#------------------------------------------------------------------------------
#$Date: 2016-03-23 03:17:18 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179239 $
#$URL: svn://www.crystallography.net/cod/cif/4/31/59/4315912.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_4315912
loop_
_publ_author_name
'Ching-Hui Huang'
'Jacob Hammell'
'S. James Ratnakar'
'A. Dean Sherry'
'Janet R. Morrow'
_publ_section_title
;
 Activation of a PARACEST Agent for MRI through Selective Outersphere
 Interactions with Phosphate Diesters
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              5963
_journal_page_last               5970
_journal_paper_doi               10.1021/ic1004616
_journal_volume                  49
_journal_year                    2010
_chemical_absolute_configuration ad
_chemical_formula_moiety
'C20 H46 Eu N4 O5, 2(C12 H8 N2 O8 P), C F3 O3 S, C3 H8 O, 2(H2 O)'
_chemical_formula_sum            'C48 H74 Eu F3 N8 O27 P2 S'
_chemical_formula_weight         1498.11
_chemical_name_common            ubjm01
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           4
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 112.122(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   25.491(5)
_cell_length_b                   9.8057(18)
_cell_length_c                   27.192(5)
_cell_measurement_reflns_used    3833
_cell_measurement_temperature    100.0(1)
_cell_measurement_theta_max      26.98
_cell_measurement_theta_min      2.23
_cell_volume                     6296(2)
_computing_cell_refinement       'SAINT (Bruker, 2009)'
_computing_data_collection       'APEX2 (Bruker, 2009)'
_computing_data_reduction        'SAINT (Bruker, 2009)'
_computing_molecular_graphics    'SHELXTL (Sheldrick, 2008)'
_computing_publication_material  'SHELXTL (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SIR97 (Altomare et al., 1999)'
_diffrn_ambient_temperature      100.0(1)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Bruker SMART APEX II CCD Platform'
_diffrn_measurement_method       'area detector, ω scans per φ'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0803
_diffrn_reflns_av_sigmaI/netI    0.0787
_diffrn_reflns_limit_h_max       35
_diffrn_reflns_limit_h_min       -35
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       37
_diffrn_reflns_limit_l_min       -37
_diffrn_reflns_number            136522
_diffrn_reflns_theta_full        29.57
_diffrn_reflns_theta_max         29.57
_diffrn_reflns_theta_min         1.39
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    1.178
_exptl_absorpt_correction_T_max  0.9327
_exptl_absorpt_correction_T_min  0.7339
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS (Sheldrick, 2008)'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.580
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             3080
_exptl_crystal_size_max          0.28
_exptl_crystal_size_mid          0.12
_exptl_crystal_size_min          0.06
_refine_diff_density_max         1.931
_refine_diff_density_min         -3.732
_refine_diff_density_rms         0.135
_refine_ls_abs_structure_details
'Flack H D (1983), 16689 Friedel pairs, Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.042(9)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.161
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1635
_refine_ls_number_reflns         35308
_refine_ls_number_restraints     93
_refine_ls_restrained_S_all      1.162
_refine_ls_R_factor_all          0.0932
_refine_ls_R_factor_gt           0.0763
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0144P)²+31.8870P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1382
_refine_ls_wR_factor_ref         0.1440
_reflns_number_gt                29118
_reflns_number_total             35308
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic1004616_si_001.cif
_cod_data_source_block           ubjm01
_cod_database_code               4315912
loop_
_symmetry_equiv_pos_as_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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Eu1 Eu 0.303448(15) 0.23846(3) 0.444458(13) 0.02432(8) Uani 1 1 d . . .
O1 O 0.3317(2) 0.4698(5) 0.4663(2) 0.0272(11) Uani 1 1 d . . .
H1A H 0.3080 0.5300 0.4656 0.033 Uiso 1 1 d R . .
O2 O 0.2286(2) 0.3518(5) 0.3729(2) 0.0347(13) Uani 1 1 d . . .
H2A H 0.2007 0.3669 0.3815 0.042 Uiso 1 1 d R . .
O3 O 0.2281(2) 0.0936(5) 0.4423(2) 0.0338(12) Uani 1 1 d . . .
H3A H 0.2127 0.0878 0.4647 0.041 Uiso 1 1 d R . .
O4 O 0.3369(2) 0.2228(5) 0.54032(17) 0.0285(11) Uani 1 1 d . . .
H4A H 0.3244 0.2851 0.5541 0.034 Uiso 1 1 d R . .
O9 O 0.2388(2) 0.3443(6) 0.4809(2) 0.0334(13) Uani 1 1 d . . .
H9A H 0.2089 0.3845 0.4619 0.040 Uiso 1 1 d R . .
H9B H 0.2502 0.3931 0.5083 0.040 Uiso 1 1 d R . .
N1 N 0.4115(3) 0.3032(6) 0.4581(2) 0.0257(13) Uani 1 1 d . . .
N2 N 0.3193(3) 0.2825(7) 0.3539(2) 0.0338(16) Uani 1 1 d . . .
N3 N 0.2840(3) 0.0188(8) 0.3820(2) 0.0368(15) Uani 1 1 d . . .
N4 N 0.3755(3) 0.0437(7) 0.4895(2) 0.0265(14) Uani 1 1 d . . .
C1 C 0.4161(4) 0.3623(8) 0.4101(3) 0.0310(17) Uani 1 1 d . . .
H1B H 0.4562 0.3602 0.4136 0.037 Uiso 1 1 calc R . .
H1C H 0.4038 0.4587 0.4066 0.037 Uiso 1 1 calc R . .
C2 C 0.3807(4) 0.2855(8) 0.3614(3) 0.0342(18) Uani 1 1 d . . .
H2B H 0.3950 0.1908 0.3639 0.041 Uiso 1 1 calc R . .
H2C H 0.3845 0.3285 0.3299 0.041 Uiso 1 1 calc R . .
C3 C 0.2903(5) 0.1767(9) 0.3138(3) 0.046(2) Uani 1 1 d . . .
H3B H 0.3027 0.1841 0.2835 0.055 Uiso 1 1 calc R . .
H3C H 0.2489 0.1922 0.3002 0.055 Uiso 1 1 calc R . .
C4 C 0.3032(4) 0.0370(8) 0.3372(3) 0.0382(19) Uani 1 1 d . . .
H4B H 0.2843 -0.0314 0.3093 0.046 Uiso 1 1 calc R . .
H4C H 0.3445 0.0209 0.3499 0.046 Uiso 1 1 calc R . .
C5 C 0.3122(4) -0.1013(9) 0.4144(3) 0.039(2) Uani 1 1 d . . .
H5B H 0.3129 -0.1771 0.3906 0.047 Uiso 1 1 calc R . .
H5C H 0.2902 -0.1318 0.4357 0.047 Uiso 1 1 calc R . .
C6 C 0.3725(3) -0.0673(7) 0.4513(3) 0.0293(16) Uani 1 1 d . . .
H6B H 0.3904 -0.1502 0.4714 0.035 Uiso 1 1 calc R . .
H6C H 0.3945 -0.0398 0.4297 0.035 Uiso 1 1 calc R . .
C7 C 0.4350(3) 0.0934(7) 0.5131(3) 0.0262(16) Uani 1 1 d . . .
H7B H 0.4609 0.0140 0.5229 0.031 Uiso 1 1 calc R . .
H7C H 0.4403 0.1449 0.5459 0.031 Uiso 1 1 calc R . .
C8 C 0.4503(4) 0.1831(7) 0.4759(3) 0.0308(17) Uani 1 1 d . . .
H8B H 0.4897 0.2157 0.4939 0.037 Uiso 1 1 calc R . .
H8C H 0.4485 0.1292 0.4445 0.037 Uiso 1 1 calc R . .
C9 C 0.4286(3) 0.4049(8) 0.5018(3) 0.0253(16) Uani 1 1 d . . .
H9C H 0.4669 0.4393 0.5074 0.030 Uiso 1 1 calc R . .
H9D H 0.4305 0.3598 0.5350 0.030 Uiso 1 1 calc R . .
C10 C 0.3874(3) 0.5253(8) 0.4900(3) 0.0265(14) Uani 1 1 d . . .
H10C H 0.3945 0.5875 0.4640 0.032 Uiso 1 1 calc R . .
C11 C 0.3962(3) 0.6026(8) 0.5400(3) 0.0291(17) Uani 1 1 d . . .
H11A H 0.3694 0.6788 0.5320 0.044 Uiso 1 1 calc R . .
H11B H 0.4350 0.6377 0.5548 0.044 Uiso 1 1 calc R . .
H11C H 0.3898 0.5417 0.5658 0.044 Uiso 1 1 calc R . .
C12 C 0.2946(4) 0.4183(9) 0.3347(3) 0.037(2) Uani 1 1 d . . .
H12A H 0.2970 0.4367 0.2998 0.044 Uiso 1 1 calc R . .
H12B H 0.3169 0.4892 0.3598 0.044 Uiso 1 1 calc R . .
C13 C 0.2340(4) 0.4265(8) 0.3294(3) 0.040(2) Uani 1 1 d . . .
H13A H 0.2097 0.3824 0.2952 0.048 Uiso 1 1 calc R . .
C14 C 0.2148(5) 0.5713(9) 0.3296(4) 0.047(2) Uani 1 1 d . . .
H14A H 0.1749 0.5721 0.3256 0.070 Uiso 1 1 calc R . .
H14B H 0.2190 0.6215 0.3002 0.070 Uiso 1 1 calc R . .
H14C H 0.2378 0.6148 0.3633 0.070 Uiso 1 1 calc R . .
C15 C 0.2210(4) -0.0021(9) 0.3610(3) 0.045(2) Uani 1 1 d . . .
H15A H 0.2024 0.0741 0.3368 0.054 Uiso 1 1 calc R . .
H15B H 0.2117 -0.0875 0.3400 0.054 Uiso 1 1 calc R . .
C16 C 0.1976(3) -0.0099(9) 0.4038(4) 0.043(2) Uani 1 1 d . . .
H16A H 0.2048 -0.1022 0.4207 0.051 Uiso 1 1 calc R . .
C17 C 0.1349(4) 0.0198(12) 0.3812(4) 0.056(2) Uani 1 1 d . . .
H17A H 0.1200 0.0152 0.4096 0.084 Uiso 1 1 calc R . .
H17B H 0.1155 -0.0477 0.3538 0.084 Uiso 1 1 calc R . .
H17C H 0.1284 0.1112 0.3655 0.084 Uiso 1 1 calc R . .
C18 C 0.3574(3) -0.0095(7) 0.5325(3) 0.0266(16) Uani 1 1 d . . .
H18A H 0.3828 -0.0850 0.5513 0.032 Uiso 1 1 calc R . .
H18B H 0.3185 -0.0465 0.5162 0.032 Uiso 1 1 calc R . .
C19 C 0.3588(3) 0.1008(7) 0.5722(3) 0.0284(16) Uani 1 1 d . . .
H19A H 0.3987 0.1166 0.5972 0.034 Uiso 1 1 calc R . .
C20 C 0.3226(4) 0.0632(9) 0.6031(3) 0.037(2) Uani 1 1 d . . .
H20A H 0.3243 0.1363 0.6283 0.055 Uiso 1 1 calc R . .
H20B H 0.3366 -0.0218 0.6226 0.055 Uiso 1 1 calc R . .
H20C H 0.2833 0.0507 0.5786 0.055 Uiso 1 1 calc R . .
Eu2 Eu 0.298546(16) 0.51945(3) 0.954038(15) 0.02810(9) Uani 1 1 d . . .
O5 O 0.2728(2) 0.2985(5) 0.9140(2) 0.0346(13) Uani 1 1 d . . .
H5A H 0.2640 0.2336 0.9295 0.041 Uiso 1 1 d R . .
O6 O 0.3614(2) 0.3889(5) 1.0275(2) 0.0279(11) Uani 1 1 d . . .
H6A H 0.3470 0.3649 1.0492 0.033 Uiso 1 1 d R . .
O7 O 0.2866(2) 0.6419(5) 1.0244(2) 0.0324(12) Uani 1 1 d . . .
H7A H 0.2586 0.6499 1.0333 0.039 Uiso 1 1 d R . .
O8 O 0.1959(2) 0.5498(5) 0.9055(2) 0.0368(13) Uani 1 1 d . . .
H8A H 0.1774 0.4865 0.9123 0.044 Uiso 1 1 d R . .
O10 O 0.2422(2) 0.3965(6) 0.9958(2) 0.0302(12) Uani 1 1 d . . .
H10A H 0.2576 0.3460 1.0223 0.036 Uiso 1 1 d R . .
H10B H 0.2113 0.3575 0.9789 0.036 Uiso 1 1 d R . .
N5 N 0.3055(4) 0.4834(8) 0.8579(3) 0.047(2) Uani 1 1 d . . .
N6 N 0.4036(3) 0.4777(7) 0.9576(3) 0.0329(15) Uani 1 1 d . . .
N7 N 0.3668(3) 0.7268(7) 0.9936(3) 0.0295(13) Uani 1 1 d . . .
N8 N 0.2658(3) 0.7368(8) 0.8928(3) 0.0386(16) Uani 1 1 d . . .
C21 C 0.3603(4) 0.4230(8) 0.8632(4) 0.044(2) Uani 1 1 d . . .
H21A H 0.3655 0.4331 0.8291 0.053 Uiso 1 1 calc R . .
H21B H 0.3595 0.3243 0.8705 0.053 Uiso 1 1 calc R . .
C22 C 0.4097(4) 0.4864(8) 0.9064(4) 0.045(2) Uani 1 1 d . . .
H22A H 0.4449 0.4395 0.9087 0.054 Uiso 1 1 calc R . .
H22B H 0.4128 0.5834 0.8977 0.054 Uiso 1 1 calc R . .
C23 C 0.4439(3) 0.5748(8) 0.9949(4) 0.0353(19) Uani 1 1 d . . .
H23A H 0.4806 0.5705 0.9903 0.042 Uiso 1 1 calc R . .
H23B H 0.4505 0.5480 1.0318 0.042 Uiso 1 1 calc R . .
C24 C 0.4216(3) 0.7191(8) 0.9854(3) 0.0335(18) Uani 1 1 d . . .
H24A H 0.4495 0.7818 1.0103 0.040 Uiso 1 1 calc R . .
H24B H 0.4157 0.7472 0.9487 0.040 Uiso 1 1 calc R . .
C25 C 0.3375(3) 0.8574(7) 0.9687(3) 0.0335(18) Uani 1 1 d . . .
H25A H 0.3087 0.8807 0.9837 0.040 Uiso 1 1 calc R . .
H25B H 0.3655 0.9322 0.9776 0.040 Uiso 1 1 calc R . .
C26 C 0.3093(3) 0.8454(8) 0.9095(4) 0.0355(19) Uani 1 1 d . . .
H26A H 0.2913 0.9337 0.8949 0.043 Uiso 1 1 calc R . .
H26B H 0.3384 0.8261 0.8946 0.043 Uiso 1 1 calc R . .
C27 C 0.2532(4) 0.7035(9) 0.8368(3) 0.044(2) Uani 1 1 d . . .
H27A H 0.2499 0.7893 0.8166 0.053 Uiso 1 1 calc R . .
H27B H 0.2162 0.6563 0.8221 0.053 Uiso 1 1 calc R . .
C28 C 0.2979(4) 0.6140(9) 0.8288(3) 0.045(2) Uani 1 1 d . . .
H28A H 0.2868 0.5948 0.7904 0.054 Uiso 1 1 calc R . .
H28B H 0.3344 0.6636 0.8410 0.054 Uiso 1 1 calc R . .
C29 C 0.2585(5) 0.3897(9) 0.8293(4) 0.048(3) Uani 1 1 d . . .
