# Electronic Supplementary Material (ESI) for CrystEngComm.
# This journal is © The Royal Society of Chemistry 2021

####################################################################### 
# 
# 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_1
_database_code_depnum_ccdc_archive 'CCDC 2115295'
loop_
_audit_author_name
_audit_author_address
'Zhi-Hui Zhang'
;Changzhou University
China
;
_audit_update_record             
;
2021-10-12 deposited with the CCDC.	2021-11-29 downloaded from the CCDC.
;
# start Validation Reply Form
_vrf_PLAT417_1                   
;
PROBLEM: Short Inter D-H..H-D       H12A     ..H13E     .       1.77 Ang.
RESPONSE: The solvent O atoms are somewhat disorder. 
;
_vrf_PLAT260_1                   
;
PROBLEM: Large Average Ueq of Residue Including       O13      0.384 Check
RESPONSE: The solvent O atoms are somewhat disorder. 
;
# Added during the CSD deposition process: Tuesday 12 October 2021 04:46 PM
# end Validation Reply Form


_audit_creation_method           SHELXL-2014/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C17 H23 Eu N3 O11'
_chemical_formula_weight         597.34

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Eu Eu -0.1578 3.6682 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_H-M_alt        'C 2/c'
_space_group_name_Hall           '-C 2yc'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;

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

_cell_length_a                   25.0401(8)
_cell_length_b                   13.9581(4)
_cell_length_c                   14.3689(4)
_cell_angle_alpha                90
_cell_angle_beta                 102.2190(10)
_cell_angle_gamma                90
_cell_volume                     4908.3(3)
_cell_formula_units_Z            8
_cell_measurement_temperature    110(2)
_cell_measurement_reflns_used    22804
_cell_measurement_theta_min      2.331
_cell_measurement_theta_max      27.137

_exptl_crystal_description       block
_exptl_crystal_colour            colorless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.617
_exptl_crystal_F_000             2376
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.220
_exptl_crystal_size_mid          0.200
_exptl_crystal_size_min          0.180
_exptl_absorpt_coefficient_mu    2.612
_shelx_estimated_absorpt_T_min   0.597
_shelx_estimated_absorpt_T_max   0.651
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.597
_exptl_absorpt_correction_T_max  0.654
_exptl_absorpt_process_details   SADABS
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      110(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   'sealed tube'
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            22804
_diffrn_reflns_av_unetI/netI     0.0539
_diffrn_reflns_av_R_equivalents  0.0562
_diffrn_reflns_limit_h_min       -32
_diffrn_reflns_limit_h_max       31
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_theta_min         2.331
_diffrn_reflns_theta_max         27.137
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measured_fraction_theta_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.996
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.996
_diffrn_reflns_point_group_measured_fraction_full 0.999
_reflns_number_total             5422
_reflns_number_gt                4301
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

