#------------------------------------------------------------------------------
#$Date: 2016-03-22 23:20:45 +0200 (Tue, 22 Mar 2016) $
#$Revision: 179056 $
#$URL: svn://www.crystallography.net/cod/cif/4/30/18/4301882.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_4301882
loop_
_publ_author_name
'Sylvie Pailloux'
'Cornel Edicome Shirima'
'Alisha D. Ray'
'Eileen N. Duesler'
'Robert T. Paine'
'John R. Klaehn'
'Michael E. McIlwain'
'Benjamin P. Hay'
_publ_section_title
;
Synthesis and Coordination Properties of Trifluoromethyl Decorated
Derivatives of 2,6-Bis[(diphenylphosphinoyl)methyl]pyridine N-Oxide Ligands
with Lanthanide Ions
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              3104
_journal_page_last               3113
_journal_paper_doi               10.1021/ic802390c
_journal_volume                  48
_journal_year                    2009
_chemical_absolute_configuration ad
_chemical_formula_moiety         'C35 H23 Eu F12 N4 O12 P2'
_chemical_formula_sum            'C35 H23 Eu F12 N4 O12 P2'
_chemical_formula_weight         1133.47
_chemical_name_systematic
;
 ?
;
_space_group_IT_number           19
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  'P 2ac 2ab'
_symmetry_space_group_name_H-M   'P 21 21 21'
_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                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   10.1129(5)
_cell_length_b                   18.8663(10)
_cell_length_c                   21.1388(10)
_cell_measurement_reflns_used    9804
_cell_measurement_temperature    228(2)
_cell_measurement_theta_max      32.07
_cell_measurement_theta_min      2.89
_cell_volume                     4033.1(3)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      228(2)
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_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  0.0860
_diffrn_reflns_av_sigmaI/netI    0.0642
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       29
_diffrn_reflns_limit_k_min       -29
_diffrn_reflns_limit_l_max       32
_diffrn_reflns_limit_l_min       -32
_diffrn_reflns_number            128628
_diffrn_reflns_theta_full        33.35
_diffrn_reflns_theta_max         33.35
_diffrn_reflns_theta_min         2.89
_exptl_absorpt_coefficient_mu    1.758
_exptl_absorpt_correction_T_max  0.8883
_exptl_absorpt_correction_T_min  0.7380
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   Bruker,SADABS
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.867
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             2232
_exptl_crystal_size_max          0.18
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.07
_refine_diff_density_max         0.965
_refine_diff_density_min         -0.766
_refine_diff_density_rms         0.100
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.028(6)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.999
_refine_ls_hydrogen_treatment    noref
_refine_ls_matrix_type           full
_refine_ls_number_parameters     592
_refine_ls_number_reflns         15577
_refine_ls_number_restraints     15
_refine_ls_restrained_S_all      0.999
_refine_ls_R_factor_all          0.0649
_refine_ls_R_factor_gt           0.0410
_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)+(0.0422P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0819
_refine_ls_wR_factor_ref         0.0898
_reflns_number_gt                11915
_reflns_number_total             15577
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic802390c_si_001_8.cif
_cod_data_source_block           rpsl35
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Orthorhombic' changed to 'orthorhombic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4301882
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, -y, z+1/2'
'-x, y+1/2, -z+1/2'
'x+1/2, -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 0.149680(16) 0.383498(8) 0.103373(7) 0.02483(4) Uani 1 1 d . . .
P1 P 0.37807(9) 0.24881(5) 0.16561(4) 0.02801(18) Uani 1 1 d . . .
P2 P 0.33269(9) 0.50898(4) 0.00465(4) 0.02811(18) Uani 1 1 d . . .
N1 N 0.4213(3) 0.33758(14) 0.02390(12) 0.0242(5) Uani 1 1 d . . .
N2 N 0.1622(4) 0.45716(17) 0.22588(14) 0.0413(7) Uani 1 1 d . . .
N3 N -0.0288(3) 0.45480(18) 0.01462(16) 0.0395(7) Uani 1 1 d . . .
N4 N -0.0334(3) 0.26349(16) 0.11040(14) 0.0337(6) Uani 1 1 d . . .
O1 O 0.2912(2) 0.32833(13) 0.02502(11) 0.0282(5) Uani 1 1 d . . .
O2 O 0.2872(3) 0.31101(13) 0.16398(11) 0.0317(5) Uani 1 1 d . . .
O3 O 0.2752(3) 0.47577(13) 0.06266(11) 0.0326(5) Uani 1 1 d . . .
O4 O 0.2620(3) 0.45577(15) 0.19069(14) 0.0464(7) Uani 1 1 d . . .
O5 O 0.0571(3) 0.42870(17) 0.20333(14) 0.0504(8) Uani 1 1 d . . .
O6 O 0.1625(4) 0.48337(19) 0.27852(14) 0.0655(9) Uani 1 1 d . . .
O7 O -0.0198(3) 0.47515(16) 0.07123(14) 0.0463(7) Uani 1 1 d . . .
O8 O 0.0402(3) 0.40091(14) -0.00100(13) 0.0432(7) Uani 1 1 d . . .
O9 O -0.0995(3) 0.48440(19) -0.02410(16) 0.0592(9) Uani 1 1 d . . .
O10 O -0.0653(3) 0.32573(14) 0.12664(15) 0.0454(7) Uani 1 1 d . . .
O11 O 0.0779(3) 0.25801(15) 0.08386(14) 0.0453(7) Uani 1 1 d . . .
O12 O -0.1041(3) 0.21309(15) 0.11932(13) 0.0481(7) Uani 1 1 d . . .
C1 C 0.4993(3) 0.28972(18) 0.05589(15) 0.0287(7) Uani 1 1 d . . .
C2 C 0.6338(4) 0.3005(2) 0.05740(17) 0.0361(8) Uani 1 1 d . . .
H2 H 0.6880 0.2692 0.0804 0.043 Uiso 1 1 calc R . .
C3 C 0.6898(4) 0.3565(2) 0.0257(2) 0.0407(9) Uani 1 1 d . . .
H3 H 0.7813 0.3648 0.0283 0.049 Uiso 1 1 calc R . .
C4 C 0.6107(3) 0.4003(2) -0.00988(18) 0.0352(8) Uani 1 1 d . . .
H4 H 0.6492 0.4371 -0.0335 0.042 Uiso 1 1 calc R . .
