#------------------------------------------------------------------------------
#$Date: 2021-07-21 02:59:39 +0300 (Wed, 21 Jul 2021) $
#$Revision: 267653 $
#$URL: file:///home/coder/svn-repositories/cod/cif/8/00/05/8000514.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_8000514
loop_
_publ_author_name
'Okayasu, Yoshinori'
'Yuasa, Junpei'
_publ_section_title
;
 Structure Determination of Europium Complexes in Solution Using
 Crystal-Field Splitting of the Narrow f-f Emission Lines.
;
_journal_name_full               'The journal of physical chemistry letters'
_journal_page_first              6867
_journal_page_last               6874
_journal_paper_doi               10.1021/acs.jpclett.1c01885
_journal_year                    2021
_chemical_absolute_configuration ad
_chemical_formula_sum            'C56 H43 Eu F9 N3 O8'
_chemical_formula_weight         1208.89
_space_group_crystal_system      monoclinic
_space_group_IT_number           4
_space_group_name_Hall           'P 2yb'
_space_group_name_H-M_alt        'P 1 21 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2016/6
_cell_angle_alpha                90
_cell_angle_beta                 90.7030(10)
_cell_angle_gamma                90
_cell_formula_units_Z            6
_cell_length_a                   13.0611(10)
_cell_length_b                   38.480(3)
_cell_length_c                   16.0189(13)
_cell_measurement_reflns_used    38185
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      25.03
_cell_measurement_theta_min      1.38
_cell_volume                     8050.4(11)
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0236
_diffrn_reflns_av_unetI/netI     0.0676
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 1.000
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       45
_diffrn_reflns_limit_k_min       -45
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            38185
_diffrn_reflns_point_group_measured_fraction_full 0.935
_diffrn_reflns_point_group_measured_fraction_max 0.935
_diffrn_reflns_theta_full        25.027
_diffrn_reflns_theta_max         25.027
_diffrn_reflns_theta_min         1.377
_exptl_absorpt_coefficient_mu    1.256
_exptl_crystal_colour            Colorless
_exptl_crystal_density_diffrn    1.496
_exptl_crystal_description       Plate
_exptl_crystal_F_000             3648
_exptl_crystal_size_max          0.15
_exptl_crystal_size_mid          0.12
_exptl_crystal_size_min          0.11
_exptl_transmission_factor_max   0.745600
_exptl_transmission_factor_min   0.662000
_refine_diff_density_max         1.193
_refine_diff_density_min         -0.535
_refine_diff_density_rms         0.069
_refine_ls_abs_structure_details
;
 Flack x determined using 9695 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack   -0.012(4)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.063
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     2069
_refine_ls_number_reflns         26623
_refine_ls_number_restraints     101
_refine_ls_restrained_S_all      1.085
_refine_ls_R_factor_all          0.0435
_refine_ls_R_factor_gt           0.0373
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     'w=1/[σ²(Fo²)] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0710
_refine_ls_wR_factor_ref         0.0730
_reflns_Friedel_coverage         0.841
_reflns_Friedel_fraction_full    0.869
_reflns_Friedel_fraction_max     0.869
_reflns_number_gt                24031
_reflns_number_total             26623
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            jz1c01885_si_008.cif
_cod_data_source_block           PhEuMe_0m_a
_cod_original_cell_volume        8050.3(11)
_cod_original_sg_symbol_H-M      'P 21'
_cod_database_code               8000514
_shelx_shelxl_version_number     2016/6
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z'
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
C18 C -0.0916(4) 0.68474(12) 0.6133(4) 0.048(2) Uani 1 1 d DG . . . .
C19 C -0.1956(4) 0.67793(11) 0.6202(5) 0.077(4) Uani 1 1 d DG . . . .
H19 H -0.218541 0.655131 0.624768 0.093 Uiso 1 1 calc R U . . .
C23 C -0.2655(3) 0.70518(16) 0.6202(6) 0.110(5) Uani 1 1 d G . . . .
H23 H -0.335108 0.700623 0.624828 0.132 Uiso 1 1 calc R U . . .
C21 C -0.2313(5) 0.73926(14) 0.6134(6) 0.083(4) Uani 1 1 d G . . . .
H21 H -0.277985 0.757492 0.613394 0.100 Uiso 1 1 calc R U . . .
C22 C -0.1272(5) 0.74607(11) 0.6065(5) 0.079(3) Uani 1 1 d G . . . .
H22 H -0.104294 0.768870 0.601900 0.095 Uiso 1 1 calc R U . . .
C20 C -0.0574(4) 0.71882(15) 0.6064(4) 0.063(3) Uani 1 1 d DG . . . .
H20 H 0.012275 0.723379 0.601839 0.076 Uiso 1 1 calc R U . . .
F22 F 0.6187(8) 0.3104(3) 1.1264(7) 0.0840(16) Uani 0.588(5) 1 d D U P A 1
F23 F 0.7424(8) 0.3469(3) 1.1565(7) 0.0840(16) Uani 0.588(5) 1 d D U P A 1
F24 F 0.7659(8) 0.2907(3) 1.1417(7) 0.0840(16) Uani 0.588(5) 1 d D U P A 1
F10 F 0.7769(9) 0.4718(3) 0.1863(8) 0.1016(18) Uani 0.588(5) 1 d D U P A 1
F11 F 0.6735(9) 0.4532(4) 0.0869(7) 0.1016(18) Uani 0.588(5) 1 d D U P A 1
F12 F 0.7638(9) 0.4274(3) 0.1818(8) 0.1016(18) Uani 0.588(5) 1 d D U P A 1
F25 F 0.6687(8) 0.1619(3) 0.7171(7) 0.0767(14) Uani 0.588(5) 1 d D U P A 1
F26 F 0.7242(8) 0.1699(2) 0.5953(7) 0.0767(14) Uani 0.588(5) 1 d D U P A 1
F27 F 0.5728(7) 0.1874(2) 0.6335(7) 0.0767(14) Uani 0.588(5) 1 d D U P A 1
F23A F 0.7900(11) 0.3335(4) 1.1609(10) 0.0840(16) Uani 0.412(5) 1 d D . P A 2
F24A F 0.7145(12) 0.2874(4) 1.1381(10) 0.0840(16) Uani 0.412(5) 1 d D . P A 2
F22A F 0.6238(11) 0.3313(4) 1.1235(10) 0.0840(16) Uani 0.412(5) 1 d D . P A 2
F11A F 0.6582(13) 0.4776(5) 0.0976(11) 0.1016(18) Uani 0.412(5) 1 d D . P A 2
F12A F 0.7012(13) 0.4301(4) 0.1135(12) 0.1016(18) Uani 0.412(5) 1 d D . P A 2
F10A F 0.7327(14) 0.4917(4) 0.1708(12) 0.1016(18) Uani 0.412(5) 1 d D . P A 2
F25A F 0.7223(11) 0.1613(4) 0.7070(10) 0.0767(14) Uani 0.412(5) 1 d D . P A 2
F26A F 0.6679(12) 0.1784(4) 0.5800(9) 0.0767(14) Uani 0.412(5) 1 d D . P A 2
F27A F 0.5751(10) 0.1808(4) 0.6875(10) 0.0767(14) Uani 0.412(5) 1 d D . P A 2
Eu1 Eu -0.02667(2) 0.61364(2) 0.82339(2) 0.02921(9) Uani 1 1 d . . . . .
Eu2 Eu 0.56129(2) 0.46263(2) 0.43851(2) 0.02558(9) Uani 1 1 d . . . . .
Eu3 Eu 0.69514(3) 0.28235(2) 0.82956(2) 0.02868(9) Uani 1 1 d . . . . .
F1 F -0.1708(4) 0.67577(15) 1.0658(4) 0.0770(17) Uani 1 1 d . . . . .
F2 F -0.0761(4) 0.65787(15) 1.1661(3) 0.0706(16) Uani 1 1 d . . . . .
F3 F -0.1876(4) 0.62467(14) 1.1110(4) 0.0751(18) Uani 1 1 d . . . . .
F4 F 0.2537(4) 0.52224(13) 0.7472(5) 0.084(2) Uani 1 1 d . . . . .
F5 F 0.2658(5) 0.54255(14) 0.6233(5) 0.089(2) Uani 1 1 d . . . . .
F6 F 0.1257(4) 0.51999(12) 0.6634(4) 0.0659(15) Uani 1 1 d . . . . .
F7 F -0.4115(4) 0.6225(2) 0.7456(5) 0.121(3) Uani 1 1 d . . . . .
F8 F -0.4447(4) 0.65008(17) 0.8568(6) 0.124(3) Uani 1 1 d . . . . .
F9 F -0.3892(5) 0.59834(19) 0.8595(6) 0.115(3) Uani 1 1 d . . . . .
F13 F 0.1790(5) 0.40770(19) 0.5234(5) 0.132(3) Uani 1 1 d . . . . .
F14 F 0.2365(6) 0.42586(17) 0.6366(4) 0.112(3) Uani 1 1 d . . . . .
F15 F 0.3118(4) 0.38601(13) 0.5758(4) 0.0794(18) Uani 1 1 d . . . . .
F16 F 0.9559(4) 0.4550(2) 0.4776(4) 0.118(3) Uani 1 1 d . . . . .
F17 F 0.9814(4) 0.47690(15) 0.3602(5) 0.103(2) Uani 1 1 d . . . . .
F18 F 0.9009(4) 0.43038(14) 0.3710(5) 0.092(2) Uani 1 1 d . . . . .
F19 F 0.5059(6) 0.2856(3) 0.5515(5) 0.144(3) Uani 1 1 d . . . . .
F20 F 0.3694(5) 0.30952(15) 0.5894(4) 0.095(2) Uani 1 1 d . . . . .
F21 F 0.4055(6) 0.25949(17) 0.6294(5) 0.124(3) Uani 1 1 d . . . . .
N1 N -0.0999(4) 0.55691(16) 0.8937(4) 0.0371(15) Uani 1 1 d . . . . .
N5 N 0.6307(4) 0.42881(14) 0.5708(4) 0.0291(14) Uani 1 1 d . . . . .
C50 C -0.1345(6) 0.72885(19) 0.8471(5) 0.0360(18) Uani 1 1 d . . . . .
C39 C 0.2661(5) 0.66780(19) 0.7034(5) 0.0359(19) Uani 1 1 d . . . . .
N3 N -0.0436(4) 0.62523(15) 0.6606(4) 0.0348(15) Uani 1 1 d . . . . .
N9 N 0.8803(4) 0.26060(15) 0.8725(4) 0.0345(15) Uani 1 1 d . . . . .
C164 C 0.9094(6) 0.3211(2) 0.5840(6) 0.042(2) Uani 1 1 d . . . . .
H164 H 0.913048 0.329526 0.638408 0.050 Uiso 1 1 calc R U . . .
N4 N 0.6039(5) 0.39802(15) 0.4206(4) 0.0362(16) Uani 1 1 d . . . . .
O19 O 0.5693(3) 0.28260(14) 0.7193(3) 0.0404(12) Uani 1 1 d . . . . .
O6 O 0.1206(4) 0.64540(12) 0.7705(3) 0.0352(12) Uani 1 1 d . . . . .
O7 O -0.2071(3) 0.61731(13) 0.8075(3) 0.0366(12) Uani 1 1 d . . . . .
O9 O 0.6903(4) 0.35029(14) 0.4623(5) 0.0596(18) Uani 1 1 d . . . . .
O4 O 0.1086(3) 0.61021(14) 0.9227(3) 0.0370(12) Uani 1 1 d . . . . .
O3 O -0.0854(3) 0.62895(13) 0.9602(3) 0.0374(12) Uani 1 1 d . . . . .
O8 O -0.0709(4) 0.67327(12) 0.8207(3) 0.0370(13) Uani 1 1 d . . . . .
O11 O 0.6407(4) 0.45756(15) 0.3035(3) 0.0457(14) Uani 1 1 d . . . . .
O2 O -0.0482(4) 0.60380(14) 0.5289(3) 0.0475(15) Uani 1 1 d . . . . .
O24 O 0.7884(3) 0.29046(12) 0.7025(3) 0.0330(12) Uani 1 1 d . . . . .
O15 O 0.7452(3) 0.46295(13) 0.4550(3) 0.0333(11) Uani 1 1 d . . . . .
O22 O 0.8107(3) 0.33122(12) 0.8497(3) 0.0351(12) Uani 1 1 d . . . . .
O14 O 0.4201(3) 0.50132(12) 0.4361(3) 0.0356(13) Uani 1 1 d . . . . .