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

_computing_data_collection       'Bruker SMART'
_computing_cell_refinement       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-2014/6 (Sheldrick, 2014)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0235P)²+119.8487P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   mixed
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         5422
_refine_ls_number_parameters     293
_refine_ls_number_restraints     42
_refine_ls_R_factor_all          0.0678
_refine_ls_R_factor_gt           0.0497
_refine_ls_wR_factor_ref         0.1182
_refine_ls_wR_factor_gt          0.1093
_refine_ls_goodness_of_fit_ref   1.078
_refine_ls_restrained_S_all      1.091
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Eu1 Eu 0.32608(2) 0.69565(2) 0.04241(2) 0.01548(10) Uani 1 1 d . . . . .
N1 N 0.4301(2) 0.7442(5) -0.0080(5) 0.0379(17) Uani 1 1 d . . . . .
N2 N 0.3595(5) 0.3987(8) 0.1750(8) 0.085(3) Uani 1 1 d . U . . .
N3 N 0.4063(9) 0.6467(12) 0.3465(8) 0.164(9) Uani 1 1 d . . . . .
O1 O 0.31429(18) 0.7851(3) -0.1000(3) 0.0214(10) Uani 1 1 d . . . . .
O2 O 0.23400(18) 0.8633(4) -0.1349(4) 0.0267(11) Uani 1 1 d . . . . .
O5 O 0.27496(18) 1.1673(3) -0.4368(3) 0.0210(10) Uani 1 1 d . . . . .
O6 O 0.20586(18) 1.0755(3) -0.4217(3) 0.0233(10) Uani 1 1 d . . . . .
O7 O 0.4096(2) 0.7992(4) 0.0443(4) 0.0377(13) Uani 1 1 d . . . . .
O8 O 0.4082(2) 0.6623(4) -0.0253(5) 0.0456(16) Uani 1 1 d . . . . .
O9 O 0.4691(3) 0.7691(5) -0.0426(6) 0.062(2) Uani 1 1 d . . . . .
O10 O 0.3647(2) 0.5440(4) 0.1086(4) 0.0369(13) Uani 1 1 d . . . . .
O11 O 0.3722(2) 0.7271(4) 0.2038(3) 0.0354(13) Uani 1 1 d . . . . .
C1 C 0.2828(3) 0.8482(5) -0.1428(5) 0.0206(14) Uani 1 1 d . . . . .
C2 C 0.2713(2) 0.9746(5) -0.2704(5) 0.0194(13) Uani 1 1 d . . . . .
H2 H 0.2330 0.9733 -0.2738 0.023 Uiso 1 1 calc R U . . .
C3 C 0.2929(3) 1.0372(5) -0.3281(5) 0.0193(13) Uani 1 1 d . . . . .
C4 C 0.3491(3) 1.0408(5) -0.3204(5) 0.0207(14) Uani 1 1 d . . . . .
H4 H 0.3641 1.0856 -0.3575 0.025 Uiso 1 1 calc R U . . .
C5 C 0.3838(3) 0.9796(5) -0.2589(5) 0.0191(13) Uani 1 1 d . . . . .