H29A H 0.2607 0.3658 0.7948 0.057 Uiso 1 1 calc R . .
H29B H 0.2222 0.4376 0.8220 0.057 Uiso 1 1 calc R . .
C30 C 0.2589(5) 0.2600(9) 0.8594(4) 0.052(3) Uani 1 1 d . . .
H30A H 0.2886 0.1970 0.8569 0.063 Uiso 1 1 calc R . .
C31 C 0.2011(5) 0.1890(12) 0.8371(4) 0.070(4) Uani 1 1 d . . .
H31A H 0.2024 0.1053 0.8572 0.105 Uiso 1 1 calc R . .
H31B H 0.1919 0.1662 0.7996 0.105 Uiso 1 1 calc R . .
H31C H 0.1720 0.2500 0.8401 0.105 Uiso 1 1 calc R . .
C32 C 0.4186(3) 0.3380(8) 0.9795(4) 0.0339(19) Uani 1 1 d . . .
H32A H 0.4582 0.3185 0.9836 0.041 Uiso 1 1 calc R . .
H32B H 0.3939 0.2718 0.9536 0.041 Uiso 1 1 calc R . .
C33 C 0.4130(3) 0.3172(8) 1.0321(4) 0.0346(19) Uani 1 1 d . . .
H33A H 0.4462 0.3580 1.0613 0.042 Uiso 1 1 calc R . .
C34 C 0.4087(4) 0.1692(9) 1.0420(4) 0.040(2) Uani 1 1 d . . .
H34A H 0.4054 0.1566 1.0765 0.060 Uiso 1 1 calc R . .
H34B H 0.4428 0.1223 1.0421 0.060 Uiso 1 1 calc R . .
H34C H 0.3753 0.1310 1.0139 0.060 Uiso 1 1 calc R . .
C35 C 0.3785(3) 0.7333(9) 1.0508(3) 0.0317(16) Uani 1 1 d . . .
H35A H 0.4000 0.8178 1.0655 0.038 Uiso 1 1 calc R . .
H35B H 0.4027 0.6549 1.0686 0.038 Uiso 1 1 calc R . .
C36 C 0.3265(3) 0.7314(9) 1.0635(3) 0.0317(16) Uani 1 1 d . . .
H36A H 0.3103 0.8255 1.0596 0.038 Uiso 1 1 calc R . .
C37 C 0.3387(4) 0.6800(9) 1.1197(3) 0.039(2) Uani 1 1 d . . .
H37A H 0.3036 0.6800 1.1265 0.058 Uiso 1 1 calc R . .
H37B H 0.3665 0.7400 1.1453 0.058 Uiso 1 1 calc R . .
H37C H 0.3539 0.5871 1.1234 0.058 Uiso 1 1 calc R . .
C38 C 0.2144(4) 0.7849(8) 0.9000(4) 0.045(2) Uani 1 1 d . . .
H38A H 0.1995 0.8660 0.8773 0.054 Uiso 1 1 calc R . .
H38B H 0.2245 0.8133 0.9374 0.054 Uiso 1 1 calc R . .
C39 C 0.1684(4) 0.6785(8) 0.8865(3) 0.038(2) Uani 1 1 d . . .
H39A H 0.1484 0.6740 0.8471 0.046 Uiso 1 1 calc R . .
C40 C 0.1257(4) 0.7089(8) 0.9118(4) 0.042(2) Uani 1 1 d . . .
H40A H 0.0967 0.6374 0.9020 0.063 Uiso 1 1 calc R . .
H40B H 0.1077 0.7973 0.8991 0.063 Uiso 1 1 calc R . .
H40C H 0.1450 0.7115 0.9505 0.063 Uiso 1 1 calc R . .
S1 S 0.45360(8) 0.79093(19) 0.36762(8) 0.0265(4) Uani 1 1 d . . .
O11 O 0.4365(3) 0.9316(6) 0.3598(2) 0.0381(14) Uani 1 1 d . . .
O12 O 0.4391(2) 0.7210(6) 0.4072(2) 0.0330(12) Uani 1 1 d . . .
O13 O 0.5094(2) 0.7615(6) 0.3685(2) 0.0336(13) Uani 1 1 d . . .
C41 C 0.4068(4) 0.7125(9) 0.3056(3) 0.039(2) Uani 1 1 d . . .
F1 F 0.4159(2) 0.5780(5) 0.3061(2) 0.0475(13) Uani 1 1 d . . .
F2 F 0.4133(2) 0.7631(6) 0.26369(18) 0.0522(15) Uani 1 1 d . . .
F3 F 0.3523(2) 0.7260(7) 0.2994(2) 0.0554(14) Uani 1 1 d . . .
S2 S 0.42985(9) -0.0292(2) 0.86577(8) 0.0341(4) Uani 1 1 d . . .
O14 O 0.4180(3) -0.1710(6) 0.8600(3) 0.0543(19) Uani 1 1 d . . .
O15 O 0.4861(2) 0.0035(8) 0.8666(2) 0.0487(17) Uani 1 1 d . . .
O16 O 0.4122(3) 0.0384(7) 0.9030(2) 0.0487(17) Uani 1 1 d . . .
C42 C 0.3840(4) 0.0375(11) 0.8030(4) 0.047(2) Uani 1 1 d . . .
F4 F 0.3908(4) 0.1719(7) 0.7994(3) 0.087(2) Uani 1 1 d . . .
F5 F 0.3302(2) 0.0152(11) 0.7952(2) 0.088(2) Uani 1 1 d . . .
F6 F 0.3925(3) -0.0190(7) 0.7619(2) 0.0631(18) Uani 1 1 d . . .
P1 P 0.10648(9) 0.5222(3) 0.39702(8) 0.0393(5) Uani 1 1 d . . .
O17 O 0.1335(3) 0.6531(6) 0.4176(2) 0.0400(15) Uani 1 1 d . . .
O18 O 0.1414(2) 0.4000(6) 0.3999(2) 0.0391(14) Uani 1 1 d . . .
O19 O 0.0658(2) 0.5335(6) 0.3350(2) 0.0393(13) Uani 1 1 d . . .
O20 O 0.0629(3) 0.4926(6) 0.4256(2) 0.0390(14) Uani 1 1 d . . .
O21 O -0.1220(4) 0.9721(12) 0.2414(4) 0.105(4) Uani 1 1 d . . .
O22 O -0.0591(4) 1.0341(9) 0.2054(4) 0.086(3) Uani 1 1 d . . .
O23 O -0.1021(4) 0.0378(10) 0.4402(4) 0.085(3) Uani 1 1 d . . .
O24 O -0.0727(3) -0.0548(8) 0.3810(4) 0.083(3) Uani 1 1 d . . .
N9 N -0.0781(3) 0.9658(10) 0.2372(3) 0.056(2) Uani 1 1 d U . .
N10 N -0.0726(4) 0.0386(10) 0.4118(4) 0.065(3) Uani 1 1 d . . .
C43 C 0.0317(3) 0.6455(8) 0.3143(3) 0.0272(16) Uani 1 1 d . . .
C44 C -0.0207(4) 0.6542(11) 0.3173(4) 0.054(3) Uani 1 1 d . . .
H44A H -0.0327 0.5884 0.3365 0.065 Uiso 1 1 calc R . .
C45 C -0.0557(4) 0.7616(13) 0.2916(4) 0.063(3) Uani 1 1 d . . .
H45A H -0.0924 0.7685 0.2928 0.075 Uiso 1 1 calc R . .
C46 C -0.0388(4) 0.8549(10) 0.2653(3) 0.044(2) Uani 1 1 d . . .
C47 C 0.0144(4) 0.8468(9) 0.2630(4) 0.046(2) Uani 1 1 d . . .
H47A H 0.0264 0.9141 0.2444 0.056 Uiso 1 1 calc R . .
C48 C 0.0502(3) 0.7396(11) 0.2881(3) 0.0392(19) Uani 1 1 d . . .
H48A H 0.0869 0.7326 0.2869 0.047 Uiso 1 1 calc R . .
C49 C 0.0298(4) 0.3760(10) 0.4195(4) 0.042(2) Uani 1 1 d . . .
C50 C 0.0268(4) 0.2745(9) 0.3844(4) 0.048(2) Uani 1 1 d . . .
H50C H 0.0476 0.2803 0.3619 0.058 Uiso 1 1 calc R . .
C51 C -0.0076(4) 0.1613(10) 0.3821(4) 0.051(3) Uani 1 1 d . . .
H51C H -0.0101 0.0880 0.3585 0.061 Uiso 1 1 calc R . .
C52 C -0.0363(4) 0.1588(10) 0.4133(4) 0.051(3) Uani 1 1 d . . .
C53 C -0.0390(4) 0.2661(12) 0.4457(4) 0.058(3) Uani 1 1 d . . .
H53B H -0.0638 0.2637 0.4644 0.069 Uiso 1 1 calc R . .
C54 C -0.0044(4) 0.3751(10) 0.4494(4) 0.047(2) Uani 1 1 d . . .
H54B H -0.0035 0.4495 0.4721 0.057 Uiso 1 1 calc R . .
P2 P 0.28857(10) 0.5599(2) 0.60190(8) 0.0378(5) Uani 1 1 d . . .
O25 O 0.2966(3) 0.4208(7) 0.5844(2) 0.0486(18) Uani 1 1 d . . .
O26 O 0.2597(3) 0.6653(7) 0.5625(2) 0.0507(18) Uani 1 1 d . . .
O27 O 0.3481(2) 0.6240(6) 0.6391(2) 0.0367(14) Uani 1 1 d . . .
O28 O 0.2569(2) 0.5375(6) 0.6427(2) 0.0416(14) Uani 1 1 d . . .
O29 O 0.5149(3) 0.4593(8) 0.8655(2) 0.0490(17) Uani 1 1 d . . .
O30 O 0.5298(3) 0.2942(9) 0.8189(3) 0.067(2) Uani 1 1 d . . .
O31 O 0.1281(4) 0.9153(13) 0.7414(4) 0.104(4) Uani 1 1 d . . .
O32 O 0.1655(5) 1.0733(13) 0.7089(4) 0.094(4) Uani 1 1 d . . .
N11 N 0.5056(3) 0.3994(9) 0.8229(3) 0.0420(19) Uani 1 1 d . . .
N12 N 0.1552(5) 0.9522(14) 0.7179(5) 0.069(3) Uani 1 1 d . . .
C55 C 0.3854(3) 0.5617(8) 0.6848(3) 0.0283(16) Uani 1 1 d . . .
C56 C 0.3984(3) 0.6301(8) 0.7318(3) 0.0317(17) Uani 1 1 d . . .
H56A H 0.3802 0.7140 0.7327 0.038 Uiso 1 1 calc R . .
C57 C 0.4376(3) 0.5779(9) 0.7774(3) 0.0320(17) Uani 1 1 d . . .
H57A H 0.4472 0.6245 0.8102 0.038 Uiso 1 1 calc R . .
C58 C 0.4626(3) 0.4560(10) 0.7743(3) 0.0368(19) Uani 1 1 d . . .
C59 C 0.4508(3) 0.3871(9) 0.7274(3) 0.0328(18) Uani 1 1 d . . .
H59A H 0.4697 0.3041 0.7266 0.039 Uiso 1 1 calc R . .
C60 C 0.4115(3) 0.4400(9) 0.6819(3) 0.0327(18) Uani 1 1 d . . .
H60A H 0.4023 0.3940 0.6489 0.039 Uiso 1 1 calc R . .
C61 C 0.2331(3) 0.6418(11) 0.6607(3) 0.037(2) Uani 1 1 d . . .
C62 C 0.2483(4) 0.7788(10) 0.6601(4) 0.046(2) Uani 1 1 d . . .
H62A H 0.2762 0.8027 0.6464 0.055 Uiso 1 1 calc R . .
C63 C 0.2235(4) 0.8780(12) 0.6790(4) 0.056(3) Uani 1 1 d . . .
H63A H 0.2345 0.9706 0.6789 0.067 Uiso 1 1 calc R . .
C64 C 0.1838(4) 0.8440(12) 0.6976(4) 0.046(3) Uani 1 1 d . . .
C65 C 0.1681(4) 0.7157(15) 0.7005(4) 0.057(3) Uani 1 1 d . . .
H65A H 0.1406 0.6951 0.7152 0.069 Uiso 1 1 calc R . .
C66 C 0.1933(4) 0.6107(12) 0.6813(4) 0.051(3) Uani 1 1 d . . .
H66A H 0.1825 0.5185 0.6826 0.061 Uiso 1 1 calc R . .
P3 P 0.30931(8) 0.1750(2) 1.11203(8) 0.0263(4) Uani 1 1 d . . .
O33 O 0.3167(2) 0.3149(5) 1.0954(2) 0.0290(12) Uani 1 1 d . . .
O34 O 0.2810(2) 0.0705(5) 1.0716(2) 0.0318(12) Uani 1 1 d . . .
O35 O 0.3693(2) 0.1117(5) 1.1487(2) 0.0258(11) Uani 1 1 d . . .
O36 O 0.2780(2) 0.1927(5) 1.1532(2) 0.0331(12) Uani 1 1 d . . .
O37 O 0.5307(3) 0.3265(8) 1.3705(3) 0.059(2) Uani 1 1 d . . .
O38 O 0.5506(3) 0.4682(8) 1.3204(3) 0.059(2) Uani 1 1 d . . .
O39 O 0.1677(5) -0.3236(13) 1.2051(4) 0.087(4) Uani 1 1 d . . .
O40 O 0.1194(4) -0.1684(14) 1.2235(4) 0.112(4) Uani 1 1 d . . .
N13 N 0.5248(3) 0.3689(9) 1.3263(3) 0.0367(17) Uani 1 1 d . . .
N14 N 0.1576(5) -0.2047(17) 1.2100(4) 0.079(4) Uani 1 1 d . . .
C67 C 0.4078(3) 0.1791(8) 1.1920(3) 0.0273(16) Uani 1 1 d . . .
C68 C 0.4221(3) 0.1170(8) 1.2412(3) 0.0269(15) Uani 1 1 d . . .
H68A H 0.4056 0.0320 1.2441 0.032 Uiso 1 1 calc R . .
C69 C 0.4602(3) 0.1791(9) 1.2856(3) 0.0348(18) Uani 1 1 d . . .
H69A H 0.4701 0.1385 1.3196 0.042 Uiso 1 1 calc R . .
C70 C 0.4839(3) 0.3021(9) 1.2797(3) 0.0309(17) Uani 1 1 d . . .
C71 C 0.4715(3) 0.3635(8) 1.2310(3) 0.0279(16) Uani 1 1 d . . .
H71A H 0.4892 0.4466 1.2279 0.033 Uiso 1 1 calc R . .
C72 C 0.4322(3) 0.2999(8) 1.1863(3) 0.0280(16) Uani 1 1 d . . .
H72A H 0.4223 0.3401 1.1523 0.034 Uiso 1 1 calc R . .
C73 C 0.2506(3) 0.0899(10) 1.1681(3) 0.0331(19) Uani 1 1 d . . .
C74 C 0.2056(3) 0.1307(11) 1.1821(3) 0.040(2) Uani 1 1 d . . .
H74A H 0.1956 0.2242 1.1810 0.048 Uiso 1 1 calc R . .
C75 C 0.1764(3) 0.0347(14) 1.1973(3) 0.049(3) Uani 1 1 d . . .
H75A H 0.1465 0.0601 1.2083 0.059 Uiso 1 1 calc R . .
C76 C 0.1911(4) -0.1017(12) 1.1964(3) 0.049(3) Uani 1 1 d . . .
C77 C 0.2362(4) -0.1438(12) 1.1842(3) 0.048(2) Uani 1 1 d . . .