O5 O 0.0943(4) 0.57200(12) 0.7722(3) 0.0343(12) Uani 1 1 d . . . . .
O13 O 0.4233(3) 0.43586(12) 0.5165(3) 0.0337(12) Uani 1 1 d . . . . .
O20 O 0.5994(4) 0.33500(12) 0.8320(3) 0.0390(13) Uani 1 1 d . . . . .
O10 O 0.5789(4) 0.49310(16) 0.7246(4) 0.0548(16) Uani 1 1 d . . . . .
O12 O 0.4414(3) 0.44453(12) 0.3333(3) 0.0366(12) Uani 1 1 d . . . . .
O16 O 0.6253(4) 0.51854(12) 0.4016(4) 0.0409(13) Uani 1 1 d . . . . .
O18 O 0.9854(4) 0.23338(16) 0.9638(4) 0.0545(16) Uani 1 1 d . . . . .
O21 O 0.6927(4) 0.29950(12) 0.9746(3) 0.0380(12) Uani 1 1 d . . . . .
O1 O -0.1987(4) 0.50865(15) 0.8822(4) 0.0568(16) Uani 1 1 d . . . . .
O23 O 0.6999(4) 0.22779(12) 0.7605(3) 0.0376(12) Uani 1 1 d . . . . .
O17 O 0.4471(5) 0.21475(15) 0.9693(4) 0.0613(17) Uani 1 1 d . . . . .
N7 N 0.5260(4) 0.25554(16) 0.8893(4) 0.0404(16) Uani 1 1 d . . . . .
C95 C 0.2605(5) 0.52765(18) 0.4091(5) 0.0316(17) Uani 1 1 d . . . . .
N2 N -0.1007(4) 0.56316(15) 0.7237(4) 0.0334(14) Uani 1 1 d . . . . .
N6 N 0.5668(4) 0.49533(15) 0.5841(4) 0.0337(15) Uani 1 1 d . . . . .
C93 C 0.2753(5) 0.47076(19) 0.4862(5) 0.038(2) Uani 1 1 d . . . . .
H93 H 0.204533 0.471319 0.492060 0.046 Uiso 1 1 calc R U . . .
C162 C 0.8508(5) 0.29157(17) 0.5656(4) 0.0284(16) Uani 1 1 d . . . . .
C102 C 0.9109(6) 0.4604(2) 0.4045(6) 0.050(2) Uani 1 1 d . . . . .
C38 C 0.1970(5) 0.63821(18) 0.7276(5) 0.0333(18) Uani 1 1 d . . . . .
C106 C 0.7046(6) 0.5680(2) 0.3477(5) 0.0387(19) Uani 1 1 d . . . . .
C163 C 0.8462(5) 0.2807(2) 0.4829(5) 0.0399(18) Uani 1 1 d . . . . .
H163 H 0.807451 0.261234 0.468910 0.048 Uiso 1 1 calc R U . . .
C118 C 0.3786(6) 0.2964(2) 0.9058(6) 0.051(2) Uani 1 1 d . . . . .
C94 C 0.3245(6) 0.49878(18) 0.4454(5) 0.0317(17) Uani 1 1 d . . . . .
C151 C 0.9027(5) 0.38150(19) 0.8837(5) 0.0344(18) Uani 1 1 d . . . . .
C107 C 0.6132(6) 0.5825(2) 0.3265(6) 0.051(2) Uani 1 1 d . . . . .
H107 H 0.554653 0.568764 0.327492 0.061 Uiso 1 1 calc R U . . .
C28 C 0.2406(5) 0.6124(2) 1.0228(5) 0.0426(19) Uani 1 1 d . . . . .
C51 C -0.2102(5) 0.7509(2) 0.8784(5) 0.0392(19) Uani 1 1 d . . . . .
H51 H -0.274093 0.741912 0.891517 0.047 Uiso 1 1 calc R U . . .
C119 C 0.4158(5) 0.2611(2) 0.8734(5) 0.047(2) Uani 1 1 d . . . . .
H119 H 0.401373 0.259255 0.813409 0.057 Uiso 1 1 calc R U . . .
C123 C 0.6352(8) 0.1948(2) 1.0440(6) 0.057(2) Uani 1 1 d . . . . .
H123 H 0.575999 0.185447 1.066576 0.068 Uiso 1 1 calc R U . . .
C140 C 0.5003(5) 0.3857(2) 0.8242(5) 0.0390(19) Uani 1 1 d . . . . .
N8 N 0.7127(5) 0.23168(14) 0.9435(4) 0.0349(15) Uani 1 1 d . . . . .
C61 C 0.4275(7) 0.3530(2) 0.3985(6) 0.050(2) Uani 1 1 d . . . . .
H61 H 0.448058 0.357498 0.453181 0.061 Uiso 1 1 calc R U . . .
C69 C 0.6801(6) 0.4271(2) 0.7164(5) 0.046(2) Uani 1 1 d . . . . .
H69 H 0.683306 0.438283 0.767830 0.056 Uiso 1 1 calc R U . . .
C129 C 0.9838(5) 0.2713(2) 0.8488(5) 0.041(2) Uani 1 1 d . . . . .
H129 H 0.988195 0.296693 0.848439 0.049 Uiso 1 1 calc R U . . .
C166 C 0.9620(6) 0.3379(2) 0.5209(6) 0.050(2) Uani 1 1 d . . . . .
H166 H 1.002237 0.357121 0.534156 0.060 Uiso 1 1 calc R U . . .
C41 C 0.2333(6) 0.7019(2) 0.7140(6) 0.045(2) Uani 1 1 d . . . . .
H41 H 0.167342 0.706064 0.732843 0.053 Uiso 1 1 calc R U . . .
C49 C -0.1498(6) 0.6904(2) 0.8351(5) 0.0390(19) Uani 1 1 d . . . . .
C17 C -0.0165(6) 0.6552(2) 0.6063(5) 0.043(2) Uani 1 1 d . . . . .
H17 H 0.051577 0.663671 0.622763 0.051 Uiso 1 1 calc R U . . .
C103 C 0.8106(5) 0.47988(19) 0.4137(5) 0.0341(18) Uani 1 1 d . . . . .
C15 C -0.0600(5) 0.5995(2) 0.6122(5) 0.0354(19) Uani 1 1 d . . . . .
C70 C 0.6388(5) 0.4438(2) 0.6462(5) 0.0348(18) Uani 1 1 d . . . . .
C65 C 0.6513(5) 0.38206(18) 0.4780(6) 0.0366(19) Uani 1 1 d . . . . .
C52 C -0.0417(6) 0.7434(2) 0.8282(5) 0.046(2) Uani 1 1 d . . . . .
H52 H 0.009894 0.729370 0.807219 0.056 Uiso 1 1 calc R U . . .
C97 C 0.3048(6) 0.5486(2) 0.3487(6) 0.049(2) Uani 1 1 d . . . . .
H97 H 0.372103 0.544743 0.332833 0.059 Uiso 1 1 calc R U . . .
C29 C 0.3036(6) 0.5935(2) 0.9715(6) 0.056(2) Uani 1 1 d . . . . .
H29 H 0.275868 0.583322 0.923699 0.067 Uiso 1 1 calc R U . . .
C130 C 1.0143(5) 0.2573(2) 0.7645(5) 0.041(2) Uani 1 1 d . . . . .
C14 C -0.0919(5) 0.5651(2) 0.6408(5) 0.0359(18) Uani 1 1 d . . . . .
C125 C 0.8161(7) 0.2000(2) 1.0420(6) 0.051(2) Uani 1 1 d . . . . .
H125 H 0.880773 0.194453 1.063038 0.062 Uiso 1 1 calc R U . . .
C10 C -0.1317(5) 0.53284(19) 0.7560(5) 0.0366(18) Uani 1 1 d . . . . .
C7 C -0.1288(6) 0.5488(2) 0.9808(5) 0.047(2) Uani 1 1 d . . . . .
H7 H -0.166371 0.568441 1.004303 0.056 Uiso 1 1 calc R U . . .
C73 C 0.5106(6) 0.5272(2) 0.6139(6) 0.046(2) Uani 1 1 d . . . . .
H73 H 0.436868 0.523355 0.606600 0.055 Uiso 1 1 calc R U . . .
C58 C 0.3635(8) 0.3395(3) 0.2387(7) 0.075(3) Uani 1 1 d . . . . .
H58 H 0.341487 0.335391 0.184182 0.090 Uiso 1 1 calc R U . . .
C84 C 0.3246(5) 0.4372(2) 0.2208(5) 0.0365(18) Uani 1 1 d . . . . .
C124 C 0.7311(8) 0.1859(2) 1.0758(6) 0.061(3) Uani 1 1 d . . . . .
H124 H 0.736853 0.170374 1.120055 0.074 Uiso 1 1 calc R U . . .
C31 C 0.4070(7) 0.5891(3) 0.9889(7) 0.072(3) Uani 1 1 d . . . . .
H31 H 0.447406 0.575628 0.954096 0.087 Uiso 1 1 calc R U . . .
C64 C 0.6789(7) 0.3463(2) 0.3734(8) 0.070(3) Uani 1 1 d . . . . .
H64A H 0.654789 0.323209 0.359281 0.084 Uiso 1 1 calc R U . . .
H64B H 0.743358 0.350464 0.345630 0.084 Uiso 1 1 calc R U . . .
C132 C 0.9817(7) 0.2251(2) 0.7367(6) 0.053(2) Uani 1 1 d . . . . .
H132 H 0.934481 0.212796 0.767960 0.064 Uiso 1 1 calc R U . . .
C136 C 0.4454(8) 0.2904(3) 0.6147(7) 0.063(3) Uani 1 1 d . . . . .
C36 C 0.1685(6) 0.57517(19) 0.7231(5) 0.040(2) Uani 1 1 d . . . . .
C63 C 0.5983(6) 0.3743(2) 0.3481(6) 0.047(2) Uani 1 1 d . . . . .
H63 H 0.621275 0.386500 0.298041 0.056 Uiso 1 1 calc R U . . .
C6 C -0.0380(7) 0.5404(2) 1.0358(6) 0.048(2) Uani 1 1 d . . . . .
C11 C -0.1536(6) 0.5044(2) 0.7075(6) 0.049(2) Uani 1 1 d . . . . .
H11 H -0.176449 0.483956 0.731981 0.058 Uiso 1 1 calc R U . . .
C59 C 0.3328(7) 0.3383(3) 0.3825(6) 0.062(3) Uani 1 1 d . . . . .
H59 H 0.290152 0.333020 0.426781 0.075 Uiso 1 1 calc R U . . .
C25 C -0.0424(5) 0.63568(18) 1.0283(5) 0.0344(18) Uani 1 1 d . . . . .
C37 C 0.2207(5) 0.60437(17) 0.6980(5) 0.0389(19) Uani 1 1 d . . . . .
H37 H 0.273597 0.601850 0.660138 0.047 Uiso 1 1 calc R U . . .
C5 C 0.0585(7) 0.5334(2) 1.0046(6) 0.051(2) Uani 1 1 d . . . . .
H5 H 0.069075 0.534245 0.947380 0.062 Uiso 1 1 calc R U . . .
C85 C 0.2472(6) 0.4307(2) 0.2785(5) 0.047(2) Uani 1 1 d . . . . .
H85 H 0.262494 0.428558 0.335166 0.057 Uiso 1 1 calc R U . . .
C160 C 0.7526(6) 0.24076(19) 0.6221(5) 0.0375(19) Uani 1 1 d . . . . .
H160 H 0.753026 0.231593 0.568375 0.045 Uiso 1 1 calc R U . . .
C54 C -0.0231(6) 0.7788(2) 0.8395(6) 0.055(2) Uani 1 1 d . . . . .
H54 H 0.040512 0.787874 0.825736 0.066 Uiso 1 1 calc R U . . .
C24 C -0.1185(6) 0.6486(2) 1.0936(5) 0.043(2) Uani 1 1 d . . . . .
C104 C 0.8026(5) 0.51221(19) 0.3777(5) 0.0357(19) Uani 1 1 d . . . . .
H104 H 0.859754 0.521950 0.352743 0.043 Uiso 1 1 calc R U . . .
C133 C 1.1173(7) 0.2611(3) 0.6406(7) 0.078(3) Uani 1 1 d . . . . .
H133 H 1.162336 0.273426 0.607343 0.094 Uiso 1 1 calc R U . . .
C153 C 0.9064(7) 0.4122(2) 0.9283(6) 0.054(2) Uani 1 1 d . . . . .