C6 C 0.3611(3) 0.9160(5) -0.2032(5) 0.0195(13) Uani 1 1 d . . . . .
H6 H 0.3841 0.8732 -0.1615 0.023 Uiso 1 1 calc R U . . .
C7 C 0.3050(3) 0.9147(5) -0.2083(5) 0.0191(13) Uani 1 1 d . . . . .
C8 C 0.2556(3) 1.0968(5) -0.3993(5) 0.0189(13) Uani 1 1 d . . . . .
C9 C 0.4440(3) 0.9814(5) -0.2538(5) 0.0202(14) Uani 1 1 d . . . . .
C10 C 0.4719(3) 1.0667(5) -0.2535(5) 0.0195(13) Uani 1 1 d . . . . .
H10 H 0.4526 1.1257 -0.2580 0.023 Uiso 1 1 calc R U . . .
C11 C 0.4719(2) 0.8948(5) -0.2515(5) 0.0196(13) Uani 1 1 d . . . . .
H11 H 0.4528 0.8359 -0.2520 0.024 Uiso 1 1 calc R U . . .
C12 C 0.3375(5) 0.4745(8) 0.1238(8) 0.059(3) Uani 1 1 d . U . . .
H12 H 0.2993 0.4746 0.0980 0.070 Uiso 1 1 calc R U . . .
C13 C 0.3236(6) 0.3154(9) 0.1837(11) 0.094(4) Uani 1 1 d . U . . .
H13A H 0.3377 0.2581 0.1577 0.141 Uiso 1 1 calc R U . . .
H13B H 0.2864 0.3286 0.1481 0.141 Uiso 1 1 calc R U . . .
H13C H 0.3231 0.3049 0.2510 0.141 Uiso 1 1 calc R U . . .
C14 C 0.4162(8) 0.3926(14) 0.2153(14) 0.142(7) Uani 1 1 d . U . . .
H14A H 0.4347 0.3592 0.1710 0.214 Uiso 1 1 calc R U . . .
H14B H 0.4217 0.3571 0.2754 0.214 Uiso 1 1 calc R U . . .
H14C H 0.4314 0.4572 0.2273 0.214 Uiso 1 1 calc R U . . .
C15 C 0.3641(5) 0.6974(10) 0.2796(9) 0.076(3) Uani 1 1 d . U . . .
H15 H 0.3295 0.7077 0.2951 0.092 Uiso 1 1 calc R U . . .
C16 C 0.3926(11) 0.611(2) 0.4287(19) 0.218(12) Uani 1 1 d . U . . .
H16A H 0.4214 0.6267 0.4840 0.327 Uiso 1 1 calc R U . . .
H16B H 0.3889 0.5408 0.4235 0.327 Uiso 1 1 calc R U . . .
H16C H 0.3580 0.6387 0.4364 0.327 Uiso 1 1 calc R U . . .
C17 C 0.4646(10) 0.6535(19) 0.3303(18) 0.187(10) Uani 1 1 d . U . . .
H17A H 0.4639 0.6481 0.2621 0.281 Uiso 1 1 calc R U . . .
H17B H 0.4867 0.6015 0.3646 0.281 Uiso 1 1 calc R U . . .
H17C H 0.4805 0.7153 0.3539 0.281 Uiso 1 1 calc R U . . .
O12 O 0.4231(10) 0.0604(13) 0.9939(8) 0.258(13) Uani 1 1 d . . . . .
H12A H 0.4243 0.0144 1.0297 0.388 Uiso 1 1 d R U . . .
H12B H 0.4418 0.0621 0.9534 0.388 Uiso 1 1 d R U . . .
O13 O 0.3432(16) 0.1171(17) 0.9719(12) 0.39(2) Uani 1 1 d . . . . .
H13D H 0.3123 0.1043 0.9425 0.578 Uiso 1 1 d R U . . .
H13E H 0.3696 0.0844 0.9664 0.578 Uiso 1 1 d R U . . .


