) no . 1_556
F11 C54 3.492(5) no . 4_555
F13 F10 2.777(3) no . 4_555
F13 F53 3.245(6) no . 4_555
F14 F5 3.228(4) no . 4_555
F14 C31 3.388(5) no . 3_757
F14 C39 3.477(5) no . 3_757
F42 C39 3.410(10) no . 3_756
F42 C44 3.507(11) no . 4_554
F42 C51 2.993(10) no . 3_756
F53 F6 3.244(7) no . 4_454
F53 F13 3.245(6) no . 4_454
F60 C1 3.424(5) no . 1_655
F60 C3 3.451(5) no . 3_757
F60 C22 3.460(5) no . 1_655
F61 C23 3.511(9) no . 3_656
F61 C29 3.270(9) no . 3_656
F61 C37 3.370(7) no . 1_554
F61 C40 3.466(8) no . 3_656
F61 C50 3.343(10) no . 3_656
F61 C57 3.444(8) no . 1_554
F71 F11 3.202(7) no . 1_554
F71 C28 3.462(9) no . 1_554
F71 C36 3.376(9) no . 3_656
F72 C50 3.158(7) no . 3_656
F73 F5 3.435(4) no . 4_555
F73 F7 3.402(4) no . 4_555
F73 F10 3.556(4) no . 4_555
O63 C26 3.345(4) no . 1_655
C1 F60 3.424(5) no . 1_455
C3 F60 3.451(5) no . 3_757
C21 C25 3.392(5) no . 1_655
C21 C26 3.357(5) no . 1_655
C22 F60 3.460(5) no . 1_455
C23 F61 3.511(9) no . 3_656
C25 F4 3.250(4) no . 1_455
C25 C21 3.392(5) no . 1_455
C25 C47 3.544(5) no . 1_455
C25 C58 3.592(5) no . 1_455
C26 F4 3.499(4) no . 1_455
C26 O63 3.345(4) no . 1_455
C26 C21 3.357(5) no . 1_455
C28 F9 3.330(4) no . 4_455
C28 F71 3.462(9) no . 1_556
C29 F61 3.270(9) no . 3_656
C29 F53B 3.365(14) no . 3_656
C29 F72B 3.442(17) no . 3_656
C31 F14 3.388(5) no . 3_757
C33 F5 3.490(5) no . 4_455
C36 F71 3.376(9) no . 3_656
C36 F70B 3.071(9) no . 3_656
C37 F9 3.449(4) no . 4_455
C37 F61 3.370(7) no . 1_556
C37 F72B 3.032(10) no . 1_556
C39 F6 3.097(4) no . 2_646
C39 F14 3.477(5) no . 3_757
C39 F42 3.410(10) no . 3_756
C39 F71B 3.492(11) no . 3_756
C40 F61 3.466(8) no . 3_656
C41 F70B 3.214(11) no . 3_656
C44 F7 3.157(5) no . 4_455
C44 F42 3.507(11) no . 4_455
C44 F71B 3.293(8) no . 4_455
C47 C25 3.544(5) no . 1_655
C50 F61 3.343(10) no . 3_656
C50 F72 3.158(7) no . 3_656
C50 F53B 3.209(13) no . 3_656
C50 F61B 3.570(13) no . 3_656
C50 F72B 3.384(19) no . 3_656
C50 F42B 3.464(9) no . 3_756
C51 F6 3.314(4) no . 2_646
C51 F42 2.993(10) no . 3_756
C51 F61B 3.582(11) no . 3_656
C51 F72B 3.48(2) no . 3_656
C51 F42B 3.360(9) no . 3_756
C51 F71B 3.285(11) no . 3_756
C54 F7 3.488(6) no . 4_455
C54 F11 3.492(5) no . 4_454
C54 F71B 3.429(9) no . 4_455
C56 F7 3.446(5) no . 4_455
C57 F9 3.194(4) no . 4_455
C57 F61 3.444(8) no . 1_556
C57 F72B 3.139(14) no . 1_556
C58 C25 3.592(5) no . 1_655
F53B C29 3.365(14) no . 3_656
F53B C50 3.209(13) no . 3_656
F61B C50 3.570(13) no . 3_656
F61B C51 3.582(11) no . 3_656
F72B C29 3.442(17) no . 3_656
F72B C37 3.032(10) no . 1_554
F72B C50 3.384(19) no . 3_656
F72B C51 3.48(2) no . 3_656
F72B C57 3.139(14) no . 1_554
F42B C50 3.464(9) no . 3_756
F42B C51 3.360(9) no . 3_756
F70B C36 3.071(9) no . 3_656
F70B C41 3.214(11) no . 3_656
F71B C39 3.492(11) no . 3_756
F71B C44 3.293(8) no . 4_554
F71B C51 3.285(11) no . 3_756
F71B C54 3.429(9) no . 4_554
P1 H12 3.5678 no . 3_657
P1 H13 2.9102 no . .