H153 H 0.865480 0.415052 0.974851 0.065 Uiso 1 1 calc R U . . .
C48 C -0.2494(5) 0.6757(2) 0.8403(5) 0.043(2) Uani 1 1 d . . . . .
H48 H -0.303829 0.690012 0.854539 0.051 Uiso 1 1 calc R U . . .
C71 C 0.5937(6) 0.4787(2) 0.6490(5) 0.0375(19) Uani 1 1 d . . . . .
C105 C 0.7090(6) 0.5312(2) 0.3776(5) 0.0378(19) Uani 1 1 d . . . . .
C150 C 0.8340(5) 0.35223(18) 0.9069(5) 0.0301(17) Uani 1 1 d . . . . .
C141 C 0.5487(6) 0.3985(2) 0.8946(6) 0.048(2) Uani 1 1 d . . . . .
H141 H 0.598302 0.385015 0.921319 0.058 Uiso 1 1 calc R U . . .
C158 C 0.6708(7) 0.1855(2) 0.6593(6) 0.060(3) Uani 1 1 d D . . . .
C74 C 0.5381(6) 0.56122(19) 0.5727(6) 0.044(2) Uani 1 1 d . . . . .
C117 C 0.4250(6) 0.3135(2) 0.9703(6) 0.052(2) Uani 1 1 d . . . . .
H117 H 0.483707 0.303921 0.994499 0.063 Uiso 1 1 calc R U . . .
C57 C 0.3011(7) 0.3315(2) 0.3033(7) 0.061(3) Uani 1 1 d . . . . .
H57 H 0.237327 0.321504 0.293155 0.074 Uiso 1 1 calc R U . . .
C112 C 0.6813(8) 0.6766(2) 0.2806(7) 0.075(3) Uani 1 1 d . . . . .
H11A H 0.740238 0.683883 0.249932 0.112 Uiso 1 1 calc R U . . .
H11B H 0.676941 0.689871 0.331196 0.112 Uiso 1 1 calc R U . . .
H11C H 0.620673 0.680331 0.247280 0.112 Uiso 1 1 calc R U . . .
C126 C 0.8046(6) 0.22292(19) 0.9748(5) 0.0388(19) Uani 1 1 d . . . . .
C81 C 0.6107(6) 0.4542(2) 0.2312(6) 0.055(2) Uani 1 1 d . . . . .
C159 C 0.7106(6) 0.22096(19) 0.6847(5) 0.0378(19) Uani 1 1 d . . . . .
C92 C 0.3296(5) 0.44257(19) 0.5175(5) 0.0339(18) Uani 1 1 d . . . . .
C72 C 0.5363(9) 0.5271(3) 0.7073(6) 0.074(3) Uani 1 1 d . . . . .
H72A H 0.585698 0.545130 0.720741 0.089 Uiso 1 1 calc R U . . .
H72B H 0.475182 0.530925 0.739788 0.089 Uiso 1 1 calc R U . . .
C78 C 0.4886(8) 0.6142(3) 0.5073(7) 0.070(3) Uani 1 1 d . . . . .
H78 H 0.437239 0.628227 0.484744 0.085 Uiso 1 1 calc R U . . .
C8 C -0.2024(7) 0.5175(3) 0.9692(6) 0.065(3) Uani 1 1 d . . . . .
H8A H -0.180298 0.498058 1.003395 0.078 Uiso 1 1 calc R U . . .
H8B H -0.271493 0.523864 0.984687 0.078 Uiso 1 1 calc R U . . .
C13 C -0.1101(6) 0.5373(2) 0.5885(6) 0.045(2) Uani 1 1 d . . . . .
H13 H -0.101348 0.539414 0.531160 0.054 Uiso 1 1 calc R U . . .
C82 C 0.5139(6) 0.4473(2) 0.2006(6) 0.058(3) Uani 1 1 d . . . . .
H82 H 0.503243 0.445280 0.143276 0.069 Uiso 1 1 calc R U . . .
C138 C 0.4787(6) 0.3358(2) 0.7205(5) 0.044(2) Uani 1 1 d . . . . .
H138 H 0.426973 0.348300 0.693795 0.052 Uiso 1 1 calc R U . . .
C9 C -0.1411(6) 0.5339(2) 0.8477(5) 0.0377(19) Uani 1 1 d . . . . .
C67 C 0.7085(6) 0.3778(2) 0.6298(7) 0.052(2) Uani 1 1 d . . . . .
H67 H 0.731998 0.355176 0.622849 0.062 Uiso 1 1 calc R U . . .
C127 C 0.8896(5) 0.23973(19) 0.9335(5) 0.0352(18) Uani 1 1 d . . . . .
C152 C 0.9643(6) 0.3780(2) 0.8143(5) 0.045(2) Uani 1 1 d . . . . .
H152 H 0.962181 0.357565 0.783195 0.054 Uiso 1 1 calc R U . . .
C128 C 1.0502(6) 0.2568(3) 0.9199(6) 0.058(3) Uani 1 1 d . . . . .
H12A H 1.109338 0.244757 0.898170 0.070 Uiso 1 1 calc R U . . .
H12B H 1.073618 0.275397 0.956392 0.070 Uiso 1 1 calc R U . . .
C161 C 0.7953(5) 0.27428(17) 0.6347(5) 0.0297(17) Uani 1 1 d . . . . .
C115 C 0.3882(8) 0.3444(3) 1.0011(7) 0.068(3) Uani 1 1 d . . . . .
H115 H 0.421051 0.355577 1.045327 0.081 Uiso 1 1 calc R U . . .
C35 C 0.2044(6) 0.5389(2) 0.6899(7) 0.053(2) Uani 1 1 d . . . . .
C4 C -0.0525(9) 0.5383(2) 1.1220(6) 0.065(3) Uani 1 1 d . . . . .
H4 H -0.116324 0.542881 1.144679 0.078 Uiso 1 1 calc R U . . .
C147 C 0.7164(7) 0.3198(2) 1.1129(7) 0.072(3) Uani 1 1 d D . . . .
C167 C 0.9562(6) 0.3267(2) 0.4385(6) 0.047(2) Uani 1 1 d . . . . .
C122 C 0.6302(6) 0.21796(19) 0.9777(5) 0.042(2) Uani 1 1 d . . . . .
C100 C 0.1495(6) 0.5818(2) 0.3350(5) 0.042(2) Uani 1 1 d . . . . .
C101 C 0.0854(7) 0.6100(2) 0.2938(7) 0.069(3) Uani 1 1 d . . . . .
H10A H 0.055261 0.601218 0.243070 0.104 Uiso 1 1 calc R U . . .
H10B H 0.128114 0.629600 0.281233 0.104 Uiso 1 1 calc R U . . .
H10C H 0.032211 0.617135 0.330943 0.104 Uiso 1 1 calc R U . . .
C165 C 0.8983(6) 0.2983(2) 0.4205(5) 0.050(2) Uani 1 1 d . . . . .
H165 H 0.893300 0.290539 0.365680 0.060 Uiso 1 1 calc R U . . .
C139 C 0.5293(6) 0.3505(2) 0.7914(5) 0.042(2) Uani 1 1 d . . . . .
C16 C -0.0099(7) 0.6387(2) 0.5186(6) 0.053(2) Uani 1 1 d . . . . .
H16A H -0.051562 0.651447 0.478560 0.064 Uiso 1 1 calc R U . . .
H16B H 0.060300 0.638354 0.499572 0.064 Uiso 1 1 calc R U . . .
C83 C 0.4299(6) 0.44332(19) 0.2556(6) 0.040(2) Uani 1 1 d . . . . .
C2 C 0.0293(14) 0.5293(3) 1.1731(8) 0.106(5) Uani 1 1 d . . . . .
H2 H 0.019770 0.527902 1.230464 0.127 Uiso 1 1 calc R U . . .
C99 C 0.2493(6) 0.5748(2) 0.3129(7) 0.062(3) Uani 1 1 d . . . . .
H99 H 0.279745 0.588395 0.272193 0.074 Uiso 1 1 calc R U . . .
C131 C 1.0816(6) 0.2757(3) 0.7153(6) 0.064(3) Uani 1 1 d . . . . .
H131 H 1.103278 0.297726 0.731506 0.077 Uiso 1 1 calc R U . . .
C96 C 0.1600(6) 0.5338(2) 0.4314(5) 0.044(2) Uani 1 1 d . . . . .
H96 H 0.128616 0.519909 0.471056 0.053 Uiso 1 1 calc R U . . .
C108 C 0.7916(6) 0.58855(19) 0.3448(5) 0.044(2) Uani 1 1 d . . . . .
H108 H 0.855477 0.578989 0.356988 0.052 Uiso 1 1 calc R U . . .
C66 C 0.6659(5) 0.39580(18) 0.5637(5) 0.0370(19) Uani 1 1 d . . . . .
C40 C 0.3633(7) 0.6627(2) 0.6744(8) 0.080(4) Uani 1 1 d . . . . .
H40 H 0.388005 0.640308 0.666548 0.096 Uiso 1 1 calc R U . . .
C148 C 0.7375(5) 0.3229(2) 1.0175(5) 0.0343(18) Uani 1 1 d . . . . .
C143 C 0.5259(8) 0.4306(3) 0.9263(6) 0.065(3) Uani 1 1 d . . . . .
H143 H 0.559635 0.438187 0.974441 0.078 Uiso 1 1 calc R U . . .
C168 C 1.0108(8) 0.3468(3) 0.3695(7) 0.072(3) Uani 1 1 d . . . . .
H16C H 1.030542 0.331043 0.326173 0.108 Uiso 1 1 calc R U . . .
H16D H 1.070601 0.357977 0.392335 0.108 Uiso 1 1 calc R U . . .
H16E H 0.965317 0.364095 0.346635 0.108 Uiso 1 1 calc R U . . .
C76 C 0.4638(6) 0.5821(2) 0.5388(6) 0.052(2) Uani 1 1 d . . . . .
H76 H 0.396203 0.574500 0.537077 0.062 Uiso 1 1 calc R U . . .
C43 C 0.2960(6) 0.7294(2) 0.6972(6) 0.055(3) Uani 1 1 d . . . . .
H43 H 0.272153 0.751944 0.705373 0.067 Uiso 1 1 calc R U . . .
C62 C 0.4916(6) 0.36084(18) 0.3336(5) 0.0379(19) Uani 1 1 d . . . . .
C3 C 0.1386(8) 0.5251(2) 1.0575(8) 0.071(3) Uani 1 1 d . . . . .
H3 H 0.203573 0.521332 1.036187 0.085 Uiso 1 1 calc R U . . .
C120 C 0.3660(7) 0.2304(2) 0.9191(6) 0.061(3) Uani 1 1 d . . . . .
H12C H 0.310962 0.238438 0.954340 0.074 Uiso 1 1 calc R U . . .
H12D H 0.338386 0.213689 0.879419 0.074 Uiso 1 1 calc R U . . .
C144 C 0.4049(7) 0.4396(2) 0.8188(7) 0.067(3) Uani 1 1 d . . . . .
H144 H 0.355889 0.453220 0.791742 0.080 Uiso 1 1 calc R U . . .
C142 C 0.4268(6) 0.4069(2) 0.7873(7) 0.058(3) Uani 1 1 d . . . . .
H142 H 0.391409 0.399037 0.740258 0.070 Uiso 1 1 calc R U . . .
C12 C -0.1417(6) 0.5063(2) 0.6229(6) 0.052(2) Uani 1 1 d . . . . .
H12 H -0.154729 0.487075 0.589211 0.062 Uiso 1 1 calc R U . . .
C68 C 0.7157(6) 0.3941(3) 0.7075(6) 0.055(3) Uani 1 1 d . . . . .
H68 H 0.744582 0.382530 0.752864 0.067 Uiso 1 1 calc R U . . .
C27 C 0.1302(5) 0.61779(19) 0.9960(5) 0.0362(18) Uani 1 1 d . . . . .
C149 C 0.8026(6) 0.3481(2) 0.9904(5) 0.045(2) Uani 1 1 d . . . . .
H149 H 0.828051 0.363726 1.029723 0.054 Uiso 1 1 calc R U . . .
C30 C 0.2827(7) 0.6279(3) 1.0936(6) 0.073(3) Uani 1 1 d . . . . .
H30 H 0.242349 0.640924 1.129423 0.087 Uiso 1 1 calc R U . . .
C53 C -0.1911(6) 0.7852(2) 0.8897(5) 0.044(2) Uani 1 1 d . . . . .