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

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Eu1 O5 2.355(4) 6_576 ?
Eu1 O2 2.357(4) 7_565 ?
Eu1 O1 2.362(4) . ?
Eu1 O11 2.402(5) . ?
Eu1 O6 2.423(5) 4_544 ?
Eu1 O10 2.435(5) . ?
Eu1 O8 2.496(5) . ?
Eu1 O7 2.537(5) . ?
Eu1 O5 2.690(5) 4_544 ?
Eu1 C8 2.922(6) 4_544 ?
Eu1 Eu1 4.0421(6) 7_565 ?
N1 O9 1.235(8) . ?
N1 O7 1.259(9) . ?
N1 O8 1.269(9) . ?
N2 C12 1.338(14) . ?
N2 C14 1.418(19) . ?
N2 C13 1.491(16) . ?
N3 C16 1.39(3) . ?
N3 C15 1.45(2) . ?
N3 C17 1.53(3) . ?
O1 C1 1.253(8) . ?
O2 C1 1.269(8) . ?
O2 Eu1 2.357(4) 7_565 ?
O5 C8 1.267(8) . ?
O5 Eu1 2.355(4) 6_575 ?
O5 Eu1 2.690(5) 4_554 ?
O6 C8 1.255(8) . ?
O6 Eu1 2.423(5) 4_554 ?
O10 C12 1.232(12) . ?
O11 C15 1.220(13) . ?
C1 C7 1.509(9) . ?
C2 C7 1.373(9) . ?
C2 C3 1.389(9) . ?
C2 H2 0.9500 . ?
C3 C4 1.390(9) . ?
C3 C8 1.485(9) . ?
C4 C5 1.393(9) . ?
C4 H4 0.9500 . ?
C5 C6 1.394(9) . ?
C5 C9 1.494(8) . ?
C6 C7 1.392(9) . ?
C6 H6 0.9500 . ?
C8 Eu1 2.922(6) 4_554 ?
C9 C10 1.380(9) . ?
C9 C11 1.394(9) . ?
C10 C10 1.390(12) 2_654 ?
C10 H10 0.9500 . ?
C11 C11 1.399(12) 2_654 ?
C11 H11 0.9500 . ?
C12 H12 0.9500 . ?
C13 H13A 0.9800 . ?
C13 H13B 0.9800 . ?
C13 H13C 0.9800 . ?
C14 H14A 0.9800 . ?
C14 H14B 0.9800 . ?
C14 H14C 0.9800 . ?
C15 H15 0.9500 . ?
C16 H16A 0.9800 . ?
C16 H16B 0.9800 . ?
C16 H16C 0.9800 . ?
C17 H17A 0.9800 . ?
C17 H17B 0.9800 . ?
C17 H17C 0.9800 . ?
O12 H12A 0.8201 . ?
O12 H12B 0.8198 . ?
O12 H13E 1.3566 . ?
O13 H13D 0.8196 . ?
O13 H13E 0.8199 . ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
O5 Eu1 O2 77.48(16) 6_576 7_565 ?
O5 Eu1 O1 73.07(16) 6_576 . ?
O2 Eu1 O1 134.08(16) 7_565 . ?
O5 Eu1 O11 83.82(18) 6_576 . ?
O2 Eu1 O11 75.68(17) 7_565 . ?
O1 Eu1 O11 133.35(17) . . ?
O5 Eu1 O6 123.14(15) 6_576 4_544 ?
O2 Eu1 O6 90.51(17) 7_565 4_544 ?
O1 Eu1 O6 77.52(16) . 4_544 ?
O11 Eu1 O6 146.69(18) . 4_544 ?
O5 Eu1 O10 146.94(17) 6_576 . ?
O2 Eu1 O10 74.02(18) 7_565 . ?
O1 Eu1 O10 139.84(17) . . ?
O11 Eu1 O10 73.3(2) . . ?
O6 Eu1 O10 73.84(18) 4_544 . ?
O5 Eu1 O8 135.63(17) 6_576 . ?
O2 Eu1 O8 146.23(18) 7_565 . ?
O1 Eu1 O8 73.92(18) . . ?
O11 Eu1 O8 98.2(2) . . ?
O6 Eu1 O8 76.49(19) 4_544 . ?
O10 Eu1 O8 72.45(19) . . ?
O5 Eu1 O7 90.26(18) 6_576 . ?
O2 Eu1 O7 144.66(17) 7_565 . ?
O1 Eu1 O7 70.11(17) . . ?
O11 Eu1 O7 70.07(17) . . ?
O6 Eu1 O7 123.25(17) 4_544 . ?
O10 Eu1 O7 103.5(2) . . ?
O8 Eu1 O7 50.65(19) . . ?
O5 Eu1 O5 73.69(16) 6_576 4_544 ?
O2 Eu1 O5 68.30(15) 7_565 4_544 ?
O1 Eu1 O5 70.05(15) . 4_544 ?
O11 Eu1 O5 140.69(16) . 4_544 ?