H77A H 0.2459 -0.2377 1.1855 0.057 Uiso 1 1 calc R . .
C78 C 0.2671(4) -0.0463(10) 1.1700(3) 0.040(2) Uani 1 1 d . . .
H78A H 0.2988 -0.0715 1.1617 0.048 Uiso 1 1 calc R . .
P4 P 0.10208(9) 0.2184(2) 0.91944(8) 0.0338(5) Uani 1 1 d . . .
O41 O 0.1288(2) 0.0885(6) 0.9416(2) 0.0357(13) Uani 1 1 d . . .
O42 O 0.1362(2) 0.3452(6) 0.9268(2) 0.0384(14) Uani 1 1 d . . .
O43 O 0.0683(2) 0.2059(5) 0.8565(2) 0.0361(13) Uani 1 1 d . . .
O44 O 0.0525(2) 0.2401(6) 0.9414(2) 0.0359(12) Uani 1 1 d . . .
O45 O -0.1167(4) -0.2323(12) 0.7510(3) 0.097(4) Uani 1 1 d . . .
O46 O -0.0519(4) -0.3152(9) 0.7323(4) 0.110(5) Uani 1 1 d . . .
O47 O -0.0863(3) 0.7802(7) 0.8822(3) 0.058(2) Uani 1 1 d . . .
O48 O -0.1168(4) 0.6999(8) 0.9410(3) 0.066(2) Uani 1 1 d . . .
N15 N -0.0662(4) -0.2294(10) 0.7523(3) 0.062(3) Uani 1 1 d U . .
N16 N -0.0882(3) 0.6926(8) 0.9146(3) 0.046(2) Uani 1 1 d . . .
C79 C 0.0354(3) 0.0932(7) 0.8334(3) 0.0264(16) Uani 1 1 d . . .
C80 C -0.0196(4) 0.0807(11) 0.8330(4) 0.046(2) Uani 1 1 d . . .
H80A H -0.0329 0.1470 0.8510 0.056 Uiso 1 1 calc R . .
C81 C -0.0543(4) -0.0227(12) 0.8076(4) 0.053(3) Uani 1 1 d . . .
H81A H -0.0918 -0.0307 0.8068 0.064 Uiso 1 1 calc R . .
C82 C -0.0314(3) -0.1176(8) 0.7826(3) 0.0315(18) Uani 1 1 d . . .
C83 C 0.0219(3) -0.1097(10) 0.7822(4) 0.042(2) Uani 1 1 d . . .
H83A H 0.0353 -0.1763 0.7645 0.050 Uiso 1 1 calc R . .
C84 C 0.0560(3) -0.0005(10) 0.8088(3) 0.038(2) Uani 1 1 d . . .
H84A H 0.0935 0.0079 0.8096 0.045 Uiso 1 1 calc R . .
C85 C 0.0187(3) 0.3548(8) 0.9333(3) 0.0271(16) Uani 1 1 d U . .
C86 C -0.0091(3) 0.3729(11) 0.9678(4) 0.042(2) Uani 1 1 d . . .
H86A H -0.0040 0.3091 0.9955 0.050 Uiso 1 1 calc R . .
C87 C -0.0444(4) 0.4843(10) 0.9617(4) 0.053(3) Uani 1 1 d . . .
H87A H -0.0638 0.4973 0.9851 0.064 Uiso 1 1 calc R . .
C88 C -0.0510(3) 0.5757(8) 0.9217(4) 0.037(2) Uani 1 1 d . . .
C89 C -0.0225(4) 0.5581(8) 0.8871(4) 0.045(2) Uani 1 1 d . . .
H89A H -0.0262 0.6237 0.8603 0.053 Uiso 1 1 calc R . .
C90 C 0.0108(3) 0.4460(9) 0.8922(4) 0.040(2) Uani 1 1 d . . .
H90A H 0.0285 0.4304 0.8677 0.048 Uiso 1 1 calc R . .
O49 O 0.2562(2) 0.6623(6) 0.4636(2) 0.0318(12) Uani 1 1 d . . .
H49A H 0.2206 0.6594 0.4501 0.038 Uiso 1 1 d R . .
H49B H 0.2575 0.6628 0.4949 0.038 Uiso 1 1 d R . .
O50 O 0.1538(2) 0.8057(6) 0.5125(3) 0.0473(16) Uani 1 1 d . . .
H50A H 0.1477 0.7615 0.4844 0.057 Uiso 1 1 d R . .
H50B H 0.1848 0.7651 0.5273 0.057 Uiso 1 1 d R . .
O51 O 0.2457(2) 0.0939(5) 0.9621(2) 0.0316(12) Uani 1 1 d . . .
H51A H 0.2566 0.0866 0.9953 0.038 Uiso 1 1 d R . .
H51B H 0.2108 0.0921 0.9559 0.038 Uiso 1 1 d R . .
O52 O 0.1770(2) -0.0744(6) 1.0350(3) 0.0438(16) Uani 1 1 d . . .
H52A H 0.2079 -0.0318 1.0459 0.053 Uiso 1 1 d R . .
H52B H 0.1626 -0.0266 1.0075 0.053 Uiso 1 1 d R . .
O53 O 0.1802(3) 0.0765(6) 0.5127(3) 0.0505(17) Uani 1 1 d D . .
H53A H 0.1723 -0.0067 0.5126 0.061 Uiso 1 1 d R A .
C91 C 0.1533(10) 0.1763(18) 0.5352(9) 0.081(5) Uani 0.47(2) 1 d PDU A 1
H91 H 0.1316 0.2480 0.5095 0.098 Uiso 0.47(2) 1 calc PR A 1
C92 C 0.1190(15) 0.104(3) 0.5628(15) 0.123(6) Uani 0.47(2) 1 d PDU A 1
H92A H 0.0860 0.0599 0.5362 0.185 Uiso 0.47(2) 1 calc PR A 1
H92B H 0.1064 0.1705 0.5829 0.185 Uiso 0.47(2) 1 calc PR A 1
H92C H 0.1426 0.0347 0.5872 0.185 Uiso 0.47(2) 1 calc PR A 1
C93 C 0.1992(15) 0.234(4) 0.5857(12) 0.123(6) Uani 0.47(2) 1 d PD A 1
H93A H 0.2264 0.2871 0.5761 0.185 Uiso 0.47(2) 1 calc PR A 1
H93B H 0.2189 0.1584 0.6091 0.185 Uiso 0.47(2) 1 calc PR A 1
H93C H 0.1816 0.2926 0.6043 0.185 Uiso 0.47(2) 1 calc PR A 1
C91' C 0.1440(8) 0.1743(17) 0.5250(8) 0.081(5) Uani 0.53(2) 1 d PD A 5
H91' H 0.1386 0.2611 0.5044 0.098 Uiso 0.53(2) 1 calc PR A 5
C92' C 0.0887(8) 0.104(3) 0.5190(14) 0.123(6) Uani 0.53(2) 1 d PD A 5
H92D H 0.0679 0.0813 0.4816 0.185 Uiso 0.53(2) 1 calc PR A 5
H92E H 0.0658 0.1654 0.5312 0.185 Uiso 0.53(2) 1 calc PR A 5
H92F H 0.0969 0.0205 0.5403 0.185 Uiso 0.53(2) 1 calc PR A 5
C93' C 0.1665(14) 0.196(3) 0.5853(9) 0.123(6) Uani 0.53(2) 1 d PD A 5
H93D H 0.2031 0.2431 0.5967 0.185 Uiso 0.53(2) 1 calc PR A 5
H93E H 0.1714 0.1074 0.6032 0.185 Uiso 0.53(2) 1 calc PR A 5
H93F H 0.1395 0.2513 0.5945 0.185 Uiso 0.53(2) 1 calc PR A 5
O54 O 0.1997(2) 0.6653(6) 1.0519(3) 0.0550(19) Uani 1 1 d D . .
H54A H 0.1923 0.7487 1.0462 0.066 Uiso 1 1 d R B .
C94 C 0.1656(6) 0.5552(13) 1.0600(6) 0.051(4) Uani 0.530(12) 1 d PD B 1
H94 H 0.1595 0.4780 1.0344 0.061 Uiso 0.530(12) 1 calc PR B 1
C95 C 0.1108(6) 0.6137(19) 1.0614(9) 0.049(4) Uani 0.530(12) 1 d PD B 1
H95A H 0.0877 0.6500 1.0263 0.073 Uiso 0.530(12) 1 calc PR B 1
H95B H 0.1197 0.6872 1.0878 0.073 Uiso 0.530(12) 1 calc PR B 1
H95C H 0.0898 0.5417 1.0711 0.073 Uiso 0.530(12) 1 calc PR B 1
C96 C 0.1946(10) 0.513(3) 1.1181(8) 0.070(7) Uani 0.530(12) 1 d PD B 1
H96A H 0.2309 0.4693 1.1234 0.104 Uiso 0.530(12) 1 calc PR B 1
H96B H 0.1703 0.4482 1.1273 0.104 Uiso 0.530(12) 1 calc PR B 1
H96C H 0.2010 0.5935 1.1409 0.104 Uiso 0.530(12) 1 calc PR B 1
C94' C 0.1649(6) 0.6147(15) 1.0800(6) 0.051(4) Uani 0.470(12) 1 d PD B 5
H94' H 0.1596 0.6819 1.1054 0.061 Uiso 0.470(12) 1 calc PR B 5
C95' C 0.1097(6) 0.562(2) 1.0387(9) 0.049(4) Uani 0.470(12) 1 d PD B 5
H95D H 0.0879 0.6388 1.0177 0.073 Uiso 0.470(12) 1 calc PR B 5
H95E H 0.0875 0.5168 1.0566 0.073 Uiso 0.470(12) 1 calc PR B 5
H95F H 0.1180 0.4970 1.0153 0.073 Uiso 0.470(12) 1 calc PR B 5
C96' C 0.1917(11) 0.480(2) 1.1057(11) 0.070(7) Uani 0.470(12) 1 d PD B 5
H96D H 0.2284 0.4987 1.1340 0.104 Uiso 0.470(12) 1 calc PR B 5
H96E H 0.1969 0.4213 1.0789 0.104 Uiso 0.470(12) 1 calc PR B 5
H96F H 0.1668 0.4352 1.1207 0.104 Uiso 0.470(12) 1 calc PR B 5
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Eu Eu -0.1578 3.6682 '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
O3 Eu1 O1 137.79(18) . . ?
O3 Eu1 O2 82.49(19) . . ?
O1 Eu1 O2 80.59(18) . . ?
O3 Eu1 O4 86.70(18) . . ?
O1 Eu1 O4 80.86(17) . . ?
O2 Eu1 O4 138.20(17) . . ?
O3 Eu1 O9 66.52(19) . . ?
O1 Eu1 O9 71.48(18) . . ?
O2 Eu1 O9 71.60(19) . . ?
O4 Eu1 O9 67.05(17) . . ?
O3 Eu1 N4 89.62(19) . . ?
O1 Eu1 N4 119.03(19) . . ?
O2 Eu1 N4 156.07(18) . . ?
O4 Eu1 N4 63.15(17) . . ?
O9 Eu1 N4 125.51(19) . . ?
O3 Eu1 N3 63.1(2) . . ?
O1 Eu1 N3 153.0(2) . . ?
O2 Eu1 N3 87.57(19) . . ?
O4 Eu1 N3 122.59(19) . . ?
O9 Eu1 N3 127.4(2) . . ?
N4 Eu1 N3 68.78(19) . . ?
O3 Eu1 N2 118.4(2) . . ?
O1 Eu1 N2 86.55(19) . . ?
O2 Eu1 N2 62.2(2) . . ?
O4 Eu1 N2 152.34(19) . . ?
O9 Eu1 N2 131.4(2) . . ?
N4 Eu1 N2 103.08(19) . . ?
N3 Eu1 N2 66.5(2) . . ?
O3 Eu1 N1 156.17(18) . . ?
O1 Eu1 N1 63.13(18) . . ?
O2 Eu1 N1 117.04(19) . . ?
O4 Eu1 N1 86.53(17) . . ?
O9 Eu1 N1 130.43(18) . . ?
N4 Eu1 N1 66.98(19) . . ?
N3 Eu1 N1 102.2(2) . . ?
N2 Eu1 N1 65.8(2) . . ?
C10 O1 Eu1 129.0(4) . . ?
C10 O1 H1A 109.1 . . ?
Eu1 O1 H1A 121.0 . . ?
C13 O2 Eu1 127.1(5) . . ?
C13 O2 H2A 119.3 . . ?
Eu1 O2 H2A 110.6 . . ?
C16 O3 Eu1 130.0(5) . . ?
C16 O3 H3A 101.9 . . ?
Eu1 O3 H3A 128.0 . . ?
C19 O4 Eu1 126.3(4) . . ?
C19 O4 H4A 117.1 . . ?
Eu1 O4 H4A 113.3 . . ?
Eu1 O9 H9A 122.8 . . ?
Eu1 O9 H9B 122.7 . . ?
H9A O9 H9B 102.0 . . ?
C1 N1 C9 110.3(6) . . ?
C1 N1 C8 109.4(6) . . ?
C9 N1 C8 108.0(6) . . ?
C1 N1 Eu1 112.8(5) . . ?
C9 N1 Eu1 104.1(4) . . ?
C8 N1 Eu1 112.0(4) . . ?
C12 N2 C3 109.9(6) . . ?
C12 N2 C2 108.2(7) . . ?
C3 N2 C2 108.6(6) . . ?
C12 N2 Eu1 106.2(5) . . ?
C3 N2 Eu1 110.9(5) . . ?
C2 N2 Eu1 113.0(4) . . ?
C5 N3 C4 110.3(7) . . ?
C5 N3 C15 109.0(7) . . ?
C4 N3 C15 109.8(6) . . ?
C5 N3 Eu1 109.3(5) . . ?
C4 N3 Eu1 112.7(5) . . ?
C15 N3 Eu1 105.5(5) . . ?
C6 N4 C7 108.4(6) . . ?
C6 N4 C18 109.8(6) . . ?
C7 N4 C18 109.9(5) . . ?
C6 N4 Eu1 111.5(4) . . ?
C7 N4 Eu1 112.6(4) . . ?
C18 N4 Eu1 104.6(4) . . ?
N1 C1 C2 111.3(6) . . ?
N1 C1 H1B 109.4 . . ?
C2 C1 H1B 109.4 . . ?
N1 C1 H1C 109.4 . . ?
C2 C1 H1C 109.4 . . ?
H1B C1 H1C 108.0 . . ?
C1 C2 N2 112.4(6) . . ?
C1 C2 H2B 109.1 . . ?
N2 C2 H2B 109.1 . . ?
C1 C2 H2C 109.1 . . ?
N2 C2 H2C 109.1 . . ?
H2B C2 H2C 107.9 . . ?
N2 C3 C4 111.1(7) . . ?
N2 C3 H3B 109.4 . . ?
C4 C3 H3B 109.4 . . ?
N2 C3 H3C 109.4 . . ?
C4 C3 H3C 109.4 . . ?
H3B C3 H3C 108.0 . . ?
N3 C4 C3 111.8(7) . . ?
N3 C4 H4B 109.3 . . ?
C3 C4 H4B 109.3 . . ?
N3 C4 H4C 109.3 . . ?
C3 C4 H4C 109.3 . . ?
H4B C4 H4C 107.9 . . ?
N3 C5 C6 111.1(7) . . ?
N3 C5 H5B 109.4 . . ?
C6 C5 H5B 109.4 . . ?
N3 C5 H5C 109.4 . . ?
C6 C5 H5C 109.4 . . ?
H5B C5 H5C 108.0 . . ?
N4 C6 C5 113.2(6) . . ?