C5 C 0.4753(3) 0.39071(18) -0.01142(14) 0.0269(6) Uani 1 1 d . . .
C6 C 0.4327(4) 0.22827(18) 0.08631(15) 0.0323(8) Uani 1 1 d . . .
H6A H 0.4941 0.1881 0.0878 0.039 Uiso 1 1 calc R . .
H6B H 0.3563 0.2142 0.0607 0.039 Uiso 1 1 calc R . .
C7 C 0.3823(3) 0.43692(17) -0.04770(15) 0.0288(7) Uani 1 1 d . . .
H7A H 0.3047 0.4097 -0.0611 0.035 Uiso 1 1 calc R . .
H7B H 0.4260 0.4559 -0.0855 0.035 Uiso 1 1 calc R . .
C8 C 0.5267(4) 0.2750(2) 0.20856(16) 0.0333(8) Uani 1 1 d . . .
C9 C 0.6325(4) 0.2348(2) 0.23127(17) 0.0417(9) Uani 1 1 d . . .
C10 C 0.7457(4) 0.2681(3) 0.2539(2) 0.0488(10) Uani 1 1 d . . .
H10 H 0.8160 0.2405 0.2695 0.059 Uiso 1 1 calc R . .
C11 C 0.7563(4) 0.3403(3) 0.2539(2) 0.0504(11) Uani 1 1 d . . .
H11 H 0.8351 0.3619 0.2674 0.060 Uiso 1 1 calc R . .
C12 C 0.6517(5) 0.3814(2) 0.23406(18) 0.0501(10) Uani 1 1 d . . .
H12 H 0.6578 0.4311 0.2357 0.060 Uiso 1 1 calc R . .
C13 C 0.5383(4) 0.3497(2) 0.21186(17) 0.0400(9) Uani 1 1 d . . .
H13 H 0.4672 0.3781 0.1986 0.048 Uiso 1 1 calc R . .
C14 C 0.6309(5) 0.1563(3) 0.2321(2) 0.0565(12) Uani 1 1 d . . .
C15 C 0.2925(4) 0.1699(2) 0.19261(17) 0.0351(8) Uani 1 1 d . . .
C16 C 0.1994(4) 0.1703(2) 0.24206(19) 0.0396(9) Uani 1 1 d . . .
C17 C 0.1262(4) 0.1094(3) 0.2547(2) 0.0554(12) Uani 1 1 d . . .
H17 H 0.0634 0.1096 0.2875 0.066 Uiso 1 1 calc R . .
C18 C 0.1458(5) 0.0481(3) 0.2188(2) 0.0592(12) Uani 1 1 d . . .
H18 H 0.0949 0.0074 0.2270 0.071 Uiso 1 1 calc R . .
C19 C 0.2384(5) 0.0471(2) 0.1723(2) 0.0529(11) Uani 1 1 d . . .
H19 H 0.2533 0.0053 0.1491 0.063 Uiso 1 1 calc R . .
C20 C 0.3110(4) 0.1076(2) 0.15871(19) 0.0417(9) Uani 1 1 d . . .
H20 H 0.3738 0.1065 0.1260 0.050 Uiso 1 1 calc R . .
C21 C 0.1730(5) 0.2348(3) 0.2824(2) 0.0524(12) Uani 1 1 d . . .
C22 C 0.4843(4) 0.55433(19) 0.02838(18) 0.0363(8) Uani 1 1 d . . .
C23 C 0.5679(4) 0.5958(2) -0.0089(2) 0.0433(10) Uani 1 1 d . . .
C24 C 0.6895(4) 0.6169(3) 0.0151(3) 0.0576(12) Uani 1 1 d . . .
H24 H 0.7460 0.6445 -0.0103 0.069 Uiso 1 1 calc R . .
C25 C 0.7291(5) 0.5987(3) 0.0747(3) 0.0735(16) Uani 1 1 d . . .
H25 H 0.8125 0.6131 0.0896 0.088 Uiso 1 1 calc R . .
C26 C 0.6459(6) 0.5587(3) 0.1134(3) 0.0687(14) Uani 1 1 d . . .
H26 H 0.6717 0.5466 0.1547 0.082 Uiso 1 1 calc R . .
C27 C 0.5268(5) 0.5376(2) 0.0903(2) 0.0492(10) Uani 1 1 d . . .
H27 H 0.4706 0.5109 0.1164 0.059 Uiso 1 1 calc R . .
C28 C 0.5333(5) 0.6209(3) -0.0731(2) 0.0526(10) Uani 1 1 d . . .
C29 C 0.2154(4) 0.5649(2) -0.03568(18) 0.0380(8) Uani 1 1 d . . .
C30 C 0.1544(5) 0.6250(2) -0.0095(2) 0.0487(9) Uani 1 1 d . . .
C31 C 0.0603(6) 0.6618(3) -0.0443(3) 0.0689(15) Uani 1 1 d . . .
H31 H 0.0184 0.7015 -0.0264 0.083 Uiso 1 1 calc R . .
C32 C 0.0283(6) 0.6412(3) -0.1037(3) 0.0762(16) Uani 1 1 d . . .
H32 H -0.0340 0.6677 -0.1268 0.091 Uiso 1 1 calc R . .
C33 C 0.0850(6) 0.5823(3) -0.1312(3) 0.0694(16) Uani 1 1 d . . .
H33 H 0.0612 0.5680 -0.1723 0.083 Uiso 1 1 calc R . .
C34 C 0.1784(4) 0.5445(2) -0.0966(2) 0.0492(10) Uani 1 1 d . . .
H34 H 0.2176 0.5042 -0.1147 0.059 Uiso 1 1 calc R . .
C_1 C 0.1893(6) 0.6535(3) 0.0540(3) 0.0697(16) Uani 1 1 d D . .
F1D_1 F 0.2395(6) 0.6128(3) 0.0937(2) 0.0779(13) Uiso 0.69 1 d PD . .
F2D_1 F 0.0881(7) 0.6857(4) 0.0815(3) 0.099(2) Uiso 0.69 1 d PD . .
F3D_1 F 0.2823(6) 0.7083(3) 0.0467(3) 0.1036(18) Uiso 0.69 1 d PD . .
F4D_1 F 0.1051(13) 0.6080(6) 0.1034(5) 0.096(3) Uiso 0.31 1 d PD . .