P1 H29 2.8063 no . .
P1 H31 2.9017 no . .
P1 H40 2.7872 no . .
P2 H12 3.3076 no . 3_657
P2 H13 3.4852 no . 3_657
P2 H16 2.7973 no . .
P2 H33 2.9051 no . .
P2 H48 2.8451 no . .
P2 H56 2.8486 no . .
F5 H55 2.4204 no . .
F6 H44 3.3107 no . .
F6 H55 2.4623 no . .
F8 H16 2.8486 no . .
F8 H56 2.9947 no . .
F9 H47 3.4581 no . .
F10 H55 3.4336 no . .
F10 H59 2.8668 no . .
F11 H16 2.8525 no . .
F11 H28 2.9426 no . .
F11 H36 3.4438 no . 3_657
F11 H47 3.5790 no . .
F13 H55 3.2210 no . .
F14 H47 2.3872 no . .
F53 H48 2.9590 no . .
F53 H49 3.3769 no . .
F60 H1 2.5332 no . 3_657
F60 H36 3.5337 no . 3_657
F60 H47 3.5788 no . .
F61 H49 2.3537 no . .
F70 H29 3.0950 no . .
F70 H49 3.2613 no . .
F70 H50 2.7881 no . .
F71 H49 2.3723 no . .
F72 H25 3.0884 no . .
F72 H40 2.8292 no . .
F72 H41 2.7200 no . .
F73 H47 2.3910 no . .
O62 H16 3.2356 no . .
O62 H47 3.1842 no . .
O63 H47 3.1627 no . .
O64 H48 3.3954 no . .
O64 H55 3.1736 no . .
O65 H16 2.8339 no . .
O65 H55 3.1645 no . .
O66 H29 2.7817 no . .
O66 H49 3.1705 no . .
O67 H40 2.6678 no . .
O67 H48 3.1912 no . .
O67 H49 3.1634 no . .
O68 H12 2.8220 no . 3_657
O68 H16 2.7671 no . .
O68 H48 3.2299 no . .
O69 H12 3.5078 no . 3_657
O69 H29 2.6852 no . .
O69 H40 2.8561 no . .
C1 H26 3.2275 no . .
C1 H36 3.4689 no . .
C2 H44 3.2384 no . .
C2 H59 3.2404 no . .
C3 H1 2.6219 no . 3_657
C3 H13 3.0752 no . .
C3 H31 3.0766 no . .
C3 H36 3.0578 no . 3_657
C6 H1 3.5111 no . 3_657
C6 H12 3.2927 no . 3_657
C6 H13 2.6545 no . .
C6 H31 2.6947 no . .
C6 H36 3.4585 no . 3_657
C12 H13 3.2807 no . 3_657
C12 H41 3.2115 no . .
C13 H13 3.2470 no . 3_657
C13 H36 3.2251 no . .
C13 H40 3.2324 no . .
C15 H12 3.0044 no . 3_657
C15 H13 3.3337 no . 3_657
C15 H28 3.2309 no . .
C15 H37 3.2369 no . .
C15 H56 2.6134 no . .
C16 H12 3.0293 no . 3_657
C16 H33 3.2546 no . .
C16 H56 2.9216 no . .
C16 H57 3.2326 no . .
C17 H13 3.1709 no . 3_657
C17 H25 2.5905 no . .
C17 H33 3.3900 no . .
C17 H48 3.5677 no . .
C18 H1 3.2584 no . .
C18 H26 3.2396 no . .
C18 H41 3.3805 no . .
C19 H29 2.8886 no . .
C22 H25 3.2527 no . .
C22 H35 3.2468 no . .
C22 H36 3.1123 no . .
C23 H39 3.2484 no . .
C23 H40 3.4346 no . .
C23 H50 3.2334 no . .
C24 H12 3.2388 no . .
C24 H12 3.5337 no . 3_657
C24 H41 3.2286 no . .
C25 H35 3.2169 no . .
C26 H1 3.2235 no . .
C27 H13 2.9157 no . 3_657
C27 H25 3.4384 no . .
C27 H33 2.7682 no . .
C27 H48 3.0318 no . .