N4 C6 H6B 108.9 . . ?
C5 C6 H6B 108.9 . . ?
N4 C6 H6C 108.9 . . ?
C5 C6 H6C 108.9 . . ?
H6B C6 H6C 107.7 . . ?
N4 C7 C8 112.6(6) . . ?
N4 C7 H7B 109.1 . . ?
C8 C7 H7B 109.1 . . ?
N4 C7 H7C 109.1 . . ?
C8 C7 H7C 109.1 . . ?
H7B C7 H7C 107.8 . . ?
N1 C8 C7 111.8(6) . . ?
N1 C8 H8B 109.3 . . ?
C7 C8 H8B 109.3 . . ?
N1 C8 H8C 109.3 . . ?
C7 C8 H8C 109.3 . . ?
H8B C8 H8C 107.9 . . ?
N1 C9 C10 112.2(6) . . ?
N1 C9 H9C 109.2 . . ?
C10 C9 H9C 109.2 . . ?
N1 C9 H9D 109.2 . . ?
C10 C9 H9D 109.2 . . ?
H9C C9 H9D 107.9 . . ?
O1 C10 C11 112.6(6) . . ?
O1 C10 C9 106.7(6) . . ?
C11 C10 C9 110.2(6) . . ?
O1 C10 H10C 109.1 . . ?
C11 C10 H10C 109.1 . . ?
C9 C10 H10C 109.1 . . ?
C10 C11 H11A 109.5 . . ?
C10 C11 H11B 109.5 . . ?
H11A C11 H11B 109.5 . . ?
C10 C11 H11C 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
N2 C12 C13 111.6(7) . . ?
N2 C12 H12A 109.3 . . ?
C13 C12 H12A 109.3 . . ?
N2 C12 H12B 109.3 . . ?
C13 C12 H12B 109.3 . . ?
H12A C12 H12B 108.0 . . ?
O2 C13 C12 107.9(6) . . ?
O2 C13 C14 110.1(7) . . ?
C12 C13 C14 112.1(8) . . ?
O2 C13 H13A 108.9 . . ?
C12 C13 H13A 108.9 . . ?
C14 C13 H13A 108.9 . . ?
C13 C14 H14A 109.5 . . ?
C13 C14 H14B 109.5 . . ?
H14A C14 H14B 109.5 . . ?
C13 C14 H14C 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
C16 C15 N3 113.1(7) . . ?
C16 C15 H15A 109.0 . . ?
N3 C15 H15A 109.0 . . ?
C16 C15 H15B 109.0 . . ?
N3 C15 H15B 109.0 . . ?
H15A C15 H15B 107.8 . . ?
O3 C16 C15 105.2(7) . . ?
O3 C16 C17 110.8(7) . . ?
C15 C16 C17 110.1(8) . . ?
O3 C16 H16A 110.2 . . ?
C15 C16 H16A 110.2 . . ?
C17 C16 H16A 110.2 . . ?
C16 C17 H17A 109.5 . . ?
C16 C17 H17B 109.5 . . ?
H17A C17 H17B 109.5 . . ?
C16 C17 H17C 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
N4 C18 C19 112.0(6) . . ?
N4 C18 H18A 109.2 . . ?
C19 C18 H18A 109.2 . . ?
N4 C18 H18B 109.2 . . ?
C19 C18 H18B 109.2 . . ?
H18A C18 H18B 107.9 . . ?
O4 C19 C20 110.7(6) . . ?
O4 C19 C18 105.0(5) . . ?
C20 C19 C18 111.5(7) . . ?
O4 C19 H19A 109.8 . . ?
C20 C19 H19A 109.8 . . ?
C18 C19 H19A 109.8 . . ?
C19 C20 H20A 109.5 . . ?
C19 C20 H20B 109.5 . . ?
H20A C20 H20B 109.5 . . ?
C19 C20 H20C 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
O7 Eu2 O5 136.49(18) . . ?
O7 Eu2 O6 81.26(18) . . ?
O5 Eu2 O6 83.03(19) . . ?
O7 Eu2 O10 66.46(17) . . ?
O5 Eu2 O10 70.09(18) . . ?
O6 Eu2 O10 71.18(17) . . ?
O7 Eu2 O8 86.40(18) . . ?
O5 Eu2 O8 79.22(19) . . ?
O6 Eu2 O8 138.55(17) . . ?
O10 Eu2 O8 67.61(18) . . ?
O7 Eu2 N7 62.93(18) . . ?
O5 Eu2 N7 155.35(19) . . ?
O6 Eu2 N7 86.61(19) . . ?
O10 Eu2 N7 127.04(18) . . ?
O8 Eu2 N7 122.08(19) . . ?
O7 Eu2 N8 89.6(2) . . ?
O5 Eu2 N8 118.4(2) . . ?
O6 Eu2 N8 155.11(19) . . ?
O10 Eu2 N8 126.0(2) . . ?
O8 Eu2 N8 62.96(19) . . ?
N7 Eu2 N8 68.7(2) . . ?
O7 Eu2 N6 118.63(19) . . ?
O5 Eu2 N6 88.7(2) . . ?
O6 Eu2 N6 62.81(19) . . ?
O10 Eu2 N6 131.26(19) . . ?
O8 Eu2 N6 152.2(2) . . ?
N7 Eu2 N6 66.7(2) . . ?
N8 Eu2 N6 102.8(2) . . ?
O7 Eu2 N5 156.7(2) . . ?
O5 Eu2 N5 63.3(2) . . ?
O6 Eu2 N5 117.8(2) . . ?
O10 Eu2 N5 130.1(2) . . ?
O8 Eu2 N5 86.7(2) . . ?
N7 Eu2 N5 102.8(2) . . ?
N8 Eu2 N5 67.5(2) . . ?
N6 Eu2 N5 65.6(2) . . ?
C30 O5 Eu2 128.5(5) . . ?
C30 O5 H5A 108.0 . . ?
Eu2 O5 H5A 122.4 . . ?
C33 O6 Eu2 128.9(5) . . ?
C33 O6 H6A 115.1 . . ?
Eu2 O6 H6A 113.8 . . ?
C36 O7 Eu2 128.8(4) . . ?
C36 O7 H7A 99.7 . . ?
Eu2 O7 H7A 131.5 . . ?
C39 O8 Eu2 124.8(4) . . ?
C39 O8 H8A 119.3 . . ?
Eu2 O8 H8A 111.3 . . ?
Eu2 O10 H10A 121.4 . . ?
Eu2 O10 H10B 124.1 . . ?
H10A O10 H10B 103.9 . . ?
C21 N5 C29 110.7(8) . . ?
C21 N5 C28 109.2(7) . . ?
C29 N5 C28 109.8(7) . . ?
C21 N5 Eu2 111.2(5) . . ?
C29 N5 Eu2 104.7(5) . . ?
C28 N5 Eu2 111.2(5) . . ?
C22 N6 C32 109.4(6) . . ?
C22 N6 C23 108.5(7) . . ?
C32 N6 C23 108.1(7) . . ?
C22 N6 Eu2 114.9(5) . . ?
C32 N6 Eu2 105.1(4) . . ?
C23 N6 Eu2 110.6(4) . . ?
C35 N7 C24 109.2(6) . . ?
C35 N7 C25 107.9(6) . . ?
C24 N7 C25 107.9(6) . . ?
C35 N7 Eu2 107.9(5) . . ?
C24 N7 Eu2 114.3(4) . . ?
C25 N7 Eu2 109.5(4) . . ?
C27 N8 C38 110.5(7) . . ?
C27 N8 C26 108.9(7) . . ?
C38 N8 C26 109.3(7) . . ?
C27 N8 Eu2 111.6(5) . . ?
C38 N8 Eu2 105.1(5) . . ?
C26 N8 Eu2 111.4(5) . . ?
N5 C21 C22 113.4(7) . . ?
N5 C21 H21A 108.9 . . ?
C22 C21 H21A 108.9 . . ?
N5 C21 H21B 108.9 . . ?
C22 C21 H21B 108.9 . . ?
H21A C21 H21B 107.7 . . ?
N6 C22 C21 111.3(7) . . ?
N6 C22 H22A 109.4 . . ?
C21 C22 H22A 109.4 . . ?
N6 C22 H22B 109.4 . . ?
C21 C22 H22B 109.4 . . ?
H22A C22 H22B 108.0 . . ?
N6 C23 C24 111.4(7) . . ?
N6 C23 H23A 109.3 . . ?
C24 C23 H23A 109.3 . . ?
N6 C23 H23B 109.3 . . ?
C24 C23 H23B 109.3 . . ?
H23A C23 H23B 108.0 . . ?
N7 C24 C23 109.5(6) . . ?
N7 C24 H24A 109.8 . . ?
C23 C24 H24A 109.8 . . ?
N7 C24 H24B 109.8 . . ?
C23 C24 H24B 109.8 . . ?
H24A C24 H24B 108.2 . . ?
C26 C25 N7 111.8(6) . . ?
C26 C25 H25A 109.3 . . ?
N7 C25 H25A 109.3 . . ?
C26 C25 H25B 109.3 . . ?
N7 C25 H25B 109.3 . . ?
H25A C25 H25B 107.9 . . ?
N8 C26 C25 112.7(7) . . ?
N8 C26 H26A 109.0 . . ?
C25 C26 H26A 109.0 . . ?
N8 C26 H26B 109.0 . . ?
C25 C26 H26B 109.0 . . ?
H26A C26 H26B 107.8 . . ?
N8 C27 C28 113.2(8) . . ?
N8 C27 H27A 108.9 . . ?
C28 C27 H27A 108.9 . . ?
N8 C27 H27B 108.9 . . ?
C28 C27 H27B 108.9 . . ?
H27A C27 H27B 107.8 . . ?
N5 C28 C27 112.2(8) . . ?
N5 C28 H28A 109.2 . . ?
C27 C28 H28A 109.2 . . ?
N5 C28 H28B 109.2 . . ?
C27 C28 H28B 109.2 . . ?
H28A C28 H28B 107.9 . . ?
N5 C29 C30 113.6(8) . . ?
N5 C29 H29A 108.8 . . ?
C30 C29 H29A 108.8 . . ?
N5 C29 H29B 108.8 . . ?
C30 C29 H29B 108.8 . . ?
H29A C29 H29B 107.7 . . ?
O5 C30 C29 106.6(7) . . ?
O5 C30 C31 110.8(8) . . ?
C29 C30 C31 111.1(9) . . ?
O5 C30 H30A 109.4 . . ?
C29 C30 H30A 109.4 . . ?
C31 C30 H30A 109.4 . . ?
C30 C31 H31A 109.5 . . ?
C30 C31 H31B 109.5 . . ?
H31A C31 H31B 109.5 . . ?
C30 C31 H31C 109.5 . . ?
H31A C31 H31C 109.5 . . ?
H31B C31 H31C 109.5 . . ?
N6 C32 C33 113.8(6) . . ?
N6 C32 H32A 108.8 . . ?
C33 C32 H32A 108.8 . . ?
N6 C32 H32B 108.8 . . ?
C33 C32 H32B 108.8 . . ?
H32A C32 H32B 107.7 . . ?
O6 C33 C34 111.3(6) . . ?
O6 C33 C32 104.9(7) . . ?
C34 C33 C32 110.1(7) . . ?
O6 C33 H33A 110.2 . . ?
C34 C33 H33A 110.2 . . ?
C32 C33 H33A 110.2 . . ?
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 . . ?
N7 C35 C36 113.5(6) . . ?
N7 C35 H35A 108.9 . . ?
C36 C35 H35A 108.9 . . ?
N7 C35 H35B 108.9 . . ?
C36 C35 H35B 108.9 . . ?
H35A C35 H35B 107.7 . . ?
O7 C36 C35 106.1(6) . . ?
O7 C36 C37 110.8(6) . . ?
C35 C36 C37 111.8(7) . . ?
O7 C36 H36A 109.4 . . ?
C35 C36 H36A 109.4 . . ?
C37 C36 H36A 109.4 . . ?
C36 C37 H37A 109.5 . . ?
C36 C37 H37B 109.5 . . ?
H37A C37 H37B 109.5 . . ?
C36 C37 H37C 109.5 . . ?
H37A C37 H37C 109.5 . . ?
H37B C37 H37C 109.5 . . ?
N8 C38 C39 113.2(7) . . ?
N8 C38 H38A 108.9 . . ?
C39 C38 H38A 108.9 . . ?
N8 C38 H38B 108.9 . . ?
C39 C38 H38B 108.9 . . ?
H38A C38 H38B 107.7 . . ?
O8 C39 C38 107.0(7) . . ?
O8 C39 C40 110.0(7) . . ?
C38 C39 C40 112.2(7) . . ?
O8 C39 H39A 109.2 . . ?
C38 C39 H39A 109.2 . . ?
C40 C39 H39A 109.2 . . ?
C39 C40 H40A 109.5 . . ?
C39 C40 H40B 109.5 . . ?
H40A C40 H40B 109.5 . . ?
C39 C40 H40C 109.5 . . ?
H40A C40 H40C 109.5 . . ?
H40B C40 H40C 109.5 . . ?
O12 S1 O11 114.8(3) . . ?
O12 S1 O13 115.0(3) . . ?
O11 S1 O13 115.8(4) . . ?
O12 S1 C41 103.1(4) . . ?
O11 S1 C41 102.2(4) . . ?
O13 S1 C41 103.1(4) . . ?
F2 C41 F1 107.7(7) . . ?
F2 C41 F3 108.5(7) . . ?
F1 C41 F3 105.5(7) . . ?
F2 C41 S1 113.0(6) . . ?
F1 C41 S1 110.8(6) . . ?
F3 C41 S1 111.0(6) . . ?
O16 S2 O14 115.2(4) . . ?
O16 S2 O15 117.3(4) . . ?
O14 S2 O15 112.6(5) . . ?
O16 S2 C42 104.0(4) . . ?
O14 S2 C42 102.5(5) . . ?
O15 S2 C42 102.7(4) . . ?
F5 C42 F6 106.4(8) . . ?
F5 C42 F4 107.9(9) . . ?
F6 C42 F4 106.3(8) . . ?
F5 C42 S2 110.9(7) . . ?
F6 C42 S2 113.1(7) . . ?
F4 C42 S2 112.0(7) . . ?
O17 P1 O18 120.2(4) . . ?
O17 P1 O20 106.7(3) . . ?
O18 P1 O20 109.9(3) . . ?
O17 P1 O19 111.3(4) . . ?
O18 P1 O19 104.3(3) . . ?
O20 P1 O19 103.2(3) . . ?
C43 O19 P1 122.5(5) . . ?
C49 O20 P1 126.3(6) . . ?
O21 N9 O22 129.7(9) . . ?
O21 N9 C46 118.4(10) . . ?
O22 N9 C46 111.4(9) . . ?
O24 N10 O23 123.9(10) . . ?
O24 N10 C52 116.5(11) . . ?
O23 N10 C52 119.6(10) . . ?
C48 C43 C44 121.9(8) . . ?
C48 C43 O19 117.7(7) . . ?
C44 C43 O19 120.2(8) . . ?
C43 C44 C45 118.3(8) . . ?
C43 C44 H44A 120.8 . . ?
C45 C44 H44A 120.8 . . ?
C46 C45 C44 121.0(9) . . ?
C46 C45 H45A 119.5 . . ?
C44 C45 H45A 119.5 . . ?
C45 C46 C47 120.5(8) . . ?
C45 C46 N9 119.3(9) . . ?
C47 C46 N9 120.2(9) . . ?
C46 C47 C48 119.7(8) . . ?
C46 C47 H47A 120.2 . . ?
C48 C47 H47A 120.2 . . ?
C43 C48 C47 118.6(8) . . ?