F5D_1 F 0.1347(13) 0.7134(6) 0.0685(5) 0.081(3) Uiso 0.31 1 d PD . .
F6D_1 F 0.2968(10) 0.6346(5) 0.0821(4) 0.055(2) Uiso 0.31 1 d PD . .
F1 F 0.7420(3) 0.1273(2) 0.25340(19) 0.0966(12) Uani 1 1 d . . .
F2 F 0.5342(4) 0.13020(18) 0.26849(17) 0.0854(11) Uani 1 1 d . . .
F3 F 0.6091(3) 0.12849(15) 0.17439(16) 0.0765(9) Uani 1 1 d . . .
F4 F 0.1234(4) 0.21593(18) 0.33824(15) 0.0954(13) Uani 1 1 d . . .
F5 F 0.2815(3) 0.27214(15) 0.29368(12) 0.0583(7) Uani 1 1 d . . .
F6 F 0.0852(3) 0.27745(17) 0.25617(17) 0.0738(9) Uani 1 1 d . . .
F7 F 0.4404(4) 0.67201(18) -0.07079(17) 0.0848(10) Uani 1 1 d . . .
F8 F 0.6336(3) 0.64905(18) -0.10492(15) 0.0807(9) Uani 1 1 d . . .
F9 F 0.4802(4) 0.57139(16) -0.10961(13) 0.0744(9) Uani 1 1 d . . .
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'
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 O2 108.51(9) . . ?
O3 Eu1 O1 75.27(9) . . ?
O2 Eu1 O1 76.80(8) . . ?
O3 Eu1 O5 105.44(10) . . ?
O2 Eu1 O5 87.61(9) . . ?
O1 Eu1 O5 163.58(9) . . ?
O3 Eu1 O10 151.95(9) . . ?
O2 Eu1 O10 98.96(10) . . ?
O1 Eu1 O10 117.65(9) . . ?
O5 Eu1 O10 69.46(10) . . ?
O3 Eu1 O8 79.37(9) . . ?
O2 Eu1 O8 145.96(9) . . ?
O1 Eu1 O8 73.36(9) . . ?
O5 Eu1 O8 123.05(10) . . ?
O10 Eu1 O8 81.02(10) . . ?
O3 Eu1 O11 143.60(9) . . ?
O2 Eu1 O11 73.13(9) . . ?
O1 Eu1 O11 69.72(8) . . ?
O5 Eu1 O11 110.95(10) . . ?
O10 Eu1 O11 50.57(9) . . ?
O8 Eu1 O11 81.38(10) . . ?
O3 Eu1 O7 75.98(9) . . ?
O2 Eu1 O7 162.28(9) . . ?
O1 Eu1 O7 120.69(9) . . ?
O5 Eu1 O7 74.70(10) . . ?
O10 Eu1 O7 76.10(10) . . ?
O8 Eu1 O7 50.96(9) . . ?
O11 Eu1 O7 113.88(10) . . ?
O3 Eu1 O4 67.99(9) . . ?
O2 Eu1 O4 69.64(9) . . ?
O1 Eu1 O4 117.36(9) . . ?
O5 Eu1 O4 50.64(10) . . ?
O10 Eu1 O4 118.66(9) . . ?
O8 Eu1 O4 139.96(9) . . ?
O11 Eu1 O4 138.50(10) . . ?
O7 Eu1 O4 97.48(10) . . ?
O2 P1 C6 109.62(15) . . ?
O2 P1 C15 111.04(17) . . ?
C6 P1 C15 105.17(18) . . ?
O2 P1 C8 107.85(16) . . ?
C6 P1 C8 105.55(17) . . ?
C15 P1 C8 117.30(17) . . ?
O3 P2 C29 112.17(17) . . ?
O3 P2 C7 107.00(15) . . ?
C29 P2 C7 109.28(18) . . ?
O3 P2 C22 107.32(16) . . ?
C29 P2 C22 114.12(18) . . ?
C7 P2 C22 106.57(17) . . ?
O1 N1 C5 120.2(3) . . ?
O1 N1 C1 118.2(3) . . ?
C5 N1 C1 121.4(3) . . ?
O6 N2 O4 123.3(4) . . ?
O6 N2 O5 120.8(4) . . ?
O4 N2 O5 115.9(3) . . ?
O9 N3 O7 122.6(4) . . ?
O9 N3 O8 120.7(4) . . ?
O7 N3 O8 116.7(3) . . ?
O12 N4 O11 122.3(3) . . ?
O12 N4 O10 122.6(3) . . ?
O11 N4 O10 115.1(3) . . ?
N1 O1 Eu1 122.74(19) . . ?
P1 O2 Eu1 147.28(15) . . ?
P2 O3 Eu1 146.28(15) . . ?
N2 O4 Eu1 94.7(2) . . ?
N2 O5 Eu1 98.6(2) . . ?
N3 O7 Eu1 95.5(2) . . ?
N3 O8 Eu1 96.8(2) . . ?
N4 O10 Eu1 97.5(2) . . ?
N4 O11 Eu1 96.2(2) . . ?
C2 C1 N1 118.7(3) . . ?
C2 C1 C6 123.6(3) . . ?
N1 C1 C6 117.7(3) . . ?
C3 C2 C1 120.7(4) . . ?
C3 C2 H2 119.7 . . ?
C1 C2 H2 119.7 . . ?
C2 C3 C4 119.3(4) . . ?
C2 C3 H3 120.3 . . ?
C4 C3 H3 120.3 . . ?
C3 C4 C5 120.8(4) . . ?
C3 C4 H4 119.6 . . ?
C5 C4 H4 119.6 . . ?
N1 C5 C4 118.7(3) . . ?
N1 C5 C7 117.2(3) . . ?
C4 C5 C7 124.1(3) . . ?
C1 C6 P1 111.9(2) . . ?
C1 C6 H6A 109.2 . . ?
P1 C6 H6A 109.2 . . ?
C1 C6 H6B 109.2 . . ?
P1 C6 H6B 109.2 . . ?
H6A C6 H6B 107.9 . . ?
C5 C7 P2 107.3(2) . . ?
C5 C7 H7A 110.3 . . ?
P2 C7 H7A 110.3 . . ?
C5 C7 H7B 110.3 . . ?
P2 C7 H7B 110.3 . . ?
H7A C7 H7B 108.5 . . ?