C28 H37 3.2301 no . .
C29 H31 3.2364 no . .
C29 H40 3.4533 no . .
C29 H51 3.2279 no . .
C30 H47 2.6318 no . .
C31 H29 3.2382 no . .
C31 H33 3.3567 no . 3_657
C31 H37 3.2031 no . 3_657
C31 H51 3.2246 no . .
C33 H13 3.3129 no . 3_657
C33 H16 3.2573 no . .
C33 H31 3.3805 no . 3_657
C33 H56 3.1973 no . .
C33 H57 3.2242 no . .
C35 H25 3.2132 no . .
C36 H13 3.2216 no . .
C36 H40 3.2350 no . .
C37 H28 3.2284 no . .
C38 H40 3.0110 no . .
C39 H37 3.1702 no . 3_657
C39 H50 3.2250 no . .
C40 H13 3.2294 no . .
C40 H36 3.2352 no . .
C41 H12 3.2146 no . .
C43 H55 2.6168 no . .
C44 H59 3.2140 no . .
C45 H55 2.6417 no . .
C46 H40 3.3858 no . .
C46 H49 2.6122 no . .
C48 H54 3.2341 no . .
C48 H56 3.2336 no . .
C49 H29 3.3447 no . .
C50 H39 3.2244 no . .
C51 H29 3.2268 no . .
C51 H31 3.2254 no . .
C52 H29 3.5151 no . .
C52 H49 2.6254 no . .
C54 H48 3.2358 no . .
C54 H56 3.2144 no . .
C56 H48 3.2347 no . .
C56 H54 3.2165 no . .
C57 H16 3.2356 no . .
C57 H33 3.2257 no . .
C58 H47 2.6278 no . .
C59 H44 3.2162 no . .
H1 H35 2.3060 no . .
H12 H13 2.3108 no . .
H12 H13 3.5019 no . 3_657
H12 H16 3.0683 no . 3_657
H12 H36 2.3040 no . .
H13 H13 3.4611 no . 3_657
H13 H33 3.2271 no . 3_657
H16 H28 2.3070 no . .
H16 H56 3.1230 no . .
H25 H26 2.2981 no . .
H25 F61B 2.8908 no . .
H26 H35 2.2976 no . .
H28 H57 2.3022 no . .
H29 H40 3.0521 no . .
H29 H50 2.3113 no . .
H29 F42B 3.1087 no . .
H31 H33 2.7348 no . 3_657
H31 H37 3.2129 no . 3_657
H31 H39 2.3107 no . .
H33 H37 2.3010 no . .
H33 H56 3.5331 no . .
H36 H41 2.2969 no . .
H37 H39 3.1613 no . 3_657
H37 H57 2.3119 no . .
H39 H51 2.2992 no . .
H40 H41 2.3120 no . .
H40 F53B 2.6130 no . .
H41 F53B 2.7103 no . .
H44 H54 2.2815 no . .
H44 H56 2.3188 no . .
H48 H59 2.3277 no . .
H48 F61B 2.8123 no . .
H49 F53B 3.2616 no . .
H49 F72B 2.4996 no . .
H49 F70B 2.5042 no . .
H49 F71B 3.4874 no . .
H50 H51 2.3063 no . .
H50 F42B 3.0332 no . .
H54 H59 2.3018 no . .