H53 H -0.242899 0.799059 0.911063 0.053 Uiso 1 1 calc R U . . .
C88 C 0.1977(6) 0.4344(2) 0.1117(6) 0.054(2) Uani 1 1 d . . . . .
H88 H 0.181301 0.435151 0.055090 0.064 Uiso 1 1 calc R U . . .
C109 C 0.6045(6) 0.6165(2) 0.3038(6) 0.059(2) Uani 1 1 d . . . . .
H109 H 0.540543 0.625458 0.289482 0.071 Uiso 1 1 calc R U . . .
C26 C 0.0585(6) 0.63145(19) 1.0531(5) 0.0373(19) Uani 1 1 d . . . . .
H26 H 0.079215 0.637513 1.106947 0.045 Uiso 1 1 calc R U . . .
C91 C 0.2646(6) 0.4149(2) 0.5619(6) 0.048(2) Uani 1 1 d . . . . .
C121 C 0.5330(6) 0.2301(2) 0.9415(5) 0.043(2) Uani 1 1 d . . . . .
C137 C 0.5043(6) 0.3037(2) 0.6909(5) 0.042(2) Uani 1 1 d . . . . .
C116 C 0.2911(7) 0.3099(3) 0.8695(8) 0.081(4) Uani 1 1 d . . . . .
H116 H 0.258278 0.298523 0.825526 0.097 Uiso 1 1 calc R U . . .
C110 C 0.7833(6) 0.6234(2) 0.3236(6) 0.049(2) Uani 1 1 d . . . . .
H110 H 0.841905 0.637155 0.324188 0.059 Uiso 1 1 calc R U . . .
C55 C -0.0979(7) 0.80075(19) 0.8711(5) 0.043(2) Uani 1 1 d . . . . .
C89 C 0.1209(6) 0.4297(2) 0.1680(6) 0.048(2) Uani 1 1 d . . . . .
C1 C 0.1223(11) 0.5224(3) 1.1419(9) 0.087(4) Uani 1 1 d . . . . .
H1 H 0.175671 0.515805 1.177450 0.105 Uiso 1 1 calc R U . . .
C156 C 1.0319(7) 0.4358(2) 0.8385(7) 0.064(3) Uani 1 1 d . . . . .
C134 C 1.0173(8) 0.2109(3) 0.6637(7) 0.071(3) Uani 1 1 d . . . . .
H134 H 0.994420 0.189120 0.646484 0.085 Uiso 1 1 calc R U . . .
C56 C -0.0768(7) 0.8381(2) 0.8841(7) 0.064(3) Uani 1 1 d . . . . .
H56A H -0.096449 0.844610 0.939412 0.097 Uiso 1 1 calc R U . . .
H56B H -0.115138 0.851466 0.843967 0.097 Uiso 1 1 calc R U . . .
H56C H -0.004959 0.842385 0.877201 0.097 Uiso 1 1 calc R U . . .
C86 C 0.2980(6) 0.4381(2) 0.1364(6) 0.052(2) Uani 1 1 d . . . . .
H86 H 0.348428 0.441212 0.096661 0.063 Uiso 1 1 calc R U . . .
C154 C 1.0288(7) 0.4047(2) 0.7913(7) 0.061(3) Uani 1 1 d . . . . .
H154 H 1.070090 0.402324 0.744747 0.073 Uiso 1 1 calc R U . . .
C80 C 0.7026(11) 0.4571(4) 0.1641(6) 0.114(5) Uani 1 1 d D . . . .
C60 C 0.4603(7) 0.3539(2) 0.2531(6) 0.065(3) Uani 1 1 d . . . . .
H60 H 0.503098 0.358786 0.208668 0.077 Uiso 1 1 calc R U . . .
C155 C 0.9720(8) 0.4391(2) 0.9034(7) 0.070(3) Uani 1 1 d . . . . .
H155 H 0.972972 0.459727 0.933553 0.084 Uiso 1 1 calc R U . . .
C75 C 0.6379(7) 0.5730(3) 0.5688(8) 0.070(3) Uani 1 1 d . . . . .
H75 H 0.689829 0.558785 0.589428 0.084 Uiso 1 1 calc R U . . .
C32 C 0.3877(7) 0.6235(4) 1.1096(7) 0.109(5) Uani 1 1 d . . . . .
H32 H 0.416368 0.633766 1.156939 0.130 Uiso 1 1 calc R U . . .
C111 C 0.6908(7) 0.6382(2) 0.3018(6) 0.051(2) Uani 1 1 d . . . . .
C98 C 0.1069(6) 0.5607(2) 0.3944(6) 0.053(2) Uani 1 1 d . . . . .
H98 H 0.039651 0.564772 0.410235 0.063 Uiso 1 1 calc R U . . .
C33 C 0.4489(8) 0.6049(4) 1.0585(7) 0.106(5) Uani 1 1 d . . . . .
C145 C 0.4525(7) 0.4523(2) 0.8877(6) 0.059(3) Uani 1 1 d . . . . .
C87 C 0.1484(6) 0.4276(2) 0.2496(6) 0.057(2) Uani 1 1 d . . . . .
H87 H 0.097156 0.423782 0.288403 0.069 Uiso 1 1 calc R U . . .
C46 C -0.3805(8) 0.6286(3) 0.8264(9) 0.076(3) Uani 1 1 d . . . . .
C47 C -0.2684(6) 0.6409(2) 0.8250(5) 0.040(2) Uani 1 1 d . . . . .
C146 C 0.4321(10) 0.4875(3) 0.9214(8) 0.095(4) Uani 1 1 d . . . . .
H14A H 0.372496 0.497087 0.894276 0.143 Uiso 1 1 calc R U . . .
H14B H 0.489964 0.502283 0.911244 0.143 Uiso 1 1 calc R U . . .
H14C H 0.420754 0.486043 0.980348 0.143 Uiso 1 1 calc R U . . .
C135 C 1.0855(8) 0.2285(3) 0.6170(7) 0.078(3) Uani 1 1 d . . . . .
H135 H 1.110900 0.218531 0.568679 0.094 Uiso 1 1 calc R U . . .
C157 C 1.1066(8) 0.4646(3) 0.8135(8) 0.098(4) Uani 1 1 d . . . . .
H15A H 1.087543 0.485977 0.840034 0.147 Uiso 1 1 calc R U . . .
H15B H 1.104305 0.467576 0.753964 0.147 Uiso 1 1 calc R U . . .
H15C H 1.174800 0.458325 0.830697 0.147 Uiso 1 1 calc R U . . .
C79 C 0.5868(11) 0.6258(3) 0.5087(8) 0.083(4) Uani 1 1 d . . . . .
H79 H 0.601487 0.648239 0.490942 0.100 Uiso 1 1 calc R U . . .
C114 C 0.2530(9) 0.3413(4) 0.9007(11) 0.104(5) Uani 1 1 d . . . . .
H114 H 0.193749 0.350956 0.877657 0.124 Uiso 1 1 calc R U . . .
C90 C 0.0104(6) 0.4278(3) 0.1409(7) 0.074(3) Uani 1 1 d . . . . .
H90A H -0.028662 0.444467 0.171808 0.110 Uiso 1 1 calc R U . . .
H90B H -0.015480 0.404910 0.151142 0.110 Uiso 1 1 calc R U . . .
H90C H 0.004886 0.432959 0.082339 0.110 Uiso 1 1 calc R U . . .
C113 C 0.3029(11) 0.3579(3) 0.9653(10) 0.093(4) Uani 1 1 d . . . . .
H113 H 0.277447 0.378949 0.984874 0.112 Uiso 1 1 calc R U . . .
C44 C 0.3916(8) 0.7245(2) 0.6691(9) 0.091(4) Uani 1 1 d . . . . .
C45 C 0.4626(10) 0.7553(3) 0.6529(12) 0.156(8) Uani 1 1 d . . . . .
H45A H 0.435114 0.769029 0.607912 0.234 Uiso 1 1 calc R U . . .
H45B H 0.529171 0.746863 0.638207 0.234 Uiso 1 1 calc R U . . .
H45C H 0.468002 0.769266 0.702358 0.234 Uiso 1 1 calc R U . . .
C77 C 0.6641(9) 0.6047(3) 0.5361(8) 0.090(4) Uani 1 1 d . . . . .
H77 H 0.732229 0.611485 0.532770 0.108 Uiso 1 1 calc R U . . .
C42 C 0.4239(8) 0.6908(3) 0.6570(11) 0.128(7) Uani 1 1 d . . . . .
H42 H 0.489123 0.687026 0.636262 0.154 Uiso 1 1 calc R U . . .
C34 C 0.5644(8) 0.6010(6) 1.0791(10) 0.194(10) Uani 1 1 d . . . . .
H34A H 0.580559 0.613539 1.129345 0.290 Uiso 1 1 calc R U . . .
H34B H 0.603827 0.610111 1.033924 0.290 Uiso 1 1 calc R U . . .
H34C H 0.580597 0.576834 1.086879 0.290 Uiso 1 1 calc R U . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Eu Eu -0.1578 3.6682 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 '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'
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
C19 C18 C20 120.0 . . ?
C19 C18 C17 120.1(5) . . ?
C20 C18 C17 119.7(5) . . ?
C23 C19 C18 120.0 . . ?
C23 C19 H19 120.0 . . ?
C18 C19 H19 120.0 . . ?
C19 C23 C21 120.0 . . ?
C19 C23 H23 120.0 . . ?
C21 C23 H23 120.0 . . ?
C22 C21 C23 120.0 . . ?
C22 C21 H21 120.0 . . ?
C23 C21 H21 120.0 . . ?
C21 C22 C20 120.0 . . ?
C21 C22 H22 120.0 . . ?
C20 C22 H22 120.0 . . ?
C22 C20 C18 120.0 . . ?
C22 C20 H20 120.0 . . ?
C18 C20 H20 120.0 . . ?
C80 F10 F12 55.1(9) . . ?
C80 F12 F10 42.6(6) . . ?
C80 F11A F10A 53.9(9) . . ?
C80 F10A F11A 56.8(9) . . ?
O4 Eu1 O8 104.27(18) . . ?
O4 Eu1 O7 143.92(17) . . ?
O8 Eu1 O7 72.44(17) . . ?
O4 Eu1 O5 72.74(17) . . ?
O8 Eu1 O5 143.33(17) . . ?
O7 Eu1 O5 131.32(17) . . ?
O4 Eu1 O3 69.22(16) . . ?
O8 Eu1 O3 72.44(18) . . ?
O7 Eu1 O3 75.82(16) . . ?
O5 Eu1 O3 133.91(17) . . ?
O4 Eu1 O6 71.07(17) . . ?
O8 Eu1 O6 72.62(16) . . ?
O7 Eu1 O6 136.05(18) . . ?
O5 Eu1 O6 71.98(16) . . ?
O3 Eu1 O6 117.09(16) . . ?
O4 Eu1 N1 86.46(19) . . ?
O8 Eu1 N1 136.03(18) . . ?
O7 Eu1 N1 74.36(18) . . ?
O5 Eu1 N1 80.64(17) . . ?
O3 Eu1 N1 72.09(18) . . ?
O6 Eu1 N1 148.56(17) . . ?
O4 Eu1 N3 136.28(17) . . ?
O8 Eu1 N3 78.57(18) . . ?
O7 Eu1 N3 79.27(18) . . ?
O5 Eu1 N3 79.84(18) . . ?
O3 Eu1 N3 146.24(18) . . ?
O6 Eu1 N3 68.36(17) . . ?
N1 Eu1 N3 122.15(19) . . ?
O4 Eu1 N2 128.26(18) . . ?
O8 Eu1 N2 127.18(18) . . ?
O7 Eu1 N2 68.25(17) . . ?
O5 Eu1 N2 63.15(16) . . ?
O3 Eu1 N2 127.02(17) . . ?
O6 Eu1 N2 115.83(17) . . ?
N1 Eu1 N2 61.7(2) . . ?
N3 Eu1 N2 60.81(18) . . ?
O14 Eu2 O16 72.80(16) . . ?
O14 Eu2 O12 70.68(17) . . ?
O16 Eu2 O12 108.44(18) . . ?
O14 Eu2 O15 140.51(16) . . ?
O16 Eu2 O15 70.81(16) . . ?
O12 Eu2 O15 136.16(17) . . ?
O14 Eu2 O11 112.24(19) . . ?
O16 Eu2 O11 72.27(19) . . ?
O12 Eu2 O11 68.27(16) . . ?
O15 Eu2 O11 70.22(16) . . ?
O14 Eu2 O13 72.14(16) . . ?