C9 C8 C13 117.4(4) . . ?
C9 C8 P1 130.9(3) . . ?
C13 C8 P1 111.2(3) . . ?
C10 C9 C8 120.2(4) . . ?
C10 C9 C14 117.1(4) . . ?
C8 C9 C14 122.6(4) . . ?
C11 C10 C9 121.0(4) . . ?
C11 C10 H10 119.5 . . ?
C9 C10 H10 119.5 . . ?
C10 C11 C12 120.1(4) . . ?
C10 C11 H11 120.0 . . ?
C12 C11 H11 120.0 . . ?
C13 C12 C11 119.9(4) . . ?
C13 C12 H12 120.1 . . ?
C11 C12 H12 120.1 . . ?
C12 C13 C8 121.3(4) . . ?
C12 C13 H13 119.4 . . ?
C8 C13 H13 119.4 . . ?
F1 C14 F2 105.8(4) . . ?
F1 C14 F3 106.6(4) . . ?
F2 C14 F3 104.9(4) . . ?
F1 C14 C9 114.0(4) . . ?
F2 C14 C9 112.5(4) . . ?
F3 C14 C9 112.4(4) . . ?
C20 C15 C16 118.5(4) . . ?
C20 C15 P1 117.9(3) . . ?
C16 C15 P1 123.3(3) . . ?
C17 C16 C15 119.6(4) . . ?
C17 C16 C21 117.6(4) . . ?
C15 C16 C21 122.8(4) . . ?
C16 C17 C18 120.3(4) . . ?
C16 C17 H17 119.9 . . ?
C18 C17 H17 119.9 . . ?
C19 C18 C17 120.1(4) . . ?
C19 C18 H18 119.9 . . ?
C17 C18 H18 119.9 . . ?
C18 C19 C20 120.2(5) . . ?
C18 C19 H19 119.9 . . ?
C20 C19 H19 119.9 . . ?
C19 C20 C15 121.2(4) . . ?
C19 C20 H20 119.4 . . ?
C15 C20 H20 119.4 . . ?
F6 C21 F5 108.0(4) . . ?
F6 C21 F4 106.4(4) . . ?
F5 C21 F4 107.1(4) . . ?
F6 C21 C16 111.9(4) . . ?
F5 C21 C16 112.6(4) . . ?
F4 C21 C16 110.6(4) . . ?
C23 C22 C27 117.6(4) . . ?
C23 C22 P2 128.1(3) . . ?
C27 C22 P2 113.9(3) . . ?
C24 C23 C22 119.5(4) . . ?
C24 C23 C28 116.8(4) . . ?
C22 C23 C28 123.6(4) . . ?
C25 C24 C23 121.6(5) . . ?
C25 C24 H24 119.2 . . ?
C23 C24 H24 119.2 . . ?
C24 C25 C26 120.0(5) . . ?
C24 C25 H25 120.0 . . ?
C26 C25 H25 120.0 . . ?
C27 C26 C25 118.8(5) . . ?
C27 C26 H26 120.6 . . ?
C25 C26 H26 120.6 . . ?
C26 C27 C22 122.5(4) . . ?
C26 C27 H27 118.8 . . ?
C22 C27 H27 118.8 . . ?
F9 C28 F8 107.3(4) . . ?
F9 C28 F7 104.1(4) . . ?
F8 C28 F7 105.3(4) . . ?
F9 C28 C23 113.9(4) . . ?
F8 C28 C23 114.3(4) . . ?
F7 C28 C23 111.1(4) . . ?
C34 C29 C30 117.9(4) . . ?
C34 C29 P2 116.9(3) . . ?
C30 C29 P2 125.2(3) . . ?
C31 C30 C29 119.8(5) . . ?
C31 C30 C_1 117.3(4) . . ?
C29 C30 C_1 122.9(4) . . ?
C32 C31 C30 120.8(5) . . ?
C32 C31 H31 119.6 . . ?
C30 C31 H31 119.6 . . ?
C31 C32 C33 121.5(5) . . ?
C31 C32 H32 119.2 . . ?
C33 C32 H32 119.2 . . ?
C32 C33 C34 118.2(5) . . ?
C32 C33 H33 120.9 . . ?
C34 C33 H33 120.9 . . ?
C33 C34 C29 121.8(5) . . ?
C33 C34 H34 119.1 . . ?
C29 C34 H34 119.1 . . ?
F1D_1 C_1 F5D_1 123.5(7) . . ?
F6D_1 C_1 F5D_1 119.5(8) . . ?
F1D_1 C_1 F2D_1 107.6(6) . . ?
F6D_1 C_1 F2D_1 125.3(7) . . ?
F1D_1 C_1 F3D_1 104.7(6) . . ?
F6D_1 C_1 F3D_1 71.9(6) . . ?
F5D_1 C_1 F3D_1 70.7(7) . . ?
F2D_1 C_1 F3D_1 103.2(5) . . ?
F1D_1 C_1 C30 118.8(4) . . ?
F6D_1 C_1 C30 121.0(5) . . ?
F5D_1 C_1 C30 115.3(7) . . ?
F2D_1 C_1 C30 112.2(5) . . ?
F3D_1 C_1 C30 109.0(5) . . ?
F1D_1 C_1 F4D_1 56.3(6) . . ?
F6D_1 C_1 F4D_1 90.0(7) . . ?
F5D_1 C_1 F4D_1 95.0(8) . . ?
F2D_1 C_1 F4D_1 63.1(6) . . ?
F3D_1 C_1 F4D_1 145.4(7) . . ?
C30 C_1 F4D_1 105.6(6) . . ?
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 2.320(2) . ?
Eu1 O2 2.334(2) . ?
Eu1 O1 2.424(2) . ?
Eu1 O5 2.463(3) . ?
Eu1 O10 2.481(3) . ?
Eu1 O8 2.490(3) . ?
Eu1 O11 2.510(3) . ?
Eu1 O7 2.528(3) . ?
Eu1 O4 2.561(3) . ?
P1 O2 1.491(3) . ?
P1 C6 1.807(3) . ?
P1 C15 1.814(4) . ?
P1 C8 1.824(4) . ?
P2 O3 1.495(2) . ?
P2 C29 1.801(4) . ?
P2 C7 1.823(3) . ?
P2 C22 1.826(4) . ?
N1 O1 1.328(3) . ?
N1 C5 1.364(4) . ?