C43 C48 H48A 120.7 . . ?
C47 C48 H48A 120.7 . . ?
C50 C49 O20 123.6(9) . . ?
C50 C49 C54 121.4(9) . . ?
O20 C49 C54 114.8(8) . . ?
C49 C50 C51 118.6(10) . . ?
C49 C50 H50C 120.7 . . ?
C51 C50 H50C 120.7 . . ?
C52 C51 C50 118.6(9) . . ?
C52 C51 H51C 120.7 . . ?
C50 C51 H51C 120.7 . . ?
C51 C52 C53 124.6(10) . . ?
C51 C52 N10 119.3(10) . . ?
C53 C52 N10 116.0(10) . . ?
C54 C53 C52 117.0(10) . . ?
C54 C53 H53B 121.5 . . ?
C52 C53 H53B 121.5 . . ?
C53 C54 C49 119.3(10) . . ?
C53 C54 H54B 120.4 . . ?
C49 C54 H54B 120.4 . . ?
O26 P2 O25 120.2(4) . . ?
O26 P2 O27 106.3(4) . . ?
O25 P2 O27 110.5(3) . . ?
O26 P2 O28 110.7(3) . . ?
O25 P2 O28 105.1(4) . . ?
O27 P2 O28 102.7(3) . . ?
C55 O27 P2 124.0(5) . . ?
C61 O28 P2 123.2(6) . . ?
O30 N11 O29 123.9(7) . . ?
O30 N11 C58 117.7(7) . . ?
O29 N11 C58 118.4(8) . . ?
O31 N12 O32 127.6(12) . . ?
O31 N12 C64 116.9(13) . . ?
O32 N12 C64 115.4(11) . . ?
C56 C55 C60 121.6(7) . . ?
C56 C55 O27 117.6(7) . . ?
C60 C55 O27 120.7(7) . . ?
C57 C56 C55 120.0(8) . . ?
C57 C56 H56A 120.0 . . ?
C55 C56 H56A 120.0 . . ?
C56 C57 C58 118.0(8) . . ?
C56 C57 H57A 121.0 . . ?
C58 C57 H57A 121.0 . . ?
C57 C58 C59 122.8(8) . . ?
C57 C58 N11 118.7(8) . . ?
C59 C58 N11 118.5(8) . . ?
C60 C59 C58 118.9(8) . . ?
C60 C59 H59A 120.6 . . ?
C58 C59 H59A 120.6 . . ?
C59 C60 C55 118.7(7) . . ?
C59 C60 H60A 120.7 . . ?
C55 C60 H60A 120.7 . . ?
C66 C61 O28 118.5(9) . . ?
C66 C61 C62 118.2(9) . . ?
O28 C61 C62 123.3(7) . . ?
C63 C62 C61 120.8(9) . . ?
C63 C62 H62A 119.6 . . ?
C61 C62 H62A 119.6 . . ?
C64 C63 C62 119.4(11) . . ?
C64 C63 H63A 120.3 . . ?
C62 C63 H63A 120.3 . . ?
C65 C64 C63 123.1(10) . . ?
C65 C64 N12 116.6(10) . . ?
C63 C64 N12 120.3(11) . . ?
C64 C65 C66 118.5(9) . . ?
C64 C65 H65A 120.7 . . ?
C66 C65 H65A 120.7 . . ?
C61 C66 C65 120.0(11) . . ?
C61 C66 H66A 120.0 . . ?
C65 C66 H66A 120.0 . . ?
O34 P3 O33 120.0(3) . . ?
O34 P3 O35 106.1(3) . . ?
O33 P3 O35 110.3(3) . . ?
O34 P3 O36 111.2(3) . . ?
O33 P3 O36 105.5(3) . . ?
O35 P3 O36 102.4(3) . . ?
C67 O35 P3 123.4(5) . . ?
C73 O36 P3 124.6(5) . . ?
O38 N13 O37 121.9(7) . . ?
O38 N13 C70 119.2(7) . . ?
O37 N13 C70 118.9(8) . . ?
O39 N14 O40 122.8(13) . . ?
O39 N14 C76 118.1(12) . . ?
O40 N14 C76 119.0(15) . . ?
C72 C67 O35 121.6(7) . . ?
C72 C67 C68 121.4(7) . . ?
O35 C67 C68 117.0(7) . . ?
C69 C68 C67 119.6(7) . . ?
C69 C68 H68A 120.2 . . ?
C67 C68 H68A 120.2 . . ?
C68 C69 C70 118.6(7) . . ?
C68 C69 H69A 120.7 . . ?
C70 C69 H69A 120.7 . . ?
C71 C70 C69 122.6(7) . . ?
C71 C70 N13 118.0(8) . . ?
C69 C70 N13 119.4(7) . . ?
C70 C71 C72 118.0(7) . . ?
C70 C71 H71A 121.0 . . ?
C72 C71 H71A 121.0 . . ?
C67 C72 C71 119.7(7) . . ?
C67 C72 H72A 120.1 . . ?
C71 C72 H72A 120.1 . . ?
O36 C73 C74 115.6(8) . . ?
O36 C73 C78 122.2(7) . . ?
C74 C73 C78 122.2(9) . . ?
C75 C74 C73 119.1(10) . . ?
C75 C74 H74A 120.5 . . ?
C73 C74 H74A 120.5 . . ?
C74 C75 C76 118.6(9) . . ?
C74 C75 H75A 120.7 . . ?
C76 C75 H75A 120.7 . . ?
C77 C76 C75 123.3(9) . . ?
C77 C76 N14 118.4(12) . . ?
C75 C76 N14 118.4(11) . . ?
C76 C77 C78 118.4(11) . . ?
C76 C77 H77A 120.8 . . ?
C78 C77 H77A 120.8 . . ?
C77 C78 C73 118.4(9) . . ?
C77 C78 H78A 120.8 . . ?
C73 C78 H78A 120.8 . . ?
O41 P4 O42 121.0(3) . . ?
O41 P4 O44 105.8(3) . . ?
O42 P4 O44 110.1(4) . . ?
O41 P4 O43 110.6(3) . . ?
O42 P4 O43 105.0(3) . . ?
O44 P4 O43 103.1(3) . . ?
C79 O43 P4 122.2(5) . . ?
C85 O44 P4 125.4(5) . . ?
O46 N15 O45 118.3(9) . . ?
O46 N15 C82 126.3(10) . . ?
O45 N15 C82 115.3(10) . . ?
O48 N16 O47 125.2(9) . . ?
O48 N16 C88 118.7(9) . . ?
O47 N16 C88 116.0(9) . . ?
C84 C79 O43 118.9(7) . . ?
C84 C79 C80 120.6(8) . . ?
O43 C79 C80 120.4(7) . . ?
C81 C80 C79 122.0(9) . . ?
C81 C80 H80A 119.0 . . ?
C79 C80 H80A 119.0 . . ?
C80 C81 C82 115.7(8) . . ?
C80 C81 H81A 122.2 . . ?
C82 C81 H81A 122.2 . . ?
C83 C82 C81 124.2(8) . . ?
C83 C82 N15 115.9(9) . . ?
C81 C82 N15 119.8(8) . . ?
C82 C83 C84 117.9(8) . . ?
C82 C83 H83A 121.0 . . ?
C84 C83 H83A 121.0 . . ?
C79 C84 C83 119.6(8) . . ?
C79 C84 H84A 120.2 . . ?
C83 C84 H84A 120.2 . . ?
O44 C85 C90 123.2(8) . . ?
O44 C85 C86 116.3(7) . . ?
C90 C85 C86 120.5(8) . . ?
C85 C86 C87 119.7(9) . . ?
C85 C86 H86A 120.1 . . ?
C87 C86 H86A 120.1 . . ?
C88 C87 C86 119.3(10) . . ?
C88 C87 H87A 120.3 . . ?
C86 C87 H87A 120.3 . . ?
C87 C88 C89 120.9(8) . . ?
C87 C88 N16 119.9(9) . . ?
C89 C88 N16 119.2(8) . . ?
C90 C89 C88 119.5(8) . . ?
C90 C89 H89A 120.3 . . ?
C88 C89 H89A 120.3 . . ?
C89 C90 C85 120.0(9) . . ?
C89 C90 H90A 120.0 . . ?
C85 C90 H90A 120.0 . . ?
H49A O49 H49B 93.9 . . ?
H50A O50 H50B 90.6 . . ?
H51A O51 H51B 96.4 . . ?
H52A O52 H52B 94.2 . . ?
C91' O53 H53A 117.8 . . ?
C91 O53 H53A 120.1 . . ?
O53 C91 C92 110.1(11) . . ?
O53 C91 C93 107.6(11) . . ?
C92 C91 C93 96.7(13) . . ?
O53 C91 H91 113.7 . . ?
C92 C91 H91 113.7 . . ?
C93 C91 H91 113.7 . . ?
C91 C92 H92A 109.5 . . ?
C91 C92 H92B 109.5 . . ?
H92A C92 H92B 109.5 . . ?
C91 C92 H92C 109.5 . . ?
H92A C92 H92C 109.5 . . ?
H92B C92 H92C 109.5 . . ?
C91 C93 H93A 109.5 . . ?
C91 C93 H93B 109.5 . . ?
H93A C93 H93B 109.5 . . ?
C91 C93 H93C 109.5 . . ?
H93A C93 H93C 109.5 . . ?
H93B C93 H93C 109.5 . . ?
O53 C91' C92' 108.7(11) . . ?
O53 C91' C93' 108.8(11) . . ?
C92' C91' C93' 97.9(13) . . ?
O53 C91' H91' 113.4 . . ?
C92' C91' H91' 113.4 . . ?
C93' C91' H91' 113.4 . . ?
C91' C92' H92D 109.5 . . ?
C91' C92' H92E 109.5 . . ?
H92D C92' H92E 109.5 . . ?
C91' C92' H92F 109.5 . . ?
H92D C92' H92F 109.5 . . ?
H92E C92' H92F 109.5 . . ?
C91' C93' H93D 109.5 . . ?
C91' C93' H93E 109.5 . . ?
H93D C93' H93E 109.5 . . ?
C91' C93' H93F 109.5 . . ?
H93D C93' H93F 109.5 . . ?
H93E C93' H93F 109.5 . . ?
C94 O54 H54A 130.2 . . ?
C94' O54 H54A 106.9 . . ?
O54 C94 C95 109.2(9) . . ?
O54 C94 C96 105.9(10) . . ?
C95 C94 C96 99.7(12) . . ?
O54 C94 H94 113.6 . . ?
C95 C94 H94 113.6 . . ?
C96 C94 H94 113.6 . . ?
C94 C95 H95A 109.5 . . ?
C94 C95 H95B 109.5 . . ?
H95A C95 H95B 109.5 . . ?
C94 C95 H95C 109.5 . . ?
H95A C95 H95C 109.5 . . ?
H95B C95 H95C 109.5 . . ?
C94 C96 H96A 109.5 . . ?
C94 C96 H96B 109.5 . . ?
H96A C96 H96B 109.5 . . ?
C94 C96 H96C 109.5 . . ?
H96A C96 H96C 109.5 . . ?
H96B C96 H96C 109.5 . . ?
O54 C94' C95' 107.8(10) . . ?
O54 C94' C96' 106.2(10) . . ?
C95' C94' C96' 100.1(12) . . ?
O54 C94' H94' 113.9 . . ?
C95' C94' H94' 113.9 . . ?
C96' C94' H94' 113.9 . . ?
C94' C95' H95D 109.5 . . ?
C94' C95' H95E 109.5 . . ?
H95D C95' H95E 109.5 . . ?
C94' C95' H95F 109.5 . . ?
H95D C95' H95F 109.5 . . ?
H95E C95' H95F 109.5 . . ?
C94' C96' H96D 109.5 . . ?
C94' C96' H96E 109.5 . . ?
H96D C96' H96E 109.5 . . ?
C94' C96' H96F 109.5 . . ?
H96D C96' H96F 109.5 . . ?
H96E C96' H96F 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
Eu1 O3 2.373(6) . ?
Eu1 O1 2.386(5) . ?
Eu1 O2 2.422(5) . ?
Eu1 O4 2.423(4) . ?
Eu1 O9 2.450(5) . ?
Eu1 N4 2.612(6) . ?
Eu1 N3 2.671(7) . ?
Eu1 N2 2.676(6) . ?
Eu1 N1 2.711(7) . ?
O1 C10 1.428(8) . ?
O1 H1A 0.8400 . ?
O2 C13 1.442(10) . ?
O2 H2A 0.8400 . ?
O3 C16 1.456(9) . ?
O3 H3A 0.8399 . ?
O4 C19 1.459(8) . ?
O4 H4A 0.8401 . ?
O9 H9A 0.8399 . ?
O9 H9B 0.8401 . ?
N1 C1 1.474(9) . ?
N1 C9 1.485(10) . ?
N1 C8 1.497(9) . ?
N2 C12 1.482(10) . ?
N2 C3 1.486(11) . ?
N2 C2 1.500(11) . ?
N3 C5 1.484(10) . ?
N3 C4 1.485(11) . ?
N3 C15 1.503(11) . ?
N4 C6 1.486(9) . ?
N4 C7 1.490(10) . ?
N4 C18 1.501(9) . ?
C1 C2 1.495(11) . ?
C1 H1B 0.9900 . ?
C1 H1C 0.9900 . ?
C2 H2B 0.9900 . ?
C2 H2C 0.9900 . ?
C3 C4 1.494(12) . ?
C3 H3B 0.9900 . ?
C3 H3C 0.9900 . ?
C4 H4B 0.9900 . ?
C4 H4C 0.9900 . ?
C5 C6 1.523(12) . ?
C5 H5B 0.9900 . ?
C5 H5C 0.9900 . ?
C6 H6B 0.9900 . ?
C6 H6C 0.9900 . ?
C7 C8 1.498(10) . ?
C7 H7B 0.9900 . ?
C7 H7C 0.9900 . ?
C8 H8B 0.9900 . ?
C8 H8C 0.9900 . ?
C9 C10 1.531(10) . ?
C9 H9C 0.9900 . ?
C9 H9D 0.9900 . ?
C10 C11 1.498(10) . ?
C10 H10C 1.0000 . ?
C11 H11A 0.9800 . ?
C11 H11B 0.9800 . ?
C11 H11C 0.9800 . ?
C12 C13 1.499(13) . ?
C12 H12A 0.9900 . ?
C12 H12B 0.9900 . ?
C13 C14 1.503(12) . ?
C13 H13A 1.0000 . ?
C14 H14A 0.9800 . ?
C14 H14B 0.9800 . ?
C14 H14C 0.9800 . ?
C15 C16 1.497(13) . ?
C15 H15A 0.9900 . ?
C15 H15B 0.9900 . ?
C16 C17 1.509(12) . ?
C16 H16A 1.0000 . ?
C17 H17A 0.9800 . ?
C17 H17B 0.9800 . ?
C17 H17C 0.9800 . ?
C18 C19 1.520(10) . ?
C18 H18A 0.9900 . ?
C18 H18B 0.9900 . ?
C19 C20 1.510(11) . ?
C19 H19A 1.0000 . ?
C20 H20A 0.9800 . ?
C20 H20B 0.9800 . ?
C20 H20C 0.9800 . ?
Eu2 O7 2.373(5) . ?
Eu2 O5 2.402(5) . ?
Eu2 O6 2.405(5) . ?
Eu2 O10 2.456(5) . ?
Eu2 O8 2.466(5) . ?
Eu2 N7 2.628(7) . ?
Eu2 N8 2.639(8) . ?
Eu2 N6 2.674(7) . ?
Eu2 N5 2.709(7) . ?
O5 C30 1.442(10) . ?
O5 H5A 0.8399 . ?