O16 Eu2 O13 140.61(16) . . ?
O12 Eu2 O13 75.89(17) . . ?
O15 Eu2 O13 133.47(15) . . ?
O11 Eu2 O13 138.88(17) . . ?
O14 Eu2 N4 141.00(17) . . ?
O16 Eu2 N4 140.31(19) . . ?
O12 Eu2 N4 77.29(18) . . ?
O15 Eu2 N4 78.46(18) . . ?
O11 Eu2 N4 74.1(2) . . ?
O13 Eu2 N4 79.06(18) . . ?
O14 Eu2 N5 125.61(18) . . ?
O16 Eu2 N5 121.75(17) . . ?
O12 Eu2 N5 129.68(17) . . ?
O15 Eu2 N5 65.34(16) . . ?
O11 Eu2 N5 122.15(18) . . ?
O13 Eu2 N5 68.16(16) . . ?
N4 Eu2 N5 62.5(2) . . ?
O14 Eu2 N6 74.25(18) . . ?
O16 Eu2 N6 77.54(19) . . ?
O12 Eu2 N6 140.31(17) . . ?
O15 Eu2 N6 83.38(17) . . ?
O11 Eu2 N6 144.91(18) . . ?
O13 Eu2 N6 76.19(17) . . ?
N4 Eu2 N6 123.7(2) . . ?
N5 Eu2 N6 61.44(18) . . ?
O23 Eu3 O20 140.95(17) . . ?
O23 Eu3 O19 71.45(18) . . ?
O20 Eu3 O19 69.72(18) . . ?
O23 Eu3 O24 72.78(16) . . ?
O20 Eu3 O24 100.07(17) . . ?
O19 Eu3 O24 74.08(16) . . ?
O23 Eu3 O21 133.68(17) . . ?
O20 Eu3 O21 74.85(17) . . ?
O19 Eu3 O21 133.66(17) . . ?
O24 Eu3 O21 142.29(16) . . ?
O23 Eu3 O22 136.59(17) . . ?
O20 Eu3 O22 70.41(16) . . ?
O19 Eu3 O22 120.91(17) . . ?
O24 Eu3 O22 72.06(16) . . ?
O21 Eu3 O22 71.10(17) . . ?
O23 Eu3 N7 81.35(18) . . ?
O20 Eu3 N7 83.35(19) . . ?
O19 Eu3 N7 72.45(19) . . ?
O24 Eu3 N7 142.71(18) . . ?
O21 Eu3 N7 74.70(19) . . ?
O22 Eu3 N7 141.11(18) . . ?
O23 Eu3 N9 79.18(17) . . ?
O20 Eu3 N9 138.09(18) . . ?
O19 Eu3 N9 144.09(18) . . ?
O24 Eu3 N9 77.88(18) . . ?
O21 Eu3 N9 81.90(18) . . ?
O22 Eu3 N9 69.24(17) . . ?
N7 Eu3 N9 123.5(2) . . ?
O23 Eu3 N8 70.82(18) . . ?
O20 Eu3 N8 130.44(18) . . ?
O19 Eu3 N8 123.85(18) . . ?
O24 Eu3 N8 129.14(17) . . ?
O21 Eu3 N8 62.98(17) . . ?
O22 Eu3 N8 115.14(18) . . ?
N7 Eu3 N8 62.06(19) . . ?
N9 Eu3 N8 61.43(19) . . ?
C9 N1 C7 106.7(6) . . ?
C9 N1 Eu1 118.8(5) . . ?
C7 N1 Eu1 132.4(5) . . ?
C70 N5 C66 117.1(6) . . ?
C70 N5 Eu2 122.2(5) . . ?
C66 N5 Eu2 120.5(5) . . ?
C52 C50 C51 117.4(7) . . ?
C52 C50 C49 119.3(7) . . ?
C51 C50 C49 123.2(7) . . ?
C40 C39 C41 117.6(7) . . ?
C40 C39 C38 122.7(7) . . ?
C41 C39 C38 119.7(7) . . ?
C15 N3 C17 106.7(6) . . ?
C15 N3 Eu1 118.6(5) . . ?
C17 N3 Eu1 133.3(5) . . ?
C127 N9 C129 107.2(6) . . ?
C127 N9 Eu3 118.6(5) . . ?
C129 N9 Eu3 133.4(5) . . ?
C166 C164 C162 119.9(8) . . ?
C166 C164 H164 120.1 . . ?
C162 C164 H164 120.1 . . ?
C65 N4 C63 106.9(6) . . ?
C65 N4 Eu2 119.7(5) . . ?
C63 N4 Eu2 132.7(5) . . ?
C137 O19 Eu3 136.3(5) . . ?
C38 O6 Eu1 135.9(5) . . ?
C47 O7 Eu1 131.3(5) . . ?
C65 O9 C64 104.2(6) . . ?
C27 O4 Eu1 141.6(4) . . ?
C25 O3 Eu1 134.6(4) . . ?
C49 O8 Eu1 135.4(5) . . ?
C81 O11 Eu2 135.9(5) . . ?
C15 O2 C16 105.6(6) . . ?
C161 O24 Eu3 135.2(4) . . ?
C103 O15 Eu2 128.4(4) . . ?
C150 O22 Eu3 137.7(5) . . ?
C94 O14 Eu2 136.0(4) . . ?
C36 O5 Eu1 131.5(5) . . ?
C92 O13 Eu2 130.5(5) . . ?
C139 O20 Eu3 140.3(5) . . ?
C71 O10 C72 104.9(7) . . ?
C83 O12 Eu2 141.4(5) . . ?
C105 O16 Eu2 137.0(5) . . ?
C127 O18 C128 105.0(6) . . ?
C148 O21 Eu3 134.7(5) . . ?
C9 O1 C8 104.6(6) . . ?
C159 O23 Eu3 129.9(5) . . ?
C121 O17 C120 103.9(7) . . ?
C121 N7 C119 106.4(6) . . ?
C121 N7 Eu3 118.7(5) . . ?
C119 N7 Eu3 134.7(5) . . ?
C96 C95 C97 118.9(7) . . ?
C96 C95 C94 123.5(7) . . ?
C97 C95 C94 117.6(6) . . ?
C10 N2 C14 117.6(6) . . ?
C10 N2 Eu1 120.5(5) . . ?
C14 N2 Eu1 120.9(5) . . ?
C71 N6 C73 106.4(7) . . ?
C71 N6 Eu2 119.1(5) . . ?
C73 N6 Eu2 131.0(5) . . ?
C92 C93 C94 121.9(7) . . ?
C92 C93 H93 119.1 . . ?
C94 C93 H93 119.1 . . ?
C163 C162 C164 117.5(7) . . ?
C163 C162 C161 124.0(6) . . ?
C164 C162 C161 118.5(7) . . ?
F18 C102 F16 105.6(8) . . ?
F18 C102 F17 105.9(8) . . ?
F16 C102 F17 104.2(7) . . ?
F18 C102 C103 113.7(7) . . ?
F16 C102 C103 111.6(7) . . ?
F17 C102 C103 114.9(7) . . ?
O6 C38 C37 124.4(7) . . ?
O6 C38 C39 117.3(6) . . ?
C37 C38 C39 118.2(6) . . ?
C107 C106 C108 118.5(7) . . ?
C107 C106 C105 119.9(7) . . ?
C108 C106 C105 121.5(7) . . ?
C162 C163 C165 121.4(7) . . ?
C162 C163 H163 119.3 . . ?
C165 C163 H163 119.3 . . ?
C117 C118 C116 119.9(10) . . ?
C117 C118 C119 122.9(7) . . ?
C116 C118 C119 117.1(9) . . ?
O14 C94 C93 124.5(6) . . ?
O14 C94 C95 116.3(6) . . ?
C93 C94 C95 119.1(6) . . ?
C153 C151 C152 118.8(7) . . ?
C153 C151 C150 122.4(7) . . ?
C152 C151 C150 118.8(7) . . ?
C106 C107 C109 122.1(8) . . ?
C106 C107 H107 119.0 . . ?
C109 C107 H107 119.0 . . ?
C29 C28 C30 118.7(8) . . ?
C29 C28 C27 118.5(7) . . ?
C30 C28 C27 122.6(8) . . ?
C53 C51 C50 120.6(7) . . ?
C53 C51 H51 119.7 . . ?
C50 C51 H51 119.7 . . ?
N7 C119 C120 103.0(7) . . ?
N7 C119 C118 112.4(7) . . ?
C120 C119 C118 112.4(7) . . ?
N7 C119 H119 109.6 . . ?
C120 C119 H119 109.6 . . ?
C118 C119 H119 109.6 . . ?
C124 C123 C122 118.2(9) . . ?
C124 C123 H123 120.9 . . ?
C122 C123 H123 120.9 . . ?
C141 C140 C142 116.4(8) . . ?
C141 C140 C139 119.7(7) . . ?
C142 C140 C139 123.9(8) . . ?
C122 N8 C126 118.3(7) . . ?
C122 N8 Eu3 120.6(5) . . ?
C126 N8 Eu3 120.5(5) . . ?
C62 C61 C59 120.1(9) . . ?
C62 C61 H61 119.9 . . ?
C59 C61 H61 119.9 . . ?
C68 C69 C70 118.3(9) . . ?
C68 C69 H69 120.9 . . ?
C70 C69 H69 120.9 . . ?
N9 C129 C130 112.7(6) . . ?
N9 C129 C128 102.8(7) . . ?
C130 C129 C128 112.5(7) . . ?
N9 C129 H129 109.6 . . ?
C130 C129 H129 109.6 . . ?
C128 C129 H129 109.6 . . ?
C164 C166 C167 121.8(8) . . ?
C164 C166 H166 119.1 . . ?
C167 C166 H166 119.1 . . ?
C43 C41 C39 121.4(7) . . ?
C43 C41 H41 119.3 . . ?
C39 C41 H41 119.3 . . ?
O8 C49 C48 123.9(7) . . ?
O8 C49 C50 115.8(7) . . ?
C48 C49 C50 120.3(7) . . ?
N3 C17 C18 112.4(6) . . ?
N3 C17 C16 103.1(6) . . ?
C18 C17 C16 115.0(7) . . ?
N3 C17 H17 108.7 . . ?
C18 C17 H17 108.7 . . ?
C16 C17 H17 108.7 . . ?
O15 C103 C104 129.5(7) . . ?
O15 C103 C102 112.7(7) . . ?
C104 C103 C102 117.8(7) . . ?
N3 C15 O2 119.0(7) . . ?
N3 C15 C14 124.0(7) . . ?
O2 C15 C14 117.0(7) . . ?
N5 C70 C69 123.5(8) . . ?
N5 C70 C71 113.2(7) . . ?
C69 C70 C71 123.3(8) . . ?
N4 C65 O9 119.2(8) . . ?
N4 C65 C66 123.9(7) . . ?
O9 C65 C66 116.9(7) . . ?
C50 C52 C54 121.6(7) . . ?
C50 C52 H52 119.2 . . ?
C54 C52 H52 119.2 . . ?
C99 C97 C95 119.8(8) . . ?
C99 C97 H97 120.1 . . ?
C95 C97 H97 120.1 . . ?
C28 C29 C31 122.2(9) . . ?
C28 C29 H29 118.9 . . ?
C31 C29 H29 118.9 . . ?
C132 C130 C131 118.0(9) . . ?
C132 C130 C129 121.6(8) . . ?
C131 C130 C129 120.2(8) . . ?
N2 C14 C13 122.9(8) . . ?
N2 C14 C15 113.0(7) . . ?
C13 C14 C15 124.1(8) . . ?
C124 C125 C126 118.6(9) . . ?
C124 C125 H125 120.7 . . ?
C126 C125 H125 120.7 . . ?
N2 C10 C11 122.6(8) . . ?
N2 C10 C9 112.9(6) . . ?
C11 C10 C9 124.5(7) . . ?
N1 C7 C6 112.8(7) . . ?
N1 C7 C8 102.5(7) . . ?
C6 C7 C8 112.9(7) . . ?
N1 C7 H7 109.5 . . ?
C6 C7 H7 109.5 . . ?
C8 C7 H7 109.5 . . ?
C74 C73 N6 116.5(7) . . ?
C74 C73 C72 112.4(7) . . ?
N6 C73 C72 101.7(6) . . ?
C74 C73 H73 108.6 . . ?
N6 C73 H73 108.6 . . ?
C72 C73 H73 108.6 . . ?
C57 C58 C60 120.9(10) . . ?
C57 C58 H58 119.5 . . ?