N1 C1 1.376(4) . ?
N2 O6 1.218(4) . ?
N2 O4 1.254(4) . ?
N2 O5 1.282(4) . ?
N3 O9 1.222(4) . ?
N3 O7 1.260(4) . ?
N3 O8 1.276(4) . ?
N4 O12 1.204(4) . ?
N4 O11 1.262(4) . ?
N4 O10 1.265(4) . ?
C1 C2 1.376(5) . ?
C1 C6 1.487(5) . ?
C2 C3 1.373(6) . ?
C2 H2 0.9400 . ?
C3 C4 1.373(6) . ?
C3 H3 0.9400 . ?
C4 C5 1.381(5) . ?
C4 H4 0.9400 . ?
C5 C7 1.495(5) . ?
C6 H6A 0.9800 . ?
C6 H6B 0.9800 . ?
C7 H7A 0.9800 . ?
C7 H7B 0.9800 . ?
C8 C9 1.396(5) . ?
C8 C13 1.415(5) . ?
C9 C10 1.391(6) . ?
C9 C14 1.481(6) . ?
C10 C11 1.367(7) . ?
C10 H10 0.9400 . ?
C11 C12 1.377(7) . ?
C11 H11 0.9400 . ?
C12 C13 1.377(6) . ?
C12 H12 0.9400 . ?
C13 H13 0.9400 . ?
C14 F1 1.328(6) . ?
C14 F2 1.339(6) . ?
C14 F3 1.346(6) . ?
C15 C20 1.389(5) . ?
C15 C16 1.407(5) . ?
C16 C17 1.392(6) . ?
C16 C21 1.510(6) . ?
C17 C18 1.398(7) . ?
C17 H17 0.9400 . ?
C18 C19 1.358(7) . ?
C18 H18 0.9400 . ?
C19 C20 1.387(6) . ?
C19 H19 0.9400 . ?
C20 H20 0.9400 . ?
C21 F6 1.320(5) . ?
C21 F5 1.325(6) . ?
C21 F4 1.331(5) . ?
C22 C23 1.395(5) . ?
C22 C27 1.413(6) . ?
C23 C24 1.389(6) . ?
C23 C28 1.481(6) . ?
C24 C25 1.365(8) . ?
C24 H24 0.9400 . ?
C25 C26 1.396(8) . ?
C25 H25 0.9400 . ?
C26 C27 1.359(7) . ?
C26 H26 0.9400 . ?
C27 H27 0.9400 . ?
C28 F9 1.325(5) . ?
C28 F8 1.327(5) . ?
C28 F7 1.348(6) . ?
C29 C34 1.394(6) . ?
C29 C30 1.405(6) . ?
C30 C31 1.389(7) . ?
C30 C_1 1.489(7) . ?
C31 C32 1.353(9) . ?
C31 H31 0.9400 . ?
C32 C33 1.379(8) . ?
C32 H32 0.9400 . ?
C33 C34 1.391(6) . ?
C33 H33 0.9400 . ?
C34 H34 0.9400 . ?
C_1 F1D_1 1.246(7) . ?
C_1 F6D_1 1.289(11) . ?
C_1 F5D_1 1.294(12) . ?
C_1 F2D_1 1.324(8) . ?
C_1 F3D_1 1.405(8) . ?
C_1 F4D_1 1.598(14) . ?
F1D_1 F6D_1 0.752(9) . ?
F1D_1 F4D_1 1.378(14) . ?
F2D_1 F5D_1 0.755(12) . ?
F2D_1 F4D_1 1.547(13) . ?
F3D_1 F5D_1 1.565(14) . ?
F3D_1 F6D_1 1.585(11) . ?
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
C2 H2 O12 0.94 2.49 3.385(5) 158.1 1_655
C6 H6A F3 0.98 2.44 3.193(5) 133.0 .
C6 H6A O8 0.98 2.53 3.221(4) 127.3 4
C7 H7B F9 0.98 2.30 3.021(4) 129.3 .
C10 H10 F1 0.94 2.29 2.655(6) 102.6 .
C13 H13 O2 0.94 2.33 2.829(5) 112.4 .
C13 H13 O4 0.94 2.55 3.466(5) 166.4 .
C17 H17 F4 0.94 2.36 2.675(7) 99.5 .
C18 H18 O5 0.94 2.60 3.463(5) 153.5 3_545
C24 H24 F8 0.94 2.30 2.669(6) 102.6 .
C27 H27 O3 0.94 2.37 2.859(5) 111.8 .
C34 H34 O6 0.94 2.57 3.137(6) 118.9 2_564
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
C5 N1 O1 Eu1 -91.8(3) . . . . ?
C1 N1 O1 Eu1 92.2(3) . . . . ?
O3 Eu1 O1 N1 51.2(2) . . . . ?
O2 Eu1 O1 N1 -62.3(2) . . . . ?
O5 Eu1 O1 N1 -43.5(5) . . . . ?
O10 Eu1 O1 N1 -155.6(2) . . . . ?
O8 Eu1 O1 N1 134.3(3) . . . . ?
O11 Eu1 O1 N1 -139.0(3) . . . . ?
O7 Eu1 O1 N1 114.6(2) . . . . ?
O4 Eu1 O1 N1 -3.9(3) . . . . ?
C6 P1 O2 Eu1 18.1(3) . . . . ?
C15 P1 O2 Eu1 -97.7(3) . . . . ?
C8 P1 O2 Eu1 132.5(3) . . . . ?
O3 Eu1 O2 P1 -89.4(3) . . . . ?
O1 Eu1 O2 P1 -20.1(3) . . . . ?
O5 Eu1 O2 P1 165.1(3) . . . . ?
O10 Eu1 O2 P1 96.3(3) . . . . ?
O8 Eu1 O2 P1 9.1(4) . . . . ?
O11 Eu1 O2 P1 52.4(3) . . . . ?
O7 Eu1 O2 P1 168.5(3) . . . . ?
O4 Eu1 O2 P1 -146.3(3) . . . . ?
C29 P2 O3 Eu1 83.4(3) . . . . ?
C7 P2 O3 Eu1 -36.4(3) . . . . ?
C22 P2 O3 Eu1 -150.5(3) . . . . ?
O2 Eu1 O3 P2 112.3(3) . . . . ?
O1 Eu1 O3 P2 42.0(3) . . . . ?