O6 C33 1.454(9) . ?
O6 H6A 0.8399 . ?
O7 C36 1.457(8) . ?
O7 H7A 0.8400 . ?
O8 C39 1.441(9) . ?
O8 H8A 0.8400 . ?
O10 H10A 0.8400 . ?
O10 H10B 0.8401 . ?
N5 C21 1.473(12) . ?
N5 C29 1.477(11) . ?
N5 C28 1.480(11) . ?
N6 C22 1.461(11) . ?
N6 C32 1.484(10) . ?
N6 C23 1.485(10) . ?
N7 C35 1.471(9) . ?
N7 C24 1.498(9) . ?
N7 C25 1.508(10) . ?
N8 C27 1.471(11) . ?
N8 C38 1.475(12) . ?
N8 C26 1.480(10) . ?
C21 C22 1.496(13) . ?
C21 H21A 0.9900 . ?
C21 H21B 0.9900 . ?
C22 H22A 0.9900 . ?
C22 H22B 0.9900 . ?
C23 C24 1.510(11) . ?
C23 H23A 0.9900 . ?
C23 H23B 0.9900 . ?
C24 H24A 0.9900 . ?
C24 H24B 0.9900 . ?
C25 C26 1.498(12) . ?
C25 H25A 0.9900 . ?
C25 H25B 0.9900 . ?
C26 H26A 0.9900 . ?
C26 H26B 0.9900 . ?
C27 C28 1.518(14) . ?
C27 H27A 0.9900 . ?
C27 H27B 0.9900 . ?
C28 H28A 0.9900 . ?
C28 H28B 0.9900 . ?
C29 C30 1.510(12) . ?
C29 H29A 0.9900 . ?
C29 H29B 0.9900 . ?
C30 C31 1.532(14) . ?
C30 H30A 1.0000 . ?
C31 H31A 0.9800 . ?
C31 H31B 0.9800 . ?
C31 H31C 0.9800 . ?
C32 C33 1.506(12) . ?
C32 H32A 0.9900 . ?
C32 H32B 0.9900 . ?
C33 C34 1.488(11) . ?
C33 H33A 1.0000 . ?
C34 H34A 0.9800 . ?
C34 H34B 0.9800 . ?
C34 H34C 0.9800 . ?
C35 C36 1.491(9) . ?
C35 H35A 0.9900 . ?
C35 H35B 0.9900 . ?
C36 C37 1.526(11) . ?
C36 H36A 1.0000 . ?
C37 H37A 0.9800 . ?
C37 H37B 0.9800 . ?
C37 H37C 0.9800 . ?
C38 C39 1.506(11) . ?
C38 H38A 0.9900 . ?
C38 H38B 0.9900 . ?
C39 C40 1.521(13) . ?
C39 H39A 1.0000 . ?
C40 H40A 0.9800 . ?
C40 H40B 0.9800 . ?
C40 H40C 0.9800 . ?
S1 O12 1.437(5) . ?
S1 O11 1.438(6) . ?
S1 O13 1.444(5) . ?
S1 C41 1.828(9) . ?
C41 F2 1.309(9) . ?
C41 F1 1.338(10) . ?
C41 F3 1.341(10) . ?
S2 O16 1.417(6) . ?
S2 O14 1.419(7) . ?
S2 O15 1.461(6) . ?
S2 C42 1.790(9) . ?
C42 F5 1.324(11) . ?
C42 F6 1.336(10) . ?
C42 F4 1.338(13) . ?
P1 O17 1.464(7) . ?
P1 O18 1.476(6) . ?
P1 O20 1.602(6) . ?
P1 O19 1.616(5) . ?
O19 C43 1.382(9) . ?
O20 C49 1.394(11) . ?
O21 N9 1.168(12) . ?
O22 N9 1.321(12) . ?
O23 N10 1.263(12) . ?
O24 N10 1.239(13) . ?
N9 C46 1.482(11) . ?
N10 C52 1.490(13) . ?
C43 C48 1.355(12) . ?
C43 C44 1.371(12) . ?
C44 C45 1.387(14) . ?
C44 H44A 0.9500 . ?
C45 C46 1.329(14) . ?
C45 H45A 0.9500 . ?
C46 C47 1.382(14) . ?
C47 C48 1.391(12) . ?
C47 H47A 0.9500 . ?
C48 H48A 0.9500 . ?
C49 C50 1.362(13) . ?
C49 C54 1.397(13) . ?
C50 C51 1.401(13) . ?
C50 H50C 0.9500 . ?
C51 C52 1.313(15) . ?
C51 H51C 0.9500 . ?
C52 C53 1.390(15) . ?
C53 C54 1.366(14) . ?
C53 H53B 0.9500 . ?
C54 H54B 0.9500 . ?
P2 O26 1.472(6) . ?
P2 O25 1.483(7) . ?
P2 O27 1.603(6) . ?
P2 O28 1.613(6) . ?
O27 C55 1.389(9) . ?
O28 C61 1.371(10) . ?
O29 N11 1.239(9) . ?
O30 N11 1.228(11) . ?
O31 N12 1.162(14) . ?
O32 N12 1.259(15) . ?
N11 C58 1.472(10) . ?
N12 C64 1.505(14) . ?
C55 C56 1.369(10) . ?
C55 C60 1.383(11) . ?
C56 C57 1.365(11) . ?
C56 H56A 0.9500 . ?
C57 C58 1.371(12) . ?
C57 H57A 0.9500 . ?
C58 C59 1.374(11) . ?
C59 C60 1.368(11) . ?
C59 H59A 0.9500 . ?
C60 H60A 0.9500 . ?
C61 C66 1.363(13) . ?
C61 C62 1.400(14) . ?
C62 C63 1.361(12) . ?
C62 H62A 0.9500 . ?
C63 C64 1.334(15) . ?
C63 H63A 0.9500 . ?
C64 C65 1.331(17) . ?
C65 C66 1.414(15) . ?
C65 H65A 0.9500 . ?
C66 H66A 0.9500 . ?
P3 O34 1.477(5) . ?
P3 O33 1.478(5) . ?
P3 O35 1.603(5) . ?
P3 O36 1.611(6) . ?
O35 C67 1.383(9) . ?
O36 C73 1.372(10) . ?
O37 N13 1.225(9) . ?
O38 N13 1.218(10) . ?
O39 N14 1.211(16) . ?
O40 N14 1.218(16) . ?
N13 C70 1.459(10) . ?
N14 C76 1.456(14) . ?
C67 C72 1.372(10) . ?
C67 C68 1.389(10) . ?
C68 C69 1.375(11) . ?
C68 H68A 0.9500 . ?
C69 C70 1.385(12) . ?
C69 H69A 0.9500 . ?
C70 C71 1.379(10) . ?
C71 C72 1.396(10) . ?
C71 H71A 0.9500 . ?
C72 H72A 0.9500 . ?
C73 C74 1.394(11) . ?
C73 C78 1.396(12) . ?
C74 C75 1.358(14) . ?
C74 H74A 0.9500 . ?
C75 C76 1.391(17) . ?
C75 H75A 0.9500 . ?
C76 C77 1.375(15) . ?
C77 C78 1.382(13) . ?
C77 H77A 0.9500 . ?
C78 H78A 0.9500 . ?
P4 O41 1.462(6) . ?
P4 O42 1.487(6) . ?
P4 O44 1.603(6) . ?
P4 O43 1.605(6) . ?
O43 C79 1.385(9) . ?
O44 C85 1.382(9) . ?
O45 N15 1.275(12) . ?
O46 N15 1.134(13) . ?
O47 N16 1.246(10) . ?
O48 N16 1.203(11) . ?
N15 C82 1.455(11) . ?
N16 C88 1.454(11) . ?
C79 C84 1.354(11) . ?
C79 C80 1.404(11) . ?
C80 C81 1.351(13) . ?
C80 H80A 0.9500 . ?
C81 C82 1.404(13) . ?
C81 H81A 0.9500 . ?
C82 C83 1.363(11) . ?
C83 C84 1.397(12) . ?
C83 H83A 0.9500 . ?
C84 H84A 0.9500 . ?
C85 C90 1.384(11) . ?
C85 C86 1.385(12) . ?
C86 C87 1.385(13) . ?
C86 H86A 0.9500 . ?
C87 C88 1.372(12) . ?
C87 H87A 0.9500 . ?
C88 C89 1.398(13) . ?
C89 C90 1.363(12) . ?
C89 H89A 0.9500 . ?
C90 H90A 0.9500 . ?
O49 H49A 0.8399 . ?
O49 H49B 0.8399 . ?
O50 H50A 0.8399 . ?
O50 H50B 0.8400 . ?
O51 H51A 0.8401 . ?
O51 H51B 0.8401 . ?
O52 H52A 0.8400 . ?
O52 H52B 0.8399 . ?
O53 C91' 1.455(11) . ?
O53 C91 1.457(11) . ?
O53 H53A 0.8400 . ?
C91 C92 1.525(11) . ?
C91 C93 1.537(11) . ?
C91 H91 1.0000 . ?
C92 H92A 0.9800 . ?
C92 H92B 0.9800 . ?
C92 H92C 0.9800 . ?
C93 H93A 0.9800 . ?
C93 H93B 0.9800 . ?
C93 H93C 0.9800 . ?
C91' C92' 1.520(11) . ?
C91' C93' 1.534(11) . ?
C91' H91' 1.0000 . ?
C92' H92D 0.9800 . ?
C92' H92E 0.9800 . ?
C92' H92F 0.9800 . ?
C93' H93D 0.9800 . ?
C93' H93E 0.9800 . ?
C93' H93F 0.9800 . ?
O54 C94 1.455(10) . ?
O54 C94' 1.457(11) . ?
O54 H54A 0.8400 . ?
C94 C95 1.523(11) . ?
C94 C96 1.528(11) . ?
C94 H94 1.0000 . ?
C95 H95A 0.9800 . ?
C95 H95B 0.9800 . ?
C95 H95C 0.9800 . ?
C96 H96A 0.9800 . ?
C96 H96B 0.9800 . ?
C96 H96C 0.9800 . ?
C94' C95' 1.523(11) . ?
C94' C96' 1.525(11) . ?
C94' H94' 1.0000 . ?
C95' H95D 0.9800 . ?
C95' H95E 0.9800 . ?
C95' H95F 0.9800 . ?
C96' H96D 0.9800 . ?
C96' H96E 0.9800 . ?
C96' H96F 0.9800 . ?
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
O1 H1A O49 0.84 1.84 2.677(7) 179.7 .
O2 H2A O18 0.84 1.79 2.635(8) 179.7 .
O3 H3A O53 0.84 1.79 2.633(9) 179.6 .
O4 H4A O25 0.84 1.84 2.682(8) 179.6 .
O9 H9A O18 0.84 1.91 2.683(8) 152.6 .
O9 H9B O25 0.84 1.98 2.744(8) 151.3 .
O5 H5A O51 0.84 1.79 2.626(8) 179.2 .
O6 H6A O33 0.84 1.77 2.612(7) 179.8 .
O7 H7A O54 0.84 1.76 2.602(8) 179.5 .
O8 H8A O42 0.84 1.87 2.708(8) 179.5 .
O10 H10A O33 0.84 2.01 2.776(8) 150.4 .
O10 H10B O42 0.84 1.91 2.695(8) 155.1 .
O49 H49A O17 0.84 2.06 2.898(8) 179.5 .
O49 H49B O26 0.84 1.82 2.656(8) 179.4 .
O50 H50A O17 0.84 2.02 2.857(9) 179.3 .
O50 H50B O26 0.84 2.03 2.874(8) 179.3 .
O51 H51A O34 0.84 1.94 2.777(8) 179.4 .
O51 H51B O41 0.84 1.98 2.819(8) 179.8 .
O52 H52A O34 0.84 2.00 2.838(7) 179.7 .
O52 H52B O41 0.84 2.02 2.857(8) 179.4 .
O53 H53A O50 0.84 1.90 2.738(9) 179.6 1_545
O54 H54A O52 0.84 1.78 2.619(8) 179.3 1_565
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
O3 Eu1 O1 C10 145.8(5) . . . . ?
O2 Eu1 O1 C10 -146.5(5) . . . . ?
O4 Eu1 O1 C10 71.1(5) . . . . ?
O9 Eu1 O1 C10 139.8(5) . . . . ?
N4 Eu1 O1 C10 18.9(6) . . . . ?
N3 Eu1 O1 C10 -81.4(6) . . . . ?
N2 Eu1 O1 C10 -84.2(5) . . . . ?
N1 Eu1 O1 C10 -19.6(5) . . . . ?
O3 Eu1 O2 C13 -150.7(6) . . . . ?
O1 Eu1 O2 C13 68.1(6) . . . . ?
O4 Eu1 O2 C13 132.9(5) . . . . ?
O9 Eu1 O2 C13 141.6(6) . . . . ?
N4 Eu1 O2 C13 -79.0(8) . . . . ?
N3 Eu1 O2 C13 -87.5(6) . . . . ?
N2 Eu1 O2 C13 -22.9(6) . . . . ?
N1 Eu1 O2 C13 14.9(6) . . . . ?
O1 Eu1 O3 C16 140.2(5) . . . . ?
O2 Eu1 O3 C16 73.2(6) . . . . ?
O4 Eu1 O3 C16 -147.3(6) . . . . ?
O9 Eu1 O3 C16 146.3(6) . . . . ?
N4 Eu1 O3 C16 -84.2(6) . . . . ?
N3 Eu1 O3 C16 -17.9(5) . . . . ?
N2 Eu1 O3 C16 20.5(6) . . . . ?
N1 Eu1 O3 C16 -73.6(7) . . . . ?
O3 Eu1 O4 C19 66.7(5) . . . . ?
O1 Eu1 O4 C19 -153.7(5) . . . . ?
O2 Eu1 O4 C19 141.6(5) . . . . ?
O9 Eu1 O4 C19 132.6(6) . . . . ?
N4 Eu1 O4 C19 -24.5(5) . . . . ?
N3 Eu1 O4 C19 11.8(6) . . . . ?
N2 Eu1 O4 C19 -89.7(6) . . . . ?
N1 Eu1 O4 C19 -90.4(5) . . . . ?
O3 Eu1 N1 C1 121.4(5) . . . . ?
O1 Eu1 N1 C1 -83.3(5) . . . . ?
O2 Eu1 N1 C1 -21.0(5) . . . . ?
O4 Eu1 N1 C1 -164.9(5) . . . . ?
O9 Eu1 N1 C1 -109.2(5) . . . . ?
N4 Eu1 N1 C1 132.9(5) . . . . ?
N3 Eu1 N1 C1 72.5(5) . . . . ?
N2 Eu1 N1 C1 15.5(4) . . . . ?
O3 Eu1 N1 C9 -119.0(5) . . . . ?
O1 Eu1 N1 C9 36.3(4) . . . . ?
O2 Eu1 N1 C9 98.6(4) . . . . ?
O4 Eu1 N1 C9 -45.2(4) . . . . ?
O9 Eu1 N1 C9 10.4(5) . . . . ?
N4 Eu1 N1 C9 -107.5(4) . . . . ?
N3 Eu1 N1 C9 -167.9(4) . . . . ?
N2 Eu1 N1 C9 135.1(5) . . . . ?
O3 Eu1 N1 C8 -2.5(7) . . . . ?
O1 Eu1 N1 C8 152.7(5) . . . . ?
O2 Eu1 N1 C8 -144.9(4) . . . . ?
O4 Eu1 N1 C8 71.2(5) . . . . ?
O9 Eu1 N1 C8 126.8(4) . . . . ?
N4 Eu1 N1 C8 9.0(4) . . . . ?
N3 Eu1 N1 C8 -51.4(5) . . . . ?