P1 H35 3.3723 no . 1_655
F4 H25 2.6967 no . 1_655
F4 H26 3.1770 no . 1_655
F4 H44 2.9953 no . 4_554
F4 H51 3.0501 no . 3_756
F4 H56 3.2660 no . 4_554
F5 H33 2.8923 no . 4_554
F5 H47 2.8471 no . 4_454
F6 H37 2.8303 no . 4_554
F6 H39 2.6325 no . 2_656
F6 H51 3.0252 no . 2_656
F7 H28 3.5070 no . 1_554
F7 H44 3.2557 no . 4_554
F7 H57 3.2290 no . 1_554
F8 H59 2.8248 no . 4_555
F9 H56 2.7928 no . 4_554
F9 H57 3.4491 no . 4_554
F10 H47 2.9374 no . 4_454
F10 H57 3.3337 no . 1_554
F11 H54 2.6346 no . 4_555
F11 H59 3.5938 no . 4_555
F13 H37 3.1826 no . 4_554
F13 H57 3.2127 no . 4_554
F13 H59 3.0551 no . 4_555
F14 H31 2.8205 no . 3_757
F14 H39 2.9922 no . 3_757
F14 H54 3.0825 no . 4_555
F42 H26 3.0540 no . 1_655
F42 H39 3.3659 no . 3_756
F42 H44 2.7372 no . 4_554
F42 H51 2.6430 no . 3_756
F42 H54 3.3267 no . 4_554
F53 H37 3.2398 no . 1_554
F53 H57 3.0760 no . 1_554
F60 H1 3.2926 no . 1_655
F60 H31 3.3165 no . 3_757
F61 H29 3.5634 no . 3_656
F61 H37 2.9919 no . 1_554
F61 H40 3.4408 no . 3_656
F61 H57 3.1472 no . 1_554
F70 H41 3.3322 no . 3_656
F71 H28 2.9553 no . 1_554
F71 H36 2.8401 no . 3_656
F71 H41 3.4661 no . 3_656
F71 H54 3.3399 no . 4_554
F72 H50 2.9189 no . 3_656
F73 H25 3.1879 no . 1_655
O63 H26 3.1222 no . 1_655
O66 H26 3.1068 no . 1_655
O66 H35 3.3303 no . 1_655
O69 H35 2.9920 no . 1_655
C3 H1 3.3516 no . 1_655
C6 H1 3.3367 no . 1_655
C21 H25 3.4469 no . 1_655
C21 H26 3.3869 no . 1_655
C23 H35 2.9916 no . 1_655
C25 H50 3.1645 no . 3_656
C25 H51 3.5217 no . 3_656
C26 H50 2.8973 no . 3_656
C26 H51 3.3275 no . 3_656
C29 H35 2.9754 no . 1_655
C30 H54 3.4404 no . 4_555
C33 H55 3.4537 no . 4_455
C36 H49 3.5746 no . 3_656
C37 H55 3.2796 no . 4_455
C38 H57 3.5749 no . 1_554
C41 H49 3.2189 no . 3_656
C43 H37 3.4746 no . 4_554
C43 H59 3.5226 no . 4_555
C44 H39 3.5778 no . 2_656
C45 H47 3.4364 no . 4_454
C46 H57 3.4729 no . 1_554
C49 H57 3.2166 no . 1_554
C50 H26 3.1832 no . 3_656
C51 H26 3.1883 no . 3_656
C54 H28 3.4183 no . 4_454
C54 H39 3.5290 no . 2_656
C57 H49 3.1708 no . 1_556
C58 H25 3.2392 no . 1_655
H1 F60 3.2926 no . 1_455
H1 C3 3.3516 no . 1_455
H1 C6 3.3367 no . 1_455
H1 H1 2.9727 no . 3_557
H25 F4 2.6967 no . 1_455
H25 F73 3.1879 no . 1_455
H25 C21 3.4469 no . 1_455
H25 C58 3.2392 no . 1_455
H25 H50 3.0863 no . 3_656
H25 H51 3.0216 no . 3_656
H26 F4 3.1770 no . 1_455
H26 F42 3.0540 no . 1_455
H26 O63 3.1222 no . 1_455
H26 O66 3.1068 no . 1_455
H26 C21 3.3869 no . 1_455
H26 C50 3.1832 no . 3_656
H26 C51 3.1883 no . 3_656
H26 H50 2.6221 no . 3_656
H26 H51 2.6388 no . 3_656
H26 F42B 2.8943 no . 1_455
H28 F7 3.5070 no . 1_556
H28 F71 2.9553 no . 1_556
H28 C54 3.4183 no . 4_555
H28 H54 2.9605 no . 4_555
H29 F61 3.5634 no . 3_656
H29 H35 3.0127 no . 1_655
H29 F53B 3.3326 no . 3_656
H31 F14 2.8205 no . 3_757
H31 F60 3.3165 no . 3_757
H33 F5 2.8923 no . 4_455
H33 H55 3.1900 no . 4_455
H35 P1 3.3723 no . 1_455
H35 O66 3.3303 no . 1_455
H35 O69 2.9920 no . 1_455
H35 C23 2.9916 no . 1_455
H35 C29 2.9754 no . 1_455
H35 H29 3.0127 no . 1_455
H36 F71 2.8401 no . 3_656
H36 F70B 2.5203 no . 3_656
H37 F6 2.8303 no . 4_455
H37 F13 3.1826 no . 4_455
H37 F53 3.2398 no . 1_556
H37 F61 2.9919 no . 1_556