O5 Eu1 O3 P2 -155.0(3) . . . . ?
O10 Eu1 O3 P2 -79.8(4) . . . . ?
O8 Eu1 O3 P2 -33.4(3) . . . . ?
O11 Eu1 O3 P2 25.8(4) . . . . ?
O7 Eu1 O3 P2 -85.5(3) . . . . ?
O4 Eu1 O3 P2 170.2(3) . . . . ?
O6 N2 O4 Eu1 176.0(3) . . . . ?
O5 N2 O4 Eu1 -3.8(3) . . . . ?
O3 Eu1 O4 N2 137.0(2) . . . . ?
O2 Eu1 O4 N2 -102.0(2) . . . . ?
O1 Eu1 O4 N2 -164.2(2) . . . . ?
O5 Eu1 O4 N2 2.3(2) . . . . ?
O10 Eu1 O4 N2 -12.8(2) . . . . ?
O8 Eu1 O4 N2 99.2(2) . . . . ?
O11 Eu1 O4 N2 -74.5(3) . . . . ?
O7 Eu1 O4 N2 65.4(2) . . . . ?
O6 N2 O5 Eu1 -175.8(3) . . . . ?
O4 N2 O5 Eu1 3.9(3) . . . . ?
O3 Eu1 O5 N2 -45.4(2) . . . . ?
O2 Eu1 O5 N2 63.2(2) . . . . ?
O1 Eu1 O5 N2 44.9(5) . . . . ?
O10 Eu1 O5 N2 163.6(3) . . . . ?
O8 Eu1 O5 N2 -132.6(2) . . . . ?
O11 Eu1 O5 N2 134.1(2) . . . . ?
O7 Eu1 O5 N2 -115.8(2) . . . . ?
O4 Eu1 O5 N2 -2.2(2) . . . . ?
O9 N3 O7 Eu1 -178.0(3) . . . . ?
O8 N3 O7 Eu1 2.0(3) . . . . ?
O3 Eu1 O7 N3 86.4(2) . . . . ?
O2 Eu1 O7 N3 -166.5(3) . . . . ?
O1 Eu1 O7 N3 23.3(3) . . . . ?
O5 Eu1 O7 N3 -163.0(2) . . . . ?
O10 Eu1 O7 N3 -90.8(2) . . . . ?
O8 Eu1 O7 N3 -1.2(2) . . . . ?
O11 Eu1 O7 N3 -56.4(2) . . . . ?
O4 Eu1 O7 N3 151.4(2) . . . . ?
O9 N3 O8 Eu1 178.0(3) . . . . ?
O7 N3 O8 Eu1 -2.1(3) . . . . ?
O3 Eu1 O8 N3 -79.3(2) . . . . ?
O2 Eu1 O8 N3 173.26(19) . . . . ?
O1 Eu1 O8 N3 -157.0(2) . . . . ?
O5 Eu1 O8 N3 22.3(3) . . . . ?
O10 Eu1 O8 N3 80.5(2) . . . . ?
O11 Eu1 O8 N3 131.7(2) . . . . ?
O7 Eu1 O8 N3 1.18(19) . . . . ?
O4 Eu1 O8 N3 -44.0(3) . . . . ?
O12 N4 O10 Eu1 172.2(3) . . . . ?
O11 N4 O10 Eu1 -8.0(3) . . . . ?
O3 Eu1 O10 N4 137.0(2) . . . . ?
O2 Eu1 O10 N4 -54.6(2) . . . . ?
O1 Eu1 O10 N4 25.1(2) . . . . ?
O5 Eu1 O10 N4 -138.6(2) . . . . ?
O8 Eu1 O10 N4 90.9(2) . . . . ?
O11 Eu1 O10 N4 4.7(2) . . . . ?
O7 Eu1 O10 N4 142.8(2) . . . . ?
O4 Eu1 O10 N4 -126.2(2) . . . . ?
O12 N4 O11 Eu1 -172.4(3) . . . . ?
O10 N4 O11 Eu1 7.9(3) . . . . ?
O3 Eu1 O11 N4 -148.83(19) . . . . ?
O2 Eu1 O11 N4 112.7(2) . . . . ?
O1 Eu1 O11 N4 -165.5(2) . . . . ?
O5 Eu1 O11 N4 32.0(2) . . . . ?
O10 Eu1 O11 N4 -4.7(2) . . . . ?
O8 Eu1 O11 N4 -90.2(2) . . . . ?
O7 Eu1 O11 N4 -50.0(2) . . . . ?
O4 Eu1 O11 N4 85.7(2) . . . . ?
O1 N1 C1 C2 -177.2(3) . . . . ?
C5 N1 C1 C2 6.9(5) . . . . ?
O1 N1 C1 C6 3.7(4) . . . . ?
C5 N1 C1 C6 -172.3(3) . . . . ?
N1 C1 C2 C3 -2.3(5) . . . . ?
C6 C1 C2 C3 176.8(3) . . . . ?
C1 C2 C3 C4 -2.7(6) . . . . ?
C2 C3 C4 C5 3.4(6) . . . . ?
O1 N1 C5 C4 177.9(3) . . . . ?
C1 N1 C5 C4 -6.2(4) . . . . ?
O1 N1 C5 C7 0.2(4) . . . . ?
C1 N1 C5 C7 176.1(3) . . . . ?
C3 C4 C5 N1 1.0(5) . . . . ?
C3 C4 C5 C7 178.6(3) . . . . ?
C2 C1 C6 P1 93.2(4) . . . . ?
N1 C1 C6 P1 -87.7(3) . . . . ?
O2 P1 C6 C1 57.5(3) . . . . ?
C15 P1 C6 C1 177.0(3) . . . . ?
C8 P1 C6 C1 -58.4(3) . . . . ?
N1 C5 C7 P2 88.0(3) . . . . ?
C4 C5 C7 P2 -89.6(3) . . . . ?
O3 P2 C7 C5 -56.3(3) . . . . ?
C29 P2 C7 C5 -177.9(2) . . . . ?
C22 P2 C7 C5 58.3(3) . . . . ?
O2 P1 C8 C9 169.4(3) . . . . ?
C6 P1 C8 C9 -73.5(4) . . . . ?
C15 P1 C8 C9 43.2(4) . . . . ?
O2 P1 C8 C13 -18.3(3) . . . . ?
C6 P1 C8 C13 98.8(3) . . . . ?