O6 Eu1 O5 50.66(14) 4_544 4_544 ?
O10 Eu1 O5 109.94(17) . 4_544 ?
O8 Eu1 O5 120.44(19) . 4_544 ?
O7 Eu1 O5 139.86(16) . 4_544 ?
O5 Eu1 C8 98.87(17) 6_576 4_544 ?
O2 Eu1 C8 78.27(17) 7_565 4_544 ?
O1 Eu1 C8 72.50(17) . 4_544 ?
O11 Eu1 C8 152.55(17) . 4_544 ?
O6 Eu1 C8 25.00(16) 4_544 4_544 ?
O10 Eu1 C8 91.46(19) . 4_544 ?
O8 Eu1 C8 98.6(2) . 4_544 ?
O7 Eu1 C8 136.83(17) . 4_544 ?
O5 Eu1 C8 25.67(16) 4_544 4_544 ?
O5 Eu1 Eu1 39.69(11) 6_576 7_565 ?
O2 Eu1 Eu1 68.14(11) 7_565 7_565 ?
O1 Eu1 Eu1 66.63(11) . 7_565 ?
O11 Eu1 Eu1 116.88(14) . 7_565 ?
O6 Eu1 Eu1 84.07(10) 4_544 7_565 ?
O10 Eu1 Eu1 135.66(14) . 7_565 ?
O8 Eu1 Eu1 138.90(16) . 7_565 ?
O7 Eu1 Eu1 120.75(14) . 7_565 ?
O5 Eu1 Eu1 34.00(9) 4_544 7_565 ?
C8 Eu1 Eu1 59.34(13) 4_544 7_565 ?
O9 N1 O7 121.7(8) . . ?
O9 N1 O8 121.4(8) . . ?
O7 N1 O8 116.8(6) . . ?
C12 N2 C14 122.2(13) . . ?
C12 N2 C13 118.5(12) . . ?
C14 N2 C13 119.2(13) . . ?
C16 N3 C15 118(2) . . ?
C16 N3 C17 124(2) . . ?
C15 N3 C17 116.9(14) . . ?
C1 O1 Eu1 138.4(4) . . ?
C1 O2 Eu1 137.2(4) . 7_565 ?
C8 O5 Eu1 162.1(4) . 6_575 ?
C8 O5 Eu1 87.5(4) . 4_554 ?
Eu1 O5 Eu1 106.32(16) 6_575 4_554 ?
C8 O6 Eu1 100.4(4) . 4_554 ?
N1 O7 Eu1 94.9(4) . . ?
N1 O8 Eu1 96.6(4) . . ?
C12 O10 Eu1 124.4(6) . . ?
C15 O11 Eu1 131.5(7) . . ?
O1 C1 O2 126.2(6) . . ?
O1 C1 C7 117.6(6) . . ?
O2 C1 C7 116.2(6) . . ?
C7 C2 C3 120.6(6) . . ?
C7 C2 H2 119.7 . . ?
C3 C2 H2 119.7 . . ?
C2 C3 C4 119.3(6) . . ?
C2 C3 C8 119.8(6) . . ?
C4 C3 C8 120.8(6) . . ?
C3 C4 C5 120.9(6) . . ?
C3 C4 H4 119.6 . . ?
C5 C4 H4 119.6 . . ?
C4 C5 C6 118.7(6) . . ?
C4 C5 C9 120.5(6) . . ?
C6 C5 C9 120.8(6) . . ?
C7 C6 C5 120.5(6) . . ?
C7 C6 H6 119.8 . . ?
C5 C6 H6 119.8 . . ?
C2 C7 C6 120.0(6) . . ?
C2 C7 C1 121.6(6) . . ?
C6 C7 C1 118.4(6) . . ?
O6 C8 O5 121.5(6) . . ?
O6 C8 C3 119.3(6) . . ?
O5 C8 C3 119.3(6) . . ?
O6 C8 Eu1 54.7(3) . 4_554 ?
O5 C8 Eu1 66.9(3) . 4_554 ?
C3 C8 Eu1 173.5(5) . 4_554 ?
C10 C9 C11 119.8(6) . . ?
C10 C9 C5 121.4(6) . . ?
C11 C9 C5 118.8(6) . . ?
C9 C10 C10 120.3(4) . 2_654 ?
C9 C10 H10 119.8 . . ?
C10 C10 H10 119.8 2_654 . ?
C9 C11 C11 119.8(4) . 2_654 ?
C9 C11 H11 120.1 . . ?
C11 C11 H11 120.1 2_654 . ?
O10 C12 N2 122.7(11) . . ?
O10 C12 H12 118.6 . . ?
N2 C12 H12 118.6 . . ?
N2 C13 H13A 109.5 . . ?
N2 C13 H13B 109.5 . . ?
H13A C13 H13B 109.5 . . ?
N2 C13 H13C 109.5 . . ?
H13A C13 H13C 109.5 . . ?
H13B C13 H13C 109.5 . . ?
N2 C14 H14A 109.5 . . ?
N2 C14 H14B 109.5 . . ?
H14A C14 H14B 109.5 . . ?
N2 C14 H14C 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
O11 C15 N3 121.4(13) . . ?
O11 C15 H15 119.3 . . ?