H37 C43 3.4746 no . 4_455
H37 H55 2.8842 no . 4_455
H37 F72B 2.5920 no . 1_556
H39 F6 2.6325 no . 2_646
H39 F14 2.9922 no . 3_757
H39 F42 3.3659 no . 3_756
H39 C44 3.5778 no . 2_646
H39 C54 3.5290 no . 2_646
H39 H44 3.2377 no . 2_646
H39 H54 3.1520 no . 2_646
H39 H55 3.0685 no . 2_646
H39 F71B 3.3410 no . 3_756
H40 F61 3.4408 no . 3_656
H41 F70 3.3322 no . 3_656
H41 F71 3.4661 no . 3_656
H41 H49 3.0618 no . 3_656
H41 H50 3.4442 no . 3_656
H41 F70B 2.8036 no . 3_656
H44 F4 2.9953 no . 4_455
H44 F7 3.2557 no . 4_455
H44 F42 2.7372 no . 4_455
H44 H39 3.2377 no . 2_656
H44 H51 3.2217 no . 2_656
H44 F71B 2.6244 no . 4_455
H47 F5 2.8471 no . 4_555
H47 F10 2.9374 no . 4_555
H47 C45 3.4364 no . 4_555
H49 C36 3.5746 no . 3_656
H49 C41 3.2189 no . 3_656
H49 C57 3.1708 no . 1_554
H49 H41 3.0618 no . 3_656
H49 H57 2.7709 no . 1_554
H50 F72 2.9189 no . 3_656
H50 C25 3.1645 no . 3_656
H50 C26 2.8973 no . 3_656
H50 H25 3.0863 no . 3_656
H50 H26 2.6221 no . 3_656
H50 H41 3.4442 no . 3_656
H50 F53B 3.0749 no . 3_656
H50 F61B 3.4987 no . 3_656
H50 F42B 3.4678 no . 3_756
H51 F4 3.0501 no . 3_756
H51 F6 3.0252 no . 2_646
H51 F42 2.6430 no . 3_756
H51 C25 3.5217 no . 3_656
H51 C26 3.3275 no . 3_656
H51 H25 3.0216 no . 3_656
H51 H26 2.6388 no . 3_656
H51 H44 3.2217 no . 2_646
H51 F61B 3.4918 no . 3_656
H51 F42B 3.3154 no . 3_756
H51 F71B 2.9897 no . 3_756
H54 F11 2.6346 no . 4_454
H54 F14 3.0825 no . 4_454
H54 F42 3.3267 no . 4_455
H54 F71 3.3399 no . 4_455
H54 C30 3.4404 no . 4_454
H54 H28 2.9605 no . 4_454
H54 H39 3.1520 no . 2_656
H54 F71B 2.8934 no . 4_455
H55 C33 3.4537 no . 4_554
H55 C37 3.2796 no . 4_554
H55 H33 3.1900 no . 4_554
H55 H37 2.8842 no . 4_554
H55 H39 3.0685 no . 2_656
H56 F4 3.2660 no . 4_455
H56 F9 2.7928 no . 4_455
H57 F7 3.2290 no . 1_556
H57 F9 3.4491 no . 4_455
H57 F10 3.3337 no . 1_556
H57 F13 3.2127 no . 4_455
H57 F53 3.0760 no . 1_556
H57 F61 3.1472 no . 1_556
H57 C38 3.5749 no . 1_556
H57 C46 3.4729 no . 1_556
H57 C49 3.2166 no . 1_556
H57 H49 2.7709 no . 1_556
H57 F72B 2.8118 no . 1_556
H59 F8 2.8248 no . 4_454
H59 F11 3.5938 no . 4_454
H59 F13 3.0551 no . 4_454
H59 C43 3.5226 no . 4_454
F53B H29 3.3326 no . 3_656
F53B H50 3.0749 no . 3_656
F61B H50 3.4987 no . 3_656
F61B H51 3.4918 no . 3_656
F72B H37 2.5920 no . 1_554
F72B H57 2.8118 no . 1_554
F42B H26 2.8943 no . 1_655
F42B H50 3.4678 no . 3_756
F42B H51 3.3154 no . 3_756
F70B H36 2.5203 no . 3_656
F70B H41 2.8036 no . 3_656
F71B H39 3.3410 no . 3_756
F71B H44 2.6244 no . 4_554
F71B H51 2.9897 no . 3_756
F71B H54 2.8934 no . 4_554

#==============================================================================

#==============================================================================
# Additional structures and associated data_? identifiers
# should be added at this point if there is more than one 
# structure analysis in the CIF.

#==============================================================================
#     End of CIF
#==============================================================================
_exptl_crystal_recrystallization_method 
'Re-crystallisation from solvent: methanol'
_exptl_crystal_preparation       Luminescent