C15 P1 C8 C13 -144.5(3) . . . . ?
C13 C8 C9 C10 -2.2(5) . . . . ?
P1 C8 C9 C10 169.6(3) . . . . ?
C13 C8 C9 C14 178.3(4) . . . . ?
P1 C8 C9 C14 -9.9(6) . . . . ?
C8 C9 C10 C11 -0.6(6) . . . . ?
C14 C9 C10 C11 178.9(4) . . . . ?
C9 C10 C11 C12 3.1(7) . . . . ?
C10 C11 C12 C13 -2.6(6) . . . . ?
C11 C12 C13 C8 -0.3(6) . . . . ?
C9 C8 C13 C12 2.7(5) . . . . ?
P1 C8 C13 C12 -170.7(3) . . . . ?
C10 C9 C14 F1 -1.6(6) . . . . ?
C8 C9 C14 F1 177.9(4) . . . . ?
C10 C9 C14 F2 118.8(4) . . . . ?
C8 C9 C14 F2 -61.7(5) . . . . ?
C10 C9 C14 F3 -123.1(4) . . . . ?
C8 C9 C14 F3 56.4(6) . . . . ?
O2 P1 C15 C20 133.6(3) . . . . ?
C6 P1 C15 C20 15.1(3) . . . . ?
C8 P1 C15 C20 -101.8(3) . . . . ?
O2 P1 C15 C16 -40.1(4) . . . . ?
C6 P1 C15 C16 -158.6(3) . . . . ?
C8 P1 C15 C16 84.5(4) . . . . ?
C20 C15 C16 C17 -1.6(6) . . . . ?
P1 C15 C16 C17 172.1(3) . . . . ?
C20 C15 C16 C21 179.1(4) . . . . ?
P1 C15 C16 C21 -7.2(6) . . . . ?
C15 C16 C17 C18 0.5(6) . . . . ?
C21 C16 C17 C18 179.8(4) . . . . ?
C16 C17 C18 C19 1.3(7) . . . . ?
C17 C18 C19 C20 -2.0(7) . . . . ?
C18 C19 C20 C15 0.9(7) . . . . ?
C16 C15 C20 C19 0.9(6) . . . . ?
P1 C15 C20 C19 -173.1(3) . . . . ?
C17 C16 C21 F6 -93.7(5) . . . . ?
C15 C16 C21 F6 85.5(5) . . . . ?
C17 C16 C21 F5 144.5(4) . . . . ?
C15 C16 C21 F5 -36.3(6) . . . . ?
C17 C16 C21 F4 24.7(6) . . . . ?
C15 C16 C21 F4 -156.1(4) . . . . ?
O3 P2 C22 C23 -176.4(3) . . . . ?
C29 P2 C22 C23 -51.4(4) . . . . ?
C7 P2 C22 C23 69.3(4) . . . . ?
O3 P2 C22 C27 11.4(3) . . . . ?
C29 P2 C22 C27 136.4(3) . . . . ?
C7 P2 C22 C27 -102.9(3) . . . . ?
C27 C22 C23 C24 1.9(6) . . . . ?
P2 C22 C23 C24 -170.0(3) . . . . ?
C27 C22 C23 C28 -176.4(4) . . . . ?
P2 C22 C23 C28 11.6(6) . . . . ?
C22 C23 C24 C25 -0.7(7) . . . . ?
C28 C23 C24 C25 177.8(5) . . . . ?
C23 C24 C25 C26 -0.9(9) . . . . ?
C24 C25 C26 C27 1.1(9) . . . . ?
C25 C26 C27 C22 0.3(8) . . . . ?
C23 C22 C27 C26 -1.8(7) . . . . ?
P2 C22 C27 C26 171.3(4) . . . . ?
C24 C23 C28 F9 136.4(4) . . . . ?
C22 C23 C28 F9 -45.2(6) . . . . ?
C24 C23 C28 F8 12.6(6) . . . . ?
C22 C23 C28 F8 -169.1(4) . . . . ?
C24 C23 C28 F7 -106.5(5) . . . . ?
C22 C23 C28 F7 71.9(5) . . . . ?
O3 P2 C29 C34 -116.3(3) . . . . ?
C7 P2 C29 C34 2.1(4) . . . . ?
C22 P2 C29 C34 121.3(3) . . . . ?
O3 P2 C29 C30 60.5(4) . . . . ?
C7 P2 C29 C30 179.0(3) . . . . ?
C22 P2 C29 C30 -61.8(4) . . . . ?
C34 C29 C30 C31 0.1(6) . . . . ?
P2 C29 C30 C31 -176.7(4) . . . . ?
C34 C29 C30 C_1 -177.6(4) . . . . ?
P2 C29 C30 C_1 5.6(6) . . . . ?
C29 C30 C31 C32 -1.2(8) . . . . ?
C_1 C30 C31 C32 176.6(5) . . . . ?
C30 C31 C32 C33 1.6(9) . . . . ?
C31 C32 C33 C34 -0.9(9) . . . . ?
C32 C33 C34 C29 -0.2(8) . . . . ?
C30 C29 C34 C33 0.6(6) . . . . ?
P2 C29 C34 C33 177.7(4) . . . . ?
C31 C30 C_1 F1D_1 158.3(6) . . . . ?
C29 C30 C_1 F1D_1 -23.9(8) . . . . ?
C31 C30 C_1 F6D_1 -161.9(7) . . . . ?
C29 C30 C_1 F6D_1 15.9(9) . . . . ?
C31 C30 C_1 F5D_1 -4.9(10) . . . . ?
C29 C30 C_1 F5D_1 172.8(8) . . . . ?
C31 C30 C_1 F2D_1 31.6(8) . . . . ?
C29 C30 C_1 F2D_1 -150.6(5) . . . . ?
C31 C30 C_1 F3D_1 -82.0(6) . . . . ?
C29 C30 C_1 F3D_1 95.7(6) . . . . ?
C31 C30 C_1 F4D_1 98.5(7) . . . . ?
C29 C30 C_1 F4D_1 -83.7(7) . . . . ?
F5D_1 C_1 F1D_1 F6D_1 -94.5(13) . . . . ?
F2D_1 C_1 F1D_1 F6D_1 -127.5(10) . . . . ?
F3D_1 C_1 F1D_1 F6D_1 -18.1(9) . . . . ?