C60 C58 H58 119.5 . . ?
C86 C84 C85 118.1(7) . . ?
C86 C84 C83 125.1(8) . . ?
C85 C84 C83 116.7(7) . . ?
C125 C124 C123 119.7(8) . . ?
C125 C124 H124 120.1 . . ?
C123 C124 H124 120.1 . . ?
C33 C31 C29 119.1(10) . . ?
C33 C31 H31 120.5 . . ?
C29 C31 H31 120.5 . . ?
O9 C64 C63 104.3(7) . . ?
O9 C64 H64A 110.9 . . ?
C63 C64 H64A 110.9 . . ?
O9 C64 H64B 110.9 . . ?
C63 C64 H64B 110.9 . . ?
H64A C64 H64B 108.9 . . ?
C130 C132 C134 121.7(10) . . ?
C130 C132 H132 119.2 . . ?
C134 C132 H132 119.2 . . ?
F19 C136 F20 107.8(10) . . ?
F19 C136 F21 104.9(10) . . ?
F20 C136 F21 105.4(8) . . ?
F19 C136 C137 111.3(8) . . ?
F20 C136 C137 115.8(9) . . ?
F21 C136 C137 110.9(8) . . ?
O5 C36 C37 130.4(7) . . ?
O5 C36 C35 111.1(6) . . ?
C37 C36 C35 118.4(7) . . ?
N4 C63 C62 111.8(7) . . ?
N4 C63 C64 101.3(7) . . ?
C62 C63 C64 115.3(7) . . ?
N4 C63 H63 109.4 . . ?
C62 C63 H63 109.4 . . ?
C64 C63 H63 109.4 . . ?
C5 C6 C4 118.6(9) . . ?
C5 C6 C7 122.9(8) . . ?
C4 C6 C7 118.5(9) . . ?
C12 C11 C10 119.6(8) . . ?
C12 C11 H11 120.2 . . ?
C10 C11 H11 120.2 . . ?
C57 C59 C61 121.0(9) . . ?
C57 C59 H59 119.5 . . ?
C61 C59 H59 119.5 . . ?
O3 C25 C26 130.2(7) . . ?
O3 C25 C24 112.0(6) . . ?
C26 C25 C24 117.7(7) . . ?
C36 C37 C38 122.7(7) . . ?
C36 C37 H37 118.7 . . ?
C38 C37 H37 118.7 . . ?
C3 C5 C6 120.7(10) . . ?
C3 C5 H5 119.6 . . ?
C6 C5 H5 119.6 . . ?
C87 C85 C84 118.5(8) . . ?
C87 C85 H85 120.8 . . ?
C84 C85 H85 120.8 . . ?
C159 C160 C161 123.9(7) . . ?
C159 C160 H160 118.0 . . ?
C161 C160 H160 118.0 . . ?
C52 C54 C55 121.2(8) . . ?
C52 C54 H54 119.4 . . ?
C55 C54 H54 119.4 . . ?
F3 C24 F1 105.7(7) . . ?
F3 C24 F2 106.4(7) . . ?
F1 C24 F2 106.8(7) . . ?
F3 C24 C25 111.7(7) . . ?
F1 C24 C25 111.1(7) . . ?
F2 C24 C25 114.6(6) . . ?
C103 C104 C105 121.7(7) . . ?
C103 C104 H104 119.2 . . ?
C105 C104 H104 119.2 . . ?
C135 C133 C131 119.8(10) . . ?
C135 C133 H133 120.1 . . ?
C131 C133 H133 120.1 . . ?
C151 C153 C155 120.1(9) . . ?
C151 C153 H153 119.9 . . ?
C155 C153 H153 119.9 . . ?
C47 C48 C49 122.5(7) . . ?
C47 C48 H48 118.7 . . ?
C49 C48 H48 118.7 . . ?
N6 C71 O10 119.2(7) . . ?
N6 C71 C70 123.1(7) . . ?
O10 C71 C70 117.7(7) . . ?
O16 C105 C104 123.4(7) . . ?
O16 C105 C106 115.6(7) . . ?
C104 C105 C106 121.0(6) . . ?
O22 C150 C149 123.1(7) . . ?
O22 C150 C151 116.6(7) . . ?
C149 C150 C151 120.2(7) . . ?
C143 C141 C140 121.9(8) . . ?
C143 C141 H141 119.1 . . ?
C140 C141 H141 119.1 . . ?
F25 C158 F27 103.3(9) . . ?
F26A C158 F27A 106.4(11) . . ?
F26A C158 F25A 114.2(12) . . ?
F27A C158 F25A 99.9(11) . . ?
F25 C158 F26 103.9(9) . . ?
F27 C158 F26 106.5(9) . . ?
F25 C158 C159 116.7(9) . . ?
F26A C158 C159 117.2(10) . . ?
F27 C158 C159 110.9(8) . . ?
F27A C158 C159 110.5(9) . . ?
F25A C158 C159 107.3(9) . . ?
F26 C158 C159 114.5(8) . . ?
C76 C74 C75 117.0(8) . . ?
C76 C74 C73 120.7(8) . . ?
C75 C74 C73 122.3(8) . . ?
C118 C117 C115 122.3(9) . . ?
C118 C117 H117 118.9 . . ?
C115 C117 H117 118.9 . . ?
C59 C57 C58 119.2(9) . . ?
C59 C57 H57 120.4 . . ?
C58 C57 H57 120.4 . . ?
C111 C112 H11A 109.5 . . ?
C111 C112 H11B 109.5 . . ?
H11A C112 H11B 109.5 . . ?
C111 C112 H11C 109.5 . . ?
H11A C112 H11C 109.5 . . ?
H11B C112 H11C 109.5 . . ?
N8 C126 C125 122.3(8) . . ?
N8 C126 C127 113.8(7) . . ?
C125 C126 C127 123.8(7) . . ?
O11 C81 C82 129.7(8) . . ?
O11 C81 C80 112.8(7) . . ?
C82 C81 C80 117.4(8) . . ?
O23 C159 C160 129.8(7) . . ?
O23 C159 C158 114.0(7) . . ?
C160 C159 C158 116.2(7) . . ?
O13 C92 C93 130.8(7) . . ?
O13 C92 C91 114.1(6) . . ?
C93 C92 C91 115.2(6) . . ?
O10 C72 C73 105.7(7) . . ?
O10 C72 H72A 110.6 . . ?
C73 C72 H72A 110.6 . . ?
O10 C72 H72B 110.6 . . ?
C73 C72 H72B 110.6 . . ?
H72A C72 H72B 108.7 . . ?
C79 C78 C76 121.0(10) . . ?
C79 C78 H78 119.5 . . ?
C76 C78 H78 119.5 . . ?
O1 C8 C7 105.8(7) . . ?
O1 C8 H8A 110.6 . . ?
C7 C8 H8A 110.6 . . ?
O1 C8 H8B 110.6 . . ?
C7 C8 H8B 110.6 . . ?
H8A C8 H8B 108.7 . . ?
C12 C13 C14 118.6(8) . . ?
C12 C13 H13 120.7 . . ?
C14 C13 H13 120.7 . . ?
C81 C82 C83 120.8(8) . . ?
C81 C82 H82 119.6 . . ?
C83 C82 H82 119.6 . . ?
C137 C138 C139 121.6(7) . . ?
C137 C138 H138 119.2 . . ?
C139 C138 H138 119.2 . . ?
N1 C9 O1 119.9(8) . . ?
N1 C9 C10 123.9(7) . . ?
O1 C9 C10 116.2(7) . . ?
C66 C67 C68 118.7(8) . . ?
C66 C67 H67 120.6 . . ?
C68 C67 H67 120.6 . . ?
N9 C127 O18 117.9(7) . . ?
N9 C127 C126 124.5(6) . . ?
O18 C127 C126 117.6(7) . . ?
C154 C152 C151 120.1(8) . . ?
C154 C152 H152 120.0 . . ?
C151 C152 H152 120.0 . . ?
O18 C128 C129 105.2(6) . . ?
O18 C128 H12A 110.7 . . ?
C129 C128 H12A 110.7 . . ?
O18 C128 H12B 110.7 . . ?
C129 C128 H12B 110.7 . . ?
H12A C128 H12B 108.8 . . ?
O24 C161 C160 122.8(7) . . ?
O24 C161 C162 117.6(6) . . ?
C160 C161 C162 119.6(7) . . ?
C113 C115 C117 118.2(12) . . ?
C113 C115 H115 120.9 . . ?
C117 C115 H115 120.9 . . ?
F4 C35 F6 109.5(8) . . ?
F4 C35 F5 108.6(7) . . ?
F6 C35 F5 105.6(8) . . ?
F4 C35 C36 110.6(8) . . ?
F6 C35 C36 111.3(6) . . ?
F5 C35 C36 111.0(7) . . ?
C2 C4 C6 119.1(12) . . ?
C2 C4 H4 120.4 . . ?
C6 C4 H4 120.4 . . ?
F22A C147 F24A 105.2(12) . . ?
F22A C147 F23A 117.1(12) . . ?
F24A C147 F23A 102.6(13) . . ?
F23 C147 F22 111.8(10) . . ?
F23 C147 F24 110.9(10) . . ?
F22 C147 F24 99.8(9) . . ?
F23 C147 C148 114.7(9) . . ?
F22A C147 C148 106.1(11) . . ?
F24A C147 C148 112.2(10) . . ?
F23A C147 C148 113.6(10) . . ?
F22 C147 C148 110.9(9) . . ?
F24 C147 C148 107.7(8) . . ?
C165 C167 C166 118.3(8) . . ?
C165 C167 C168 121.1(9) . . ?
C166 C167 C168 120.6(8) . . ?
N8 C122 C123 122.8(8) . . ?
N8 C122 C121 114.4(7) . . ?
C123 C122 C121 122.8(8) . . ?
C98 C100 C99 117.0(7) . . ?
C98 C100 C101 119.8(8) . . ?
C99 C100 C101 123.0(8) . . ?
C100 C101 H10A 109.5 . . ?
C100 C101 H10B 109.5 . . ?
H10A C101 H10B 109.5 . . ?
C100 C101 H10C 109.5 . . ?
H10A C101 H10C 109.5 . . ?
H10B C101 H10C 109.5 . . ?
C167 C165 C163 121.1(8) . . ?
C167 C165 H165 119.5 . . ?
C163 C165 H165 119.5 . . ?
O20 C139 C138 123.2(7) . . ?
O20 C139 C140 115.4(7) . . ?
C138 C139 C140 121.4(7) . . ?
O2 C16 C17 104.9(6) . . ?
O2 C16 H16A 110.8 . . ?
C17 C16 H16A 110.8 . . ?
O2 C16 H16B 110.8 . . ?
C17 C16 H16B 110.8 . . ?
H16A C16 H16B 108.8 . . ?
O12 C83 C82 121.8(7) . . ?
O12 C83 C84 118.3(7) . . ?
C82 C83 C84 119.9(8) . . ?
C1 C2 C4 121.6(13) . . ?
C1 C2 H2 119.2 . . ?
C4 C2 H2 119.2 . . ?
C97 C99 C100 122.3(9) . . ?
C97 C99 H99 118.8 . . ?
C100 C99 H99 118.8 . . ?
C130 C131 C133 120.0(10) . . ?
C130 C131 H131 120.0 . . ?
C133 C131 H131 120.0 . . ?
C98 C96 C95 119.5(8) . . ?
C98 C96 H96 120.2 . . ?
C95 C96 H96 120.2 . . ?
C106 C108 C110 119.9(7) . . ?
C106 C108 H108 120.1 . . ?
C110 C108 H108 120.1 . . ?
N5 C66 C67 122.7(8) . . ?
N5 C66 C65 111.9(6) . . ?
C67 C66 C65 125.4(7) . . ?
C42 C40 C39 119.7(8) . . ?
C42 C40 H40 120.1 . . ?
C39 C40 H40 120.1 . . ?
O21 C148 C149 128.0(8) . . ?
O21 C148 C147 113.0(7) . . ?
C149 C148 C147 118.9(7) . . ?
C141 C143 C145 121.5(9) . . ?
C141 C143 H143 119.3 . . ?
C145 C143 H143 119.3 . . ?
C167 C168 H16C 109.5 . . ?
C167 C168 H16D 109.5 . . ?
H16C C168 H16D 109.5 . . ?
C167 C168 H16E 109.5 . . ?
H16C C168 H16E 109.5 . . ?
H16D C168 H16E 109.5 . . ?
C74 C76 C78 120.3(8) . . ?
C74 C76 H76 119.8 . . ?