N3 C15 H15 119.3 . . ?
N3 C16 H16A 109.5 . . ?
N3 C16 H16B 109.5 . . ?
H16A C16 H16B 109.5 . . ?
N3 C16 H16C 109.5 . . ?
H16A C16 H16C 109.5 . . ?
H16B C16 H16C 109.5 . . ?
N3 C17 H17A 109.5 . . ?
N3 C17 H17B 109.5 . . ?
H17A C17 H17B 109.5 . . ?
N3 C17 H17C 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
H12A O12 H12B 121.3 . . ?
H12A O12 H13E 106.1 . . ?
H12B O12 H13E 117.6 . . ?
H13D O13 H13E 121.4 . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
O9 N1 O7 Eu1 168.5(7) . . . . ?
O8 N1 O7 Eu1 -10.0(7) . . . . ?
O9 N1 O8 Eu1 -168.3(7) . . . . ?
O7 N1 O8 Eu1 10.2(7) . . . . ?
Eu1 O1 C1 O2 -25.4(12) . . . . ?
Eu1 O1 C1 C7 153.0(5) . . . . ?
Eu1 O2 C1 O1 4.8(12) 7_565 . . . ?
Eu1 O2 C1 C7 -173.6(5) 7_565 . . . ?
C7 C2 C3 C4 -2.1(10) . . . . ?
C7 C2 C3 C8 175.9(6) . . . . ?
C2 C3 C4 C5 3.0(10) . . . . ?
C8 C3 C4 C5 -175.0(6) . . . . ?
C3 C4 C5 C6 -1.6(10) . . . . ?
C3 C4 C5 C9 177.6(6) . . . . ?
C4 C5 C6 C7 -0.8(10) . . . . ?
C9 C5 C6 C7 -180.0(6) . . . . ?
C3 C2 C7 C6 -0.3(10) . . . . ?
C3 C2 C7 C1 178.1(6) . . . . ?
C5 C6 C7 C2 1.7(10) . . . . ?
C5 C6 C7 C1 -176.8(6) . . . . ?
O1 C1 C7 C2 168.5(6) . . . . ?
O2 C1 C7 C2 -12.9(10) . . . . ?
O1 C1 C7 C6 -13.0(10) . . . . ?
O2 C1 C7 C6 165.6(6) . . . . ?
Eu1 O6 C8 O5 1.9(7) 4_554 . . . ?
Eu1 O6 C8 C3 -177.3(5) 4_554 . . . ?
Eu1 O5 C8 O6 139.6(11) 6_575 . . . ?
Eu1 O5 C8 O6 -1.7(6) 4_554 . . . ?
Eu1 O5 C8 C3 -41.2(17) 6_575 . . . ?
Eu1 O5 C8 C3 177.5(5) 4_554 . . . ?
Eu1 O5 C8 Eu1 141.2(14) 6_575 . . 4_554 ?
C2 C3 C8 O6 -15.8(10) . . . . ?
C4 C3 C8 O6 162.1(6) . . . . ?
C2 C3 C8 O5 165.0(6) . . . . ?
C4 C3 C8 O5 -17.1(10) . . . . ?
C4 C5 C9 C10 42.4(10) . . . . ?
C6 C5 C9 C10 -138.4(7) . . . . ?
C4 C5 C9 C11 -136.2(7) . . . . ?
C6 C5 C9 C11 43.0(9) . . . . ?
C11 C9 C10 C10 -2.9(12) . . . 2_654 ?
C5 C9 C10 C10 178.5(8) . . . 2_654 ?
C10 C9 C11 C11 0.2(12) . . . 2_654 ?
C5 C9 C11 C11 178.9(8) . . . 2_654 ?
Eu1 O10 C12 N2 -168.0(8) . . . . ?
C14 N2 C12 O10 0(2) . . . . ?
C13 N2 C12 O10 -175.9(10) . . . . ?
Eu1 O11 C15 N3 121.9(11) . . . . ?
C16 N3 C15 O11 -176.3(17) . . . . ?
C17 N3 C15 O11 15(2) . . . . ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
C13 H13C O1 0.98 2.53 3.463(14) 158.4 6_566
C13 H13C O1 0.98 2.53 3.463(14) 158.4 6_566
C13 H13C O1 0.98 2.53 3.463(14) 158.4 6_566
C13 H13C O1 0.98 2.53 3.463(14) 158.4 6_566
O13 H13E O12 0.82 1.36 2.11(3) 151.1 .

_refine_diff_density_max         2.077
_refine_diff_density_min         -1.139
_refine_diff_density_rms         0.187

_shelxl_version_number           2014/6