N2 Eu1 N1 C8 -108.4(5) . . . . ?
O3 Eu1 N2 C12 101.2(5) . . . . ?
O1 Eu1 N2 C12 -43.0(5) . . . . ?
O2 Eu1 N2 C12 38.2(5) . . . . ?
O4 Eu1 N2 C12 -105.7(6) . . . . ?
O9 Eu1 N2 C12 18.5(6) . . . . ?
N4 Eu1 N2 C12 -162.0(5) . . . . ?
N3 Eu1 N2 C12 138.4(6) . . . . ?
N1 Eu1 N2 C12 -105.0(6) . . . . ?
O3 Eu1 N2 C3 -18.1(6) . . . . ?
O1 Eu1 N2 C3 -162.3(5) . . . . ?
O2 Eu1 N2 C3 -81.2(5) . . . . ?
O4 Eu1 N2 C3 134.9(5) . . . . ?
O9 Eu1 N2 C3 -100.9(5) . . . . ?
N4 Eu1 N2 C3 78.6(5) . . . . ?
N3 Eu1 N2 C3 19.1(5) . . . . ?
N1 Eu1 N2 C3 135.6(6) . . . . ?
O3 Eu1 N2 C2 -140.3(5) . . . . ?
O1 Eu1 N2 C2 75.5(5) . . . . ?
O2 Eu1 N2 C2 156.7(5) . . . . ?
O4 Eu1 N2 C2 12.7(7) . . . . ?
O9 Eu1 N2 C2 137.0(4) . . . . ?
N4 Eu1 N2 C2 -43.5(5) . . . . ?
N3 Eu1 N2 C2 -103.1(5) . . . . ?
N1 Eu1 N2 C2 13.5(4) . . . . ?
O3 Eu1 N3 C5 -82.9(6) . . . . ?
O1 Eu1 N3 C5 130.7(5) . . . . ?
O2 Eu1 N3 C5 -165.7(6) . . . . ?
O4 Eu1 N3 C5 -16.5(6) . . . . ?
O9 Eu1 N3 C5 -101.1(6) . . . . ?
N4 Eu1 N3 C5 18.1(5) . . . . ?
N2 Eu1 N3 C5 133.8(6) . . . . ?
N1 Eu1 N3 C5 77.2(6) . . . . ?
O3 Eu1 N3 C4 154.2(6) . . . . ?
O1 Eu1 N3 C4 7.7(8) . . . . ?
O2 Eu1 N3 C4 71.3(5) . . . . ?
O4 Eu1 N3 C4 -139.5(5) . . . . ?
O9 Eu1 N3 C4 135.9(5) . . . . ?
N4 Eu1 N3 C4 -104.9(5) . . . . ?
N2 Eu1 N3 C4 10.8(5) . . . . ?
N1 Eu1 N3 C4 -45.8(5) . . . . ?
O3 Eu1 N3 C15 34.3(5) . . . . ?
O1 Eu1 N3 C15 -112.2(6) . . . . ?
O2 Eu1 N3 C15 -48.5(5) . . . . ?
O4 Eu1 N3 C15 100.6(5) . . . . ?
O9 Eu1 N3 C15 16.0(6) . . . . ?
N4 Eu1 N3 C15 135.2(5) . . . . ?
N2 Eu1 N3 C15 -109.1(5) . . . . ?
N1 Eu1 N3 C15 -165.7(5) . . . . ?
O3 Eu1 N4 C6 72.4(5) . . . . ?
O1 Eu1 N4 C6 -140.1(4) . . . . ?
O2 Eu1 N4 C6 2.1(8) . . . . ?
O4 Eu1 N4 C6 158.9(5) . . . . ?
O9 Eu1 N4 C6 132.8(4) . . . . ?
N3 Eu1 N4 C6 11.3(5) . . . . ?
N2 Eu1 N4 C6 -46.7(5) . . . . ?
N1 Eu1 N4 C6 -103.0(5) . . . . ?
O3 Eu1 N4 C7 -165.4(5) . . . . ?
O1 Eu1 N4 C7 -17.9(5) . . . . ?
O2 Eu1 N4 C7 124.3(6) . . . . ?
O4 Eu1 N4 C7 -78.9(5) . . . . ?
O9 Eu1 N4 C7 -105.0(5) . . . . ?
N3 Eu1 N4 C7 133.5(5) . . . . ?
N2 Eu1 N4 C7 75.4(5) . . . . ?
N1 Eu1 N4 C7 19.2(4) . . . . ?
O3 Eu1 N4 C18 -46.2(4) . . . . ?
O1 Eu1 N4 C18 101.3(4) . . . . ?
O2 Eu1 N4 C18 -116.5(5) . . . . ?
O4 Eu1 N4 C18 40.3(4) . . . . ?
O9 Eu1 N4 C18 14.2(5) . . . . ?
N3 Eu1 N4 C18 -107.3(4) . . . . ?
N2 Eu1 N4 C18 -165.3(4) . . . . ?
N1 Eu1 N4 C18 138.5(4) . . . . ?
C9 N1 C1 C2 -159.5(6) . . . . ?
C8 N1 C1 C2 81.9(8) . . . . ?
Eu1 N1 C1 C2 -43.5(7) . . . . ?
N1 C1 C2 N2 58.2(8) . . . . ?
C12 N2 C2 C1 75.2(8) . . . . ?
C3 N2 C2 C1 -165.5(6) . . . . ?
Eu1 N2 C2 C1 -42.1(7) . . . . ?
C12 N2 C3 C4 -165.2(7) . . . . ?
C2 N2 C3 C4 76.6(9) . . . . ?
Eu1 N2 C3 C4 -48.1(9) . . . . ?
C5 N3 C4 C3 -162.7(8) . . . . ?
C15 N3 C4 C3 77.1(9) . . . . ?
Eu1 N3 C4 C3 -40.3(8) . . . . ?
N2 C3 C4 N3 60.6(10) . . . . ?
C4 N3 C5 C6 78.7(8) . . . . ?
C15 N3 C5 C6 -160.7(7) . . . . ?
Eu1 N3 C5 C6 -45.8(8) . . . . ?
C7 N4 C6 C5 -165.1(6) . . . . ?
C18 N4 C6 C5 74.9(8) . . . . ?
Eu1 N4 C6 C5 -40.6(7) . . . . ?
N3 C5 C6 N4 60.4(9) . . . . ?
C6 N4 C7 C8 76.5(7) . . . . ?
C18 N4 C7 C8 -163.5(6) . . . . ?
Eu1 N4 C7 C8 -47.4(7) . . . . ?
C1 N1 C8 C7 -162.2(6) . . . . ?
C9 N1 C8 C7 77.8(8) . . . . ?
Eu1 N1 C8 C7 -36.3(7) . . . . ?
N4 C7 C8 N1 57.0(8) . . . . ?
C1 N1 C9 C10 66.8(8) . . . . ?
C8 N1 C9 C10 -173.7(6) . . . . ?
Eu1 N1 C9 C10 -54.5(6) . . . . ?
Eu1 O1 C10 C11 -123.2(6) . . . . ?
Eu1 O1 C10 C9 -2.2(7) . . . . ?
N1 C9 C10 O1 41.1(7) . . . . ?
N1 C9 C10 C11 163.6(6) . . . . ?
C3 N2 C12 C13 65.0(9) . . . . ?
C2 N2 C12 C13 -176.5(6) . . . . ?
Eu1 N2 C12 C13 -55.0(7) . . . . ?
Eu1 O2 C13 C12 2.0(9) . . . . ?
Eu1 O2 C13 C14 -120.7(7) . . . . ?
N2 C12 C13 O2 37.7(9) . . . . ?
N2 C12 C13 C14 159.1(7) . . . . ?
C5 N3 C15 C16 63.7(9) . . . . ?
C4 N3 C15 C16 -175.3(7) . . . . ?
Eu1 N3 C15 C16 -53.6(8) . . . . ?
Eu1 O3 C16 C15 -3.9(8) . . . . ?
Eu1 O3 C16 C17 -123.0(7) . . . . ?
N3 C15 C16 O3 40.2(9) . . . . ?
N3 C15 C16 C17 159.7(8) . . . . ?
C6 N4 C18 C19 -179.1(6) . . . . ?
C7 N4 C18 C19 61.7(7) . . . . ?
Eu1 N4 C18 C19 -59.4(6) . . . . ?
Eu1 O4 C19 C20 -118.8(6) . . . . ?
Eu1 O4 C19 C18 1.7(8) . . . . ?
N4 C18 C19 O4 40.2(7) . . . . ?
N4 C18 C19 C20 160.2(6) . . . . ?
O7 Eu2 O5 C30 147.6(7) . . . . ?
O6 Eu2 O5 C30 -143.0(7) . . . . ?
O10 Eu2 O5 C30 144.6(8) . . . . ?
O8 Eu2 O5 C30 74.6(7) . . . . ?
N7 Eu2 O5 C30 -77.1(9) . . . . ?
N8 Eu2 O5 C30 23.6(8) . . . . ?
N6 Eu2 O5 C30 -80.2(7) . . . . ?
N5 Eu2 O5 C30 -17.0(7) . . . . ?
O7 Eu2 O6 C33 -148.5(6) . . . . ?
O5 Eu2 O6 C33 72.2(5) . . . . ?
O10 Eu2 O6 C33 143.5(6) . . . . ?
O8 Eu2 O6 C33 137.1(5) . . . . ?
N7 Eu2 O6 C33 -85.4(6) . . . . ?
N8 Eu2 O6 C33 -78.9(7) . . . . ?
N6 Eu2 O6 C33 -19.9(5) . . . . ?
N5 Eu2 O6 C33 17.3(6) . . . . ?
O5 Eu2 O7 C36 140.9(6) . . . . ?
O6 Eu2 O7 C36 70.8(6) . . . . ?
O10 Eu2 O7 C36 144.0(6) . . . . ?
O8 Eu2 O7 C36 -148.9(6) . . . . ?
N7 Eu2 O7 C36 -19.9(6) . . . . ?
N8 Eu2 O7 C36 -86.0(6) . . . . ?
N6 Eu2 O7 C36 18.4(7) . . . . ?
N5 Eu2 O7 C36 -76.0(8) . . . . ?
O7 Eu2 O8 C39 67.8(6) . . . . ?
O5 Eu2 O8 C39 -153.5(6) . . . . ?
O6 Eu2 O8 C39 140.2(6) . . . . ?
O10 Eu2 O8 C39 133.8(6) . . . . ?
N7 Eu2 O8 C39 13.1(7) . . . . ?
N8 Eu2 O8 C39 -23.6(6) . . . . ?
N6 Eu2 O8 C39 -87.8(7) . . . . ?
N5 Eu2 O8 C39 -90.0(6) . . . . ?
O7 Eu2 N5 C21 122.3(6) . . . . ?
O5 Eu2 N5 C21 -85.3(5) . . . . ?
O6 Eu2 N5 C21 -20.0(6) . . . . ?
O10 Eu2 N5 C21 -108.1(5) . . . . ?
O8 Eu2 N5 C21 -164.9(5) . . . . ?
N7 Eu2 N5 C21 73.0(5) . . . . ?
N8 Eu2 N5 C21 133.1(6) . . . . ?
N6 Eu2 N5 C21 16.3(5) . . . . ?
O7 Eu2 N5 C29 -118.2(6) . . . . ?
O5 Eu2 N5 C29 34.3(6) . . . . ?
O6 Eu2 N5 C29 99.6(6) . . . . ?
O10 Eu2 N5 C29 11.4(7) . . . . ?
O8 Eu2 N5 C29 -45.3(6) . . . . ?
N7 Eu2 N5 C29 -167.5(6) . . . . ?
N8 Eu2 N5 C29 -107.4(6) . . . . ?
N6 Eu2 N5 C29 135.8(7) . . . . ?
O7 Eu2 N5 C28 0.4(10) . . . . ?
O5 Eu2 N5 C28 152.8(7) . . . . ?
O6 Eu2 N5 C28 -141.9(6) . . . . ?
O10 Eu2 N5 C28 130.0(6) . . . . ?
O8 Eu2 N5 C28 73.2(6) . . . . ?
N7 Eu2 N5 C28 -48.9(6) . . . . ?
N8 Eu2 N5 C28 11.2(6) . . . . ?
N6 Eu2 N5 C28 -105.6(6) . . . . ?
O7 Eu2 N6 C22 -142.2(5) . . . . ?
O5 Eu2 N6 C22 73.3(5) . . . . ?
O6 Eu2 N6 C22 156.2(6) . . . . ?
O10 Eu2 N6 C22 135.1(5) . . . . ?
O8 Eu2 N6 C22 9.8(8) . . . . ?
N7 Eu2 N6 C22 -105.3(5) . . . . ?
N8 Eu2 N6 C22 -45.5(5) . . . . ?
N5 Eu2 N6 C22 12.2(5) . . . . ?
O7 Eu2 N6 C32 97.6(5) . . . . ?
O5 Eu2 N6 C32 -46.9(5) . . . . ?
O6 Eu2 N6 C32 35.9(5) . . . . ?
O10 Eu2 N6 C32 14.8(6) . . . . ?
O8 Eu2 N6 C32 -110.5(6) . . . . ?
N7 Eu2 N6 C32 134.5(5) . . . . ?
N8 Eu2 N6 C32 -165.8(5) . . . . ?
N5 Eu2 N6 C32 -108.0(5) . . . . ?
O7 Eu2 N6 C23 -18.9(6) . . . . ?
O5 Eu2 N6 C23 -163.4(5) . . . . ?
O6 Eu2 N6 C23 -80.5(5) . . . . ?
O10 Eu2 N6 C23 -101.6(5) . . . . ?
O8 Eu2 N6 C23 133.1(5) . . . . ?
N7 Eu2 N6 C23 18.0(5) . . . . ?
N8 Eu2 N6 C23 77.8(5) . . . . ?
N5 Eu2 N6 C23 135.5(6) . . . . ?
O7 Eu2 N7 C35 34.6(4) . . . . ?
O5 Eu2 N7 C35 -112.5(6) . . . . ?
O6 Eu2 N7 C35 -47.4(5) . . . . ?
O10 Eu2 N7 C35 15.9(6) . . . . ?
O8 Eu2 N7 C35 100.7(5) . . . . ?
N8 Eu2 N7 C35 135.6(5) . . . . ?
N6 Eu2 N7 C35 -109.1(5) . . . . ?
N5 Eu2 N7 C35 -165.1(5) . . . . ?
O7 Eu2 N7 C24 156.2(6) . . . . ?
O5 Eu2 N7 C24 9.2(8) . . . . ?
O6 Eu2 N7 C24 74.3(5) . . . . ?
O10 Eu2 N7 C24 137.6(5) . . . . ?
O8 Eu2 N7 C24 -137.6(5) . . . . ?
N8 Eu2 N7 C24 -102.8(5) . . . . ?
N6 Eu2 N7 C24 12.5(5) . . . . ?
N5 Eu2 N7 C24 -43.5(6) . . . . ?
O7 Eu2 N7 C25 -82.6(5) . . . . ?
O5 Eu2 N7 C25 130.3(5) . . . . ?
O6 Eu2 N7 C25 -164.5(5) . . . . ?
O10 Eu2 N7 C25 -101.2(5) . . . . ?
O8 Eu2 N7 C25 -16.4(5) . . . . ?
N8 Eu2 N7 C25 18.4(5) . . . . ?
N6 Eu2 N7 C25 133.7(5) . . . . ?
N5 Eu2 N7 C25 77.7(5) . . . . ?
O7 Eu2 N8 C27 -166.8(6) . . . . ?
O5 Eu2 N8 C27 -21.7(6) . . . . ?