C78 C76 H76 119.8 . . ?
C44 C43 C41 121.1(8) . . ?
C44 C43 H43 119.5 . . ?
C41 C43 H43 119.5 . . ?
C61 C62 C60 119.3(8) . . ?
C61 C62 C63 122.1(8) . . ?
C60 C62 C63 118.4(8) . . ?
C1 C3 C5 119.8(11) . . ?
C1 C3 H3 120.1 . . ?
C5 C3 H3 120.1 . . ?
O17 C120 C119 105.7(6) . . ?
O17 C120 H12C 110.6 . . ?
C119 C120 H12C 110.6 . . ?
O17 C120 H12D 110.6 . . ?
C119 C120 H12D 110.6 . . ?
H12C C120 H12D 108.7 . . ?
C145 C144 C142 122.0(8) . . ?
C145 C144 H144 119.0 . . ?
C142 C144 H144 119.0 . . ?
C140 C142 C144 121.6(9) . . ?
C140 C142 H142 119.2 . . ?
C144 C142 H142 119.2 . . ?
C11 C12 C13 118.7(8) . . ?
C11 C12 H12 120.7 . . ?
C13 C12 H12 120.7 . . ?
C69 C68 C67 119.7(8) . . ?
C69 C68 H68 120.2 . . ?
C67 C68 H68 120.2 . . ?
O4 C27 C26 123.7(7) . . ?
O4 C27 C28 116.2(6) . . ?
C26 C27 C28 120.1(7) . . ?
C148 C149 C150 124.8(7) . . ?
C148 C149 H149 117.6 . . ?
C150 C149 H149 117.6 . . ?
C28 C30 C32 118.3(10) . . ?
C28 C30 H30 120.9 . . ?
C32 C30 H30 120.9 . . ?
C51 C53 C55 123.4(7) . . ?
C51 C53 H53 118.3 . . ?
C55 C53 H53 118.3 . . ?
C89 C88 C86 121.9(9) . . ?
C89 C88 H88 119.1 . . ?
C86 C88 H88 119.1 . . ?
C107 C109 C111 120.9(8) . . ?
C107 C109 H109 119.5 . . ?
C111 C109 H109 119.5 . . ?
C25 C26 C27 119.5(7) . . ?
C25 C26 H26 120.3 . . ?
C27 C26 H26 120.3 . . ?
F15 C91 F13 107.7(8) . . ?
F15 C91 F14 104.8(8) . . ?
F13 C91 F14 104.5(8) . . ?
F15 C91 C92 114.2(7) . . ?
F13 C91 C92 113.8(7) . . ?
F14 C91 C92 111.0(7) . . ?
N7 C121 O17 119.6(8) . . ?
N7 C121 C122 123.6(7) . . ?
O17 C121 C122 116.7(8) . . ?
O19 C137 C138 128.7(8) . . ?
O19 C137 C136 113.9(8) . . ?
C138 C137 C136 117.4(7) . . ?
C118 C116 C114 118.1(12) . . ?
C118 C116 H116 120.9 . . ?
C114 C116 H116 120.9 . . ?
C111 C110 C108 121.9(7) . . ?
C111 C110 H110 119.1 . . ?
C108 C110 H110 119.1 . . ?
C53 C55 C54 115.9(7) . . ?
C53 C55 C56 123.4(8) . . ?
C54 C55 C56 120.7(8) . . ?
C87 C89 C88 117.2(8) . . ?
C87 C89 C90 121.2(9) . . ?
C88 C89 C90 121.6(9) . . ?
C2 C1 C3 120.1(11) . . ?
C2 C1 H1 119.9 . . ?
C3 C1 H1 119.9 . . ?
C155 C156 C154 119.3(9) . . ?
C155 C156 C157 121.7(10) . . ?
C154 C156 C157 119.0(9) . . ?
C135 C134 C132 120.0(10) . . ?
C135 C134 H134 120.0 . . ?
C132 C134 H134 120.0 . . ?
C55 C56 H56A 109.5 . . ?
C55 C56 H56B 109.5 . . ?
H56A C56 H56B 109.5 . . ?
C55 C56 H56C 109.5 . . ?
H56A C56 H56C 109.5 . . ?
H56B C56 H56C 109.5 . . ?
C88 C86 C84 120.3(9) . . ?
C88 C86 H86 119.9 . . ?
C84 C86 H86 119.9 . . ?
C152 C154 C156 120.0(9) . . ?
C152 C154 H154 120.0 . . ?
C156 C154 H154 120.0 . . ?
F10 C80 F11 125.2(14) . . ?
F12A C80 F10A 143.5(15) . . ?
F10 C80 F12 82.3(11) . . ?
F11 C80 F12 104.7(12) . . ?
F12A C80 F11A 88.5(12) . . ?
F10A C80 F11A 69.3(12) . . ?
F10 C80 C81 116.6(11) . . ?
F11 C80 C81 114.3(11) . . ?
F12A C80 C81 110.3(12) . . ?
F10A C80 C81 103.0(12) . . ?
F12 C80 C81 103.3(10) . . ?
F11A C80 C81 103.5(12) . . ?
C62 C60 C58 119.4(9) . . ?
C62 C60 H60 120.3 . . ?
C58 C60 H60 120.3 . . ?
C156 C155 C153 121.7(9) . . ?
C156 C155 H155 119.2 . . ?
C153 C155 H155 119.2 . . ?
C77 C75 C74 123.4(10) . . ?
C77 C75 H75 118.3 . . ?
C74 C75 H75 118.3 . . ?
C33 C32 C30 122.5(11) . . ?
C33 C32 H32 118.8 . . ?
C30 C32 H32 118.8 . . ?
C110 C111 C109 116.7(7) . . ?
C110 C111 C112 121.9(8) . . ?
C109 C111 C112 121.3(8) . . ?
C100 C98 C96 122.4(8) . . ?
C100 C98 H98 118.8 . . ?
C96 C98 H98 118.8 . . ?
C32 C33 C31 119.3(10) . . ?
C32 C33 C34 120.2(12) . . ?
C31 C33 C34 120.5(12) . . ?
C144 C145 C143 116.6(8) . . ?
C144 C145 C146 123.0(9) . . ?
C143 C145 C146 120.4(10) . . ?
C89 C87 C85 123.9(9) . . ?
C89 C87 H87 118.0 . . ?
C85 C87 H87 118.0 . . ?
F8 C46 F9 111.5(11) . . ?
F8 C46 F7 106.4(10) . . ?
F9 C46 F7 101.9(10) . . ?
F8 C46 C47 115.9(9) . . ?
F9 C46 C47 112.0(9) . . ?
F7 C46 C47 108.0(9) . . ?
O7 C47 C48 129.2(7) . . ?
O7 C47 C46 113.1(8) . . ?
C48 C47 C46 117.7(7) . . ?
C145 C146 H14A 109.5 . . ?
C145 C146 H14B 109.5 . . ?
H14A C146 H14B 109.5 . . ?
C145 C146 H14C 109.5 . . ?
H14A C146 H14C 109.5 . . ?
H14B C146 H14C 109.5 . . ?
C134 C135 C133 120.4(11) . . ?
C134 C135 H135 119.8 . . ?
C133 C135 H135 119.8 . . ?
C156 C157 H15A 109.5 . . ?
C156 C157 H15B 109.5 . . ?
H15A C157 H15B 109.5 . . ?
C156 C157 H15C 109.5 . . ?
H15A C157 H15C 109.5 . . ?
H15B C157 H15C 109.5 . . ?
C77 C79 C78 120.3(11) . . ?
C77 C79 H79 119.8 . . ?
C78 C79 H79 119.8 . . ?
C113 C114 C116 120.1(11) . . ?
C113 C114 H114 119.9 . . ?
C116 C114 H114 119.9 . . ?
C89 C90 H90A 109.5 . . ?
C89 C90 H90B 109.5 . . ?
H90A C90 H90B 109.5 . . ?
C89 C90 H90C 109.5 . . ?
H90A C90 H90C 109.5 . . ?
H90B C90 H90C 109.5 . . ?
C115 C113 C114 121.4(12) . . ?
C115 C113 H113 119.3 . . ?
C114 C113 H113 119.3 . . ?
C43 C44 C42 117.9(9) . . ?
C43 C44 C45 120.9(9) . . ?
C42 C44 C45 121.2(9) . . ?
C44 C45 H45A 109.5 . . ?
C44 C45 H45B 109.5 . . ?
H45A C45 H45B 109.5 . . ?
C44 C45 H45C 109.5 . . ?
H45A C45 H45C 109.5 . . ?
H45B C45 H45C 109.5 . . ?
C79 C77 C75 117.7(11) . . ?
C79 C77 H77 121.1 . . ?
C75 C77 H77 121.1 . . ?
C40 C42 C44 122.4(9) . . ?
C40 C42 H42 118.8 . . ?
C44 C42 H42 118.8 . . ?
C33 C34 H34A 109.5 . . ?
C33 C34 H34B 109.5 . . ?
H34A C34 H34B 109.5 . . ?
C33 C34 H34C 109.5 . . ?
H34A C34 H34C 109.5 . . ?
H34B C34 H34C 109.5 . . ?
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
C18 C19 1.3900 . ?
C18 C20 1.3900 . ?
C18 C17 1.505(9) . ?
C19 C23 1.3900 . ?
C19 H19 0.9300 . ?
C23 C21 1.3900 . ?
C23 H23 0.9300 . ?
C21 C22 1.3900 . ?
C21 H21 0.9300 . ?
C22 C20 1.3900 . ?
C22 H22 0.9300 . ?
C20 H20 0.9300 . ?
F22 C147 1.347(12) . ?
F23 C147 1.298(12) . ?
F24 C147 1.369(13) . ?
F10 C80 1.173(12) . ?
F10 F12 1.717(18) . ?
F11 C80 1.299(13) . ?
F12 C80 1.421(14) . ?
F25 C158 1.297(11) . ?
F26 C158 1.385(12) . ?
F27 C158 1.342(11) . ?
F23A C147 1.333(14) . ?
F24A C147 1.312(15) . ?
F22A C147 1.301(14) . ?
F11A C80 1.441(15) . ?
F11A F10A 1.61(2) . ?
F12A C80 1.320(16) . ?
F10A C80 1.391(15) . ?
F25A C158 1.374(14) . ?
F26A C158 1.300(14) . ?
F27A C158 1.346(13) . ?
Eu1 O4 2.366(5) . ?
Eu1 O8 2.366(5) . ?
Eu1 O7 2.371(4) . ?
Eu1 O5 2.402(5) . ?
Eu1 O3 2.404(5) . ?
Eu1 O6 2.439(5) . ?
Eu1 N1 2.641(6) . ?
Eu1 N3 2.653(6) . ?
Eu1 N2 2.687(6) . ?
Eu2 O14 2.370(4) . ?
Eu2 O16 2.385(5) . ?
Eu2 O12 2.390(5) . ?
Eu2 O15 2.413(4) . ?
Eu2 O11 2.418(5) . ?
Eu2 O13 2.434(5) . ?
Eu2 N4 2.564(6) . ?
Eu2 N5 2.638(6) . ?
Eu2 N6 2.650(6) . ?
Eu3 O23 2.374(5) . ?
Eu3 O20 2.381(5) . ?
Eu3 O19 2.398(5) . ?
Eu3 O24 2.404(5) . ?
Eu3 O21 2.415(5) . ?
Eu3 O22 2.430(5) . ?
Eu3 N7 2.629(6) . ?
Eu3 N9 2.642(6) . ?
Eu3 N8 2.679(6) . ?
F1 C24 1.325(9) . ?
F2 C24 1.330(9) . ?
F3 C24 1.320(9) . ?
F4 C35 1.286(11) . ?
F5 C35 1.350(10) . ?
F6 C35 1.325(9) . ?
F7 C46 1.372(14) . ?
F8 C46 1.278(11) . ?
F9 C46 1.286(13) . ?
F13 C91 1.301(10) . ?
F14 C91 1.324(11) . ?
F15 C91 1.290(9) . ?
F16 C102 1.321(10) . ?
F17 C102 1.330(10) . ?
F18 C102 1.281(10) . ?
F19 C136 1.304(12) . ?
F20 C136 1.297(10) . ?
F21 C136 1.319(11) . ?
N1 C9 1.269(9) . ?
N1 C7 1.482(10) . ?
N5 C70 1.342(9) . ?
N5 C66 1.356(8) . ?
C50 C52 1.372(10) . ?
C50 C51 1.400(10) . ?
C50 C49 1.504(10) . ?