O6 Eu2 N8 C27 125.2(6) . . . . ?
O10 Eu2 N8 C27 -106.7(6) . . . . ?
O8 Eu2 N8 C27 -80.7(5) . . . . ?
N7 Eu2 N8 C27 132.2(6) . . . . ?
N6 Eu2 N8 C27 73.8(6) . . . . ?
N5 Eu2 N8 C27 17.4(5) . . . . ?
O7 Eu2 N8 C38 -47.1(5) . . . . ?
O5 Eu2 N8 C38 98.1(5) . . . . ?
O6 Eu2 N8 C38 -115.0(6) . . . . ?
O10 Eu2 N8 C38 13.1(6) . . . . ?
O8 Eu2 N8 C38 39.1(5) . . . . ?
N7 Eu2 N8 C38 -108.0(5) . . . . ?
N6 Eu2 N8 C38 -166.4(5) . . . . ?
N5 Eu2 N8 C38 137.2(5) . . . . ?
O7 Eu2 N8 C26 71.2(5) . . . . ?
O5 Eu2 N8 C26 -143.7(5) . . . . ?
O6 Eu2 N8 C26 3.2(9) . . . . ?
O10 Eu2 N8 C26 131.3(5) . . . . ?
O8 Eu2 N8 C26 157.3(6) . . . . ?
N7 Eu2 N8 C26 10.2(5) . . . . ?
N6 Eu2 N8 C26 -48.2(6) . . . . ?
N5 Eu2 N8 C26 -104.6(6) . . . . ?
C29 N5 C21 C22 -160.2(7) . . . . ?
C28 N5 C21 C22 78.8(9) . . . . ?
Eu2 N5 C21 C22 -44.2(8) . . . . ?
C32 N6 C22 C21 78.4(9) . . . . ?
C23 N6 C22 C21 -163.8(7) . . . . ?
Eu2 N6 C22 C21 -39.4(8) . . . . ?
N5 C21 C22 N6 57.1(9) . . . . ?
C22 N6 C23 C24 79.1(8) . . . . ?
C32 N6 C23 C24 -162.3(6) . . . . ?
Eu2 N6 C23 C24 -47.7(8) . . . . ?
C35 N7 C24 C23 79.4(8) . . . . ?
C25 N7 C24 C23 -163.5(7) . . . . ?
Eu2 N7 C24 C23 -41.5(8) . . . . ?
N6 C23 C24 N7 60.4(9) . . . . ?
C35 N7 C25 C26 -163.9(6) . . . . ?
C24 N7 C25 C26 78.2(8) . . . . ?
Eu2 N7 C25 C26 -46.8(7) . . . . ?
C27 N8 C26 C25 -162.8(7) . . . . ?
C38 N8 C26 C25 76.5(9) . . . . ?
Eu2 N8 C26 C25 -39.2(8) . . . . ?
N7 C25 C26 N8 59.9(9) . . . . ?
C38 N8 C27 C28 -162.1(7) . . . . ?
C26 N8 C27 C28 77.8(9) . . . . ?
Eu2 N8 C27 C28 -45.6(8) . . . . ?
C21 N5 C28 C27 -161.5(7) . . . . ?
C29 N5 C28 C27 77.0(9) . . . . ?
Eu2 N5 C28 C27 -38.5(8) . . . . ?
N8 C27 C28 N5 58.4(10) . . . . ?
C21 N5 C29 C30 66.3(10) . . . . ?
C28 N5 C29 C30 -173.1(8) . . . . ?
Eu2 N5 C29 C30 -53.7(9) . . . . ?
Eu2 O5 C30 C29 -4.6(12) . . . . ?
Eu2 O5 C30 C31 -125.6(7) . . . . ?
N5 C29 C30 O5 41.6(12) . . . . ?
N5 C29 C30 C31 162.4(9) . . . . ?
C22 N6 C32 C33 -179.2(7) . . . . ?
C23 N6 C32 C33 62.7(8) . . . . ?
Eu2 N6 C32 C33 -55.4(7) . . . . ?
Eu2 O6 C33 C34 -120.7(7) . . . . ?
Eu2 O6 C33 C32 -1.7(8) . . . . ?
N6 C32 C33 O6 40.4(8) . . . . ?
N6 C32 C33 C34 160.2(7) . . . . ?
C24 N7 C35 C36 -175.9(7) . . . . ?
C25 N7 C35 C36 67.0(9) . . . . ?
Eu2 N7 C35 C36 -51.2(8) . . . . ?
Eu2 O7 C36 C35 0.3(9) . . . . ?
Eu2 O7 C36 C37 -121.2(6) . . . . ?
N7 C35 C36 O7 35.6(10) . . . . ?
N7 C35 C36 C37 156.4(7) . . . . ?
C27 N8 C38 C39 63.0(10) . . . . ?
C26 N8 C38 C39 -177.2(7) . . . . ?
Eu2 N8 C38 C39 -57.6(8) . . . . ?
Eu2 O8 C39 C38 2.2(10) . . . . ?
Eu2 O8 C39 C40 -119.8(6) . . . . ?
N8 C38 C39 O8 39.0(10) . . . . ?
N8 C38 C39 C40 159.7(7) . . . . ?
O12 S1 C41 F2 179.8(6) . . . . ?
O11 S1 C41 F2 60.4(7) . . . . ?
O13 S1 C41 F2 -60.2(7) . . . . ?
O12 S1 C41 F1 -59.2(6) . . . . ?
O11 S1 C41 F1 -178.7(6) . . . . ?
O13 S1 C41 F1 60.8(6) . . . . ?
O12 S1 C41 F3 57.6(7) . . . . ?
O11 S1 C41 F3 -61.8(7) . . . . ?
O13 S1 C41 F3 177.7(6) . . . . ?
O16 S2 C42 F5 -57.9(9) . . . . ?
O14 S2 C42 F5 62.4(9) . . . . ?
O15 S2 C42 F5 179.4(8) . . . . ?
O16 S2 C42 F6 -177.3(7) . . . . ?
O14 S2 C42 F6 -57.0(8) . . . . ?
O15 S2 C42 F6 59.9(9) . . . . ?
O16 S2 C42 F4 62.7(8) . . . . ?
O14 S2 C42 F4 -177.1(7) . . . . ?
O15 S2 C42 F4 -60.1(8) . . . . ?
O17 P1 O19 C43 -40.1(7) . . . . ?
O18 P1 O19 C43 -171.1(6) . . . . ?
O20 P1 O19 C43 74.0(7) . . . . ?
O17 P1 O20 C49 -177.1(6) . . . . ?
O18 P1 O20 C49 -45.3(7) . . . . ?
O19 P1 O20 C49 65.6(7) . . . . ?
P1 O19 C43 C48 100.2(8) . . . . ?
P1 O19 C43 C44 -84.3(10) . . . . ?
C48 C43 C44 C45 1.4(16) . . . . ?
O19 C43 C44 C45 -173.9(9) . . . . ?
C43 C44 C45 C46 -0.9(18) . . . . ?
C44 C45 C46 C47 0.1(17) . . . . ?
C44 C45 C46 N9 178.3(10) . . . . ?
O21 N9 C46 C45 4.2(16) . . . . ?
O22 N9 C46 C45 -168.3(10) . . . . ?
O21 N9 C46 C47 -177.6(11) . . . . ?
O22 N9 C46 C47 9.9(13) . . . . ?
C45 C46 C47 C48 0.4(15) . . . . ?
N9 C46 C47 C48 -177.8(9) . . . . ?
C44 C43 C48 C47 -0.9(14) . . . . ?
O19 C43 C48 C47 174.5(8) . . . . ?
C46 C47 C48 C43 0.0(14) . . . . ?
P1 O20 C49 C50 -5.5(12) . . . . ?
P1 O20 C49 C54 179.4(7) . . . . ?
O20 C49 C50 C51 179.4(8) . . . . ?
C54 C49 C50 C51 -5.8(14) . . . . ?
C49 C50 C51 C52 1.1(14) . . . . ?
C50 C51 C52 C53 5.7(16) . . . . ?
C50 C51 C52 N10 -179.4(8) . . . . ?
O24 N10 C52 C51 1.2(14) . . . . ?
O23 N10 C52 C51 -177.3(10) . . . . ?
O24 N10 C52 C53 176.6(9) . . . . ?
O23 N10 C52 C53 -2.0(14) . . . . ?
C51 C52 C53 C54 -7.5(16) . . . . ?
N10 C52 C53 C54 177.4(9) . . . . ?
C52 C53 C54 C49 2.4(15) . . . . ?
C50 C49 C54 C53 4.0(15) . . . . ?
O20 C49 C54 C53 179.2(9) . . . . ?
O26 P2 O27 C55 172.9(6) . . . . ?
O25 P2 O27 C55 -55.1(7) . . . . ?
O28 P2 O27 C55 56.6(6) . . . . ?
O26 P2 O28 C61 -37.1(7) . . . . ?
O25 P2 O28 C61 -168.4(6) . . . . ?
O27 P2 O28 C61 75.9(6) . . . . ?
P2 O27 C55 C56 -119.5(7) . . . . ?
P2 O27 C55 C60 65.2(9) . . . . ?
C60 C55 C56 C57 -0.6(12) . . . . ?
O27 C55 C56 C57 -175.8(7) . . . . ?
C55 C56 C57 C58 -0.5(11) . . . . ?
C56 C57 C58 C59 1.7(12) . . . . ?
C56 C57 C58 N11 178.9(7) . . . . ?
O30 N11 C58 C57 -176.0(8) . . . . ?
O29 N11 C58 C57 4.9(11) . . . . ?
O30 N11 C58 C59 1.4(12) . . . . ?
O29 N11 C58 C59 -177.7(8) . . . . ?
C57 C58 C59 C60 -1.7(13) . . . . ?
N11 C58 C59 C60 -179.0(8) . . . . ?
C58 C59 C60 C55 0.6(12) . . . . ?
C56 C55 C60 C59 0.5(12) . . . . ?
O27 C55 C60 C59 175.6(7) . . . . ?
P2 O28 C61 C66 160.3(7) . . . . ?
P2 O28 C61 C62 -20.9(11) . . . . ?
C66 C61 C62 C63 -0.7(15) . . . . ?
O28 C61 C62 C63 -179.5(9) . . . . ?
C61 C62 C63 C64 -0.9(16) . . . . ?
C62 C63 C64 C65 2.5(17) . . . . ?
C62 C63 C64 N12 -179.1(10) . . . . ?
O31 N12 C64 C65 10.7(16) . . . . ?
O32 N12 C64 C65 -171.7(11) . . . . ?
O31 N12 C64 C63 -167.7(12) . . . . ?
O32 N12 C64 C63 9.8(17) . . . . ?
C63 C64 C65 C66 -2.3(16) . . . . ?
N12 C64 C65 C66 179.3(9) . . . . ?
O28 C61 C66 C65 179.7(8) . . . . ?
C62 C61 C66 C65 0.8(14) . . . . ?
C64 C65 C66 C61 0.6(15) . . . . ?
O34 P3 O35 C67 -178.8(5) . . . . ?
O33 P3 O35 C67 49.7(6) . . . . ?
O36 P3 O35 C67 -62.2(6) . . . . ?
O34 P3 O36 C73 31.3(7) . . . . ?
O33 P3 O36 C73 162.9(6) . . . . ?
O35 P3 O36 C73 -81.6(6) . . . . ?
P3 O35 C67 C72 -62.7(9) . . . . ?
P3 O35 C67 C68 119.2(6) . . . . ?
C72 C67 C68 C69 1.8(11) . . . . ?
O35 C67 C68 C69 180.0(7) . . . . ?
C67 C68 C69 C70 -0.8(11) . . . . ?
C68 C69 C70 C71 -1.0(12) . . . . ?
C68 C69 C70 N13 -179.5(7) . . . . ?
O38 N13 C70 C71 -7.1(11) . . . . ?
O37 N13 C70 C71 170.2(8) . . . . ?
O38 N13 C70 C69 171.4(8) . . . . ?
O37 N13 C70 C69 -11.3(11) . . . . ?
C69 C70 C71 C72 1.8(11) . . . . ?
N13 C70 C71 C72 -179.7(7) . . . . ?
O35 C67 C72 C71 -179.1(7) . . . . ?
C68 C67 C72 C71 -1.0(11) . . . . ?
C70 C71 C72 C67 -0.8(11) . . . . ?
P3 O36 C73 C74 -150.7(6) . . . . ?
P3 O36 C73 C78 30.2(11) . . . . ?
O36 C73 C74 C75 180.0(7) . . . . ?
C78 C73 C74 C75 -1.0(13) . . . . ?
C73 C74 C75 C76 -2.4(13) . . . . ?
C74 C75 C76 C77 4.3(14) . . . . ?
C74 C75 C76 N14 -176.7(8) . . . . ?
O39 N14 C76 C77 -6.8(16) . . . . ?
O40 N14 C76 C77 176.3(10) . . . . ?
O39 N14 C76 C75 174.2(11) . . . . ?
O40 N14 C76 C75 -2.7(15) . . . . ?
C75 C76 C77 C78 -2.7(14) . . . . ?
N14 C76 C77 C78 178.4(8) . . . . ?
C76 C77 C78 C73 -0.8(13) . . . . ?
O36 C73 C78 C77 -178.4(7) . . . . ?
C74 C73 C78 C77 2.6(14) . . . . ?
O41 P4 O43 C79 42.1(7) . . . . ?
O42 P4 O43 C79 174.2(6) . . . . ?
O44 P4 O43 C79 -70.6(6) . . . . ?
O41 P4 O44 C85 175.3(6) . . . . ?
O42 P4 O44 C85 43.0(6) . . . . ?
O43 P4 O44 C85 -68.6(6) . . . . ?
P4 O43 C79 C84 -103.2(8) . . . . ?
P4 O43 C79 C80 80.5(9) . . . . ?
C84 C79 C80 C81 -1.0(14) . . . . ?
O43 C79 C80 C81 175.2(9) . . . . ?
C79 C80 C81 C82 0.9(15) . . . . ?
C80 C81 C82 C83 -0.7(15) . . . . ?
C80 C81 C82 N15 -177.4(9) . . . . ?
O46 N15 C82 C83 6.6(15) . . . . ?
O45 N15 C82 C83 -177.1(9) . . . . ?
O46 N15 C82 C81 -176.5(12) . . . . ?
O45 N15 C82 C81 -0.2(13) . . . . ?
C81 C82 C83 C84 0.4(14) . . . . ?
N15 C82 C83 C84 177.2(8) . . . . ?
O43 C79 C84 C83 -175.6(8) . . . . ?
C80 C79 C84 C83 0.7(13) . . . . ?
C82 C83 C84 C79 -0.4(13) . . . . ?
P4 O44 C85 C90 21.3(10) . . . . ?
P4 O44 C85 C86 -160.9(6) . . . . ?
O44 C85 C86 C87 -179.0(8) . . . . ?
C90 C85 C86 C87 -1.1(13) . . . . ?
C85 C86 C87 C88 -0.4(14) . . . . ?
C86 C87 C88 C89 -0.2(13) . . . . ?
C86 C87 C88 N16 179.5(8) . . . . ?
O48 N16 C88 C87 -6.9(12) . . . . ?
O47 N16 C88 C87 170.8(8) . . . . ?
O48 N16 C88 C89 172.8(8) . . . . ?
O47 N16 C88 C89 -9.5(11) . . . . ?
C87 C88 C89 C90 2.3(12) . . . . ?
N16 C88 C89 C90 -177.5(7) . . . . ?
C88 C89 C90 C85 -3.7(12) . . . . ?
O44 C85 C90 C89 -179.1(7) . . . . ?
C86 C85 C90 C89 3.2(12) . . . . ?