C39 C40 1.371(11) . ?
C39 C41 1.392(10) . ?
C39 C38 1.507(10) . ?
N3 C15 1.273(9) . ?
N3 C17 1.491(9) . ?
N9 C127 1.270(9) . ?
N9 C129 1.467(9) . ?
C164 C166 1.388(12) . ?
C164 C162 1.400(10) . ?
C164 H164 0.9300 . ?
N4 C65 1.261(9) . ?
N4 C63 1.480(10) . ?
O19 C137 1.256(9) . ?
O6 C38 1.250(8) . ?
O7 C47 1.246(9) . ?
O9 C65 1.349(8) . ?
O9 C64 1.438(12) . ?
O4 C27 1.239(9) . ?
O3 C25 1.248(8) . ?
O8 C49 1.248(8) . ?
O11 C81 1.224(9) . ?
O2 C15 1.356(9) . ?
O2 C16 1.442(9) . ?
O24 C161 1.256(8) . ?
O15 C103 1.268(9) . ?
O22 C150 1.256(8) . ?
O14 C94 1.263(8) . ?
O5 C36 1.261(9) . ?
O13 C92 1.251(8) . ?
O20 C139 1.265(8) . ?
O10 C71 1.349(9) . ?
O10 C72 1.446(10) . ?
O12 C83 1.252(9) . ?
O16 C105 1.261(8) . ?
O18 C127 1.359(8) . ?
O18 C128 1.428(10) . ?
O21 C148 1.270(8) . ?
O1 C9 1.351(9) . ?
O1 C8 1.435(11) . ?
O23 C159 1.252(9) . ?
O17 C121 1.350(9) . ?
O17 C120 1.451(11) . ?
N7 C121 1.288(10) . ?
N7 C119 1.474(9) . ?
C95 C96 1.386(10) . ?
C95 C97 1.390(11) . ?
C95 C94 1.503(9) . ?
N2 C10 1.341(9) . ?
N2 C14 1.337(9) . ?
N6 C71 1.266(10) . ?
N6 C73 1.511(9) . ?
C93 C92 1.387(10) . ?
C93 C94 1.419(10) . ?
C93 H93 0.9300 . ?
C162 C163 1.390(10) . ?
C162 C161 1.488(10) . ?
C102 C103 1.517(10) . ?
C38 C37 1.421(10) . ?
C106 C107 1.356(10) . ?
C106 C108 1.386(10) . ?
C106 C105 1.498(10) . ?
C163 C165 1.392(11) . ?
C163 H163 0.9300 . ?
C118 C117 1.362(12) . ?
C118 C116 1.377(12) . ?
C118 C119 1.537(12) . ?
C151 C153 1.380(10) . ?
C151 C152 1.387(11) . ?
C151 C150 1.490(10) . ?
C107 C109 1.363(11) . ?
C107 H107 0.9300 . ?
C28 C29 1.378(11) . ?
C28 C30 1.389(12) . ?
C28 C27 1.514(9) . ?
C51 C53 1.355(11) . ?
C51 H51 0.9300 . ?
C119 C120 1.538(12) . ?
C119 H119 0.9800 . ?
C123 C124 1.388(13) . ?
C123 C122 1.388(11) . ?
C123 H123 0.9300 . ?
C140 C141 1.377(11) . ?
C140 C142 1.389(11) . ?
C140 C139 1.501(11) . ?
N8 C122 1.325(9) . ?
N8 C126 1.338(9) . ?
C61 C62 1.376(12) . ?
C61 C59 1.380(11) . ?
C61 H61 0.9300 . ?
C69 C68 1.359(12) . ?
C69 C70 1.397(10) . ?
C69 H69 0.9300 . ?
C129 C130 1.511(11) . ?
C129 C128 1.528(11) . ?
C129 H129 0.9800 . ?
C166 C167 1.389(12) . ?
C166 H166 0.9300 . ?
C41 C43 1.367(11) . ?
C41 H41 0.9300 . ?
C49 C48 1.422(10) . ?
C17 C16 1.546(12) . ?
C17 H17 0.9800 . ?
C103 C104 1.375(10) . ?
C15 C14 1.462(11) . ?
C70 C71 1.467(10) . ?
C65 C66 1.480(11) . ?
C52 C54 1.394(11) . ?
C52 H52 0.9300 . ?
C97 C99 1.363(11) . ?
C97 H97 0.9300 . ?
C29 C31 1.385(11) . ?
C29 H29 0.9300 . ?
C130 C132 1.380(11) . ?
C130 C131 1.384(12) . ?
C14 C13 1.379(10) . ?
C125 C124 1.354(12) . ?
C125 C126 1.399(11) . ?
C125 H125 0.9300 . ?
C10 C11 1.370(11) . ?
C10 C9 1.476(11) . ?
C7 C6 1.504(12) . ?
C7 C8 1.549(11) . ?
C7 H7 0.9800 . ?
C73 C74 1.510(11) . ?
C73 C72 1.530(13) . ?
C73 H73 0.9800 . ?
C58 C57 1.361(14) . ?
C58 C60 1.396(12) . ?
C58 H58 0.9300 . ?
C84 C86 1.392(11) . ?
C84 C85 1.401(11) . ?
C84 C83 1.496(10) . ?
C124 H124 0.9300 . ?
C31 C33 1.377(15) . ?
C31 H31 0.9300 . ?
C64 C63 1.554(11) . ?
C64 H64A 0.9700 . ?
C64 H64B 0.9700 . ?
C132 C134 1.377(13) . ?
C132 H132 0.9300 . ?
C136 C137 1.524(12) . ?
C36 C37 1.377(10) . ?
C36 C35 1.567(11) . ?
C63 C62 1.502(10) . ?
C63 H63 0.9800 . ?
C6 C5 1.389(12) . ?
C6 C4 1.399(13) . ?
C11 C12 1.369(12) . ?
C11 H11 0.9300 . ?
C59 C57 1.356(13) . ?
C59 H59 0.9300 . ?
C25 C26 1.381(10) . ?
C25 C24 1.535(11) . ?
C37 H37 0.9300 . ?
C5 C3 1.375(12) . ?
C5 H5 0.9300 . ?
C85 C87 1.371(10) . ?
C85 H85 0.9300 . ?
C160 C159 1.378(11) . ?
C160 C161 1.419(9) . ?
C160 H160 0.9300 . ?
C54 C55 1.392(11) . ?
C54 H54 0.9300 . ?
C104 C105 1.423(10) . ?
C104 H104 0.9300 . ?
C133 C135 1.371(15) . ?
C133 C131 1.406(14) . ?
C133 H133 0.9300 . ?
C153 C155 1.404(12) . ?
C153 H153 0.9300 . ?
C48 C47 1.381(11) . ?
C48 H48 0.9300 . ?
C150 C149 1.413(11) . ?
C141 C143 1.369(12) . ?
C141 H141 0.9300 . ?
C158 C159 1.513(12) . ?
C74 C76 1.366(11) . ?
C74 C75 1.382(11) . ?
C117 C115 1.376(13) . ?
C117 H117 0.9300 . ?
C57 H57 0.9300 . ?
C112 C111 1.520(11) . ?
C112 H11A 0.9600 . ?
C112 H11B 0.9600 . ?
C112 H11C 0.9600 . ?
C126 C127 1.451(10) . ?
C81 C82 1.376(11) . ?
C81 C80 1.625(16) . ?
C92 C91 1.541(11) . ?
C72 H72A 0.9700 . ?
C72 H72B 0.9700 . ?
C78 C79 1.358(14) . ?
C78 C76 1.376(13) . ?
C78 H78 0.9300 . ?
C8 H8A 0.9700 . ?
C8 H8B 0.9700 . ?
C13 C12 1.380(11) . ?
C13 H13 0.9300 . ?
C82 C83 1.425(11) . ?
C82 H82 0.9300 . ?
C138 C137 1.365(11) . ?
C138 C139 1.425(11) . ?
C138 H138 0.9300 . ?
C67 C66 1.377(11) . ?
C67 C68 1.396(13) . ?
C67 H67 0.9300 . ?
C152 C154 1.384(11) . ?
C152 H152 0.9300 . ?
C128 H12A 0.9700 . ?
C128 H12B 0.9700 . ?
C115 C113 1.352(15) . ?
C115 H115 0.9300 . ?
C4 C2 1.382(16) . ?
C4 H4 0.9300 . ?
C147 C148 1.561(13) . ?
C167 C165 1.359(11) . ?
C167 C168 1.532(12) . ?
C122 C121 1.466(11) . ?
C100 C98 1.373(12) . ?
C100 C99 1.381(11) . ?
C100 C101 1.519(10) . ?
C101 H10A 0.9600 . ?
C101 H10B 0.9600 . ?
C101 H10C 0.9600 . ?
C165 H165 0.9300 . ?
C16 H16A 0.9700 . ?
C16 H16B 0.9700 . ?
C2 C1 1.346(17) . ?
C2 H2 0.9300 . ?
C99 H99 0.9300 . ?
C131 H131 0.9300 . ?
C96 C98 1.375(11) . ?
C96 H96 0.9300 . ?
C108 C110 1.387(10) . ?
C108 H108 0.9300 . ?
C40 C42 1.371(12) . ?
C40 H40 0.9300 . ?
C148 C149 1.365(10) . ?
C143 C145 1.410(12) . ?
C143 H143 0.9300 . ?
C168 H16C 0.9600 . ?
C168 H16D 0.9600 . ?
C168 H16E 0.9600 . ?
C76 H76 0.9300 . ?
C43 C44 1.347(12) . ?
C43 H43 0.9300 . ?
C62 C60 1.374(12) . ?
C3 C1 1.375(17) . ?
C3 H3 0.9300 . ?
C120 H12C 0.9700 . ?
C120 H12D 0.9700 . ?
C144 C145 1.351(13) . ?
C144 C142 1.387(12) . ?
C144 H144 0.9300 . ?
C142 H142 0.9300 . ?
C12 H12 0.9300 . ?
C68 H68 0.9300 . ?
C27 C26 1.420(10) . ?
C149 H149 0.9300 . ?
C30 C32 1.401(12) . ?
C30 H30 0.9300 . ?
C53 C55 1.392(11) . ?
C53 H53 0.9300 . ?
C88 C89 1.369(12) . ?
C88 C86 1.372(11) . ?
C88 H88 0.9300 . ?
C109 C111 1.404(11) . ?
C109 H109 0.9300 . ?
C26 H26 0.9300 . ?
C116 C114 1.402(17) . ?
C116 H116 0.9300 . ?
C110 C111 1.378(11) . ?
C110 H110 0.9300 . ?
C55 C56 1.476(11) . ?
C89 C87 1.354(12) . ?
C89 C90 1.504(10) . ?
C1 H1 0.9300 . ?
C156 C155 1.315(14) . ?
C156 C154 1.415(13) . ?
C156 C157 1.533(12) . ?
C134 C135 1.352(14) . ?
C134 H134 0.9300 . ?
C56 H56A 0.9600 . ?
C56 H56B 0.9600 . ?
C56 H56C 0.9600 . ?
C86 H86 0.9300 . ?
C154 H154 0.9300 . ?
C60 H60 0.9300 . ?
C155 H155 0.9300 . ?
C75 C77 1.370(14) . ?
C75 H75 0.9300 . ?
C32 C33 1.357(16) . ?
C32 H32 0.9300 . ?
C98 H98 0.9300 . ?
C33 C34 1.548(14) . ?
C145 C146 1.484(13) . ?
C87 H87 0.9300 . ?
C46 C47 1.538(12) . ?
C146 H14A 0.9600 . ?
C146 H14B 0.9600 . ?
C146 H14C 0.9600 . ?
C135 H135 0.9300 . ?
C157 H15A 0.9600 . ?
C157 H15B 0.9600 . ?
C157 H15C 0.9600 . ?
C79 C77 1.365(15) . ?
C79 H79 0.9300 . ?
C114 C113 1.374(18) . ?
C114 H114 0.9300 . ?
C90 H90A 0.9600 . ?
C90 H90B 0.9600 . ?
C90 H90C 0.9600 . ?
C113 H113 0.9300 . ?
C44 C42 1.376(13) . ?
C44 C45 1.529(13) . ?
C45 H45A 0.9600 . ?
C45 H45B 0.9600 . ?
C45 H45C 0.9600 . ?
C77 H77 0.9300 . ?
C42 H42 0.9300 . ?
C34 H34A 0.9600 . ?
C34 H34B 0.9600 . ?
C34 H34C 0.9600 . ?