C30 C_1 F1D_1 F6D_1 103.7(10) . . . . ?
F4D_1 C_1 F1D_1 F6D_1 -166.1(11) . . . . ?
F6D_1 C_1 F1D_1 F4D_1 166.1(11) . . . . ?
F5D_1 C_1 F1D_1 F4D_1 71.6(11) . . . . ?
F2D_1 C_1 F1D_1 F4D_1 38.7(7) . . . . ?
F3D_1 C_1 F1D_1 F4D_1 148.0(7) . . . . ?
C30 C_1 F1D_1 F4D_1 -90.2(8) . . . . ?
F1D_1 C_1 F2D_1 F5D_1 124.8(12) . . . . ?
F6D_1 C_1 F2D_1 F5D_1 91.4(14) . . . . ?
F3D_1 C_1 F2D_1 F5D_1 14.4(12) . . . . ?
C30 C_1 F2D_1 F5D_1 -102.8(12) . . . . ?
F4D_1 C_1 F2D_1 F5D_1 160.4(13) . . . . ?
F1D_1 C_1 F2D_1 F4D_1 -35.6(7) . . . . ?
F6D_1 C_1 F2D_1 F4D_1 -69.0(9) . . . . ?
F5D_1 C_1 F2D_1 F4D_1 -160.4(13) . . . . ?
F3D_1 C_1 F2D_1 F4D_1 -146.0(7) . . . . ?
C30 C_1 F2D_1 F4D_1 96.8(7) . . . . ?
F1D_1 C_1 F3D_1 F5D_1 -120.9(8) . . . . ?
F6D_1 C_1 F3D_1 F5D_1 -131.5(8) . . . . ?
F2D_1 C_1 F3D_1 F5D_1 -8.4(7) . . . . ?
C30 C_1 F3D_1 F5D_1 111.1(7) . . . . ?
F4D_1 C_1 F3D_1 F5D_1 -69.9(12) . . . . ?
F1D_1 C_1 F3D_1 F6D_1 10.7(5) . . . . ?
F5D_1 C_1 F3D_1 F6D_1 131.5(8) . . . . ?
F2D_1 C_1 F3D_1 F6D_1 123.2(7) . . . . ?
C30 C_1 F3D_1 F6D_1 -117.4(6) . . . . ?
F4D_1 C_1 F3D_1 F6D_1 61.7(12) . . . . ?
F6D_1 F1D_1 F4D_1 F2D_1 -5(2) . . . . ?
C_1 F1D_1 F4D_1 F2D_1 -30.6(5) . . . . ?
F6D_1 F1D_1 F4D_1 C_1 26(2) . . . . ?
F5D_1 F2D_1 F4D_1 F1D_1 4(2) . . . . ?
C_1 F2D_1 F4D_1 F1D_1 30.2(5) . . . . ?
F5D_1 F2D_1 F4D_1 C_1 -26.2(17) . . . . ?
F6D_1 C_1 F4D_1 F1D_1 -7.8(6) . . . . ?
F5D_1 C_1 F4D_1 F1D_1 -127.4(8) . . . . ?
F2D_1 C_1 F4D_1 F1D_1 -138.1(7) . . . . ?
F3D_1 C_1 F4D_1 F1D_1 -64.6(12) . . . . ?
C30 C_1 F4D_1 F1D_1 114.5(5) . . . . ?
F1D_1 C_1 F4D_1 F2D_1 138.1(7) . . . . ?
F6D_1 C_1 F4D_1 F2D_1 130.3(7) . . . . ?
F5D_1 C_1 F4D_1 F2D_1 10.7(7) . . . . ?
F3D_1 C_1 F4D_1 F2D_1 73.5(11) . . . . ?
C30 C_1 F4D_1 F2D_1 -107.4(6) . . . . ?
F4D_1 F2D_1 F5D_1 C_1 25.4(16) . . . . ?
C_1 F2D_1 F5D_1 F3D_1 -16.8(14) . . . . ?
F4D_1 F2D_1 F5D_1 F3D_1 9(3) . . . . ?
F1D_1 C_1 F5D_1 F2D_1 -69.9(14) . . . . ?
F6D_1 C_1 F5D_1 F2D_1 -110.3(13) . . . . ?
F3D_1 C_1 F5D_1 F2D_1 -165.1(13) . . . . ?
C30 C_1 F5D_1 F2D_1 92.4(11) . . . . ?
F4D_1 C_1 F5D_1 F2D_1 -17.5(12) . . . . ?
F1D_1 C_1 F5D_1 F3D_1 95.2(8) . . . . ?
F6D_1 C_1 F5D_1 F3D_1 54.8(8) . . . . ?
F2D_1 C_1 F5D_1 F3D_1 165.1(13) . . . . ?
C30 C_1 F5D_1 F3D_1 -102.4(7) . . . . ?
F4D_1 C_1 F5D_1 F3D_1 147.7(7) . . . . ?
C_1 F3D_1 F5D_1 F2D_1 19.3(16) . . . . ?
F6D_1 F3D_1 F5D_1 F2D_1 -16.1(19) . . . . ?
F6D_1 F3D_1 F5D_1 C_1 -35.4(6) . . . . ?
F4D_1 F1D_1 F6D_1 C_1 -26(2) . . . . ?
C_1 F1D_1 F6D_1 F3D_1 18.8(9) . . . . ?
F4D_1 F1D_1 F6D_1 F3D_1 -7(3) . . . . ?
F5D_1 C_1 F6D_1 F1D_1 107.3(12) . . . . ?
F2D_1 C_1 F6D_1 F1D_1 67.9(12) . . . . ?
F3D_1 C_1 F6D_1 F1D_1 161.5(10) . . . . ?
C30 C_1 F6D_1 F1D_1 -96.8(9) . . . . ?
F4D_1 C_1 F6D_1 F1D_1 11.5(9) . . . . ?
F1D_1 C_1 F6D_1 F3D_1 -161.5(10) . . . . ?
F5D_1 C_1 F6D_1 F3D_1 -54.3(9) . . . . ?
F2D_1 C_1 F6D_1 F3D_1 -93.6(8) . . . . ?
C30 C_1 F6D_1 F3D_1 101.7(7) . . . . ?
F4D_1 C_1 F6D_1 F3D_1 -150.0(6) . . . . ?
C_1 F3D_1 F6D_1 F1D_1 -21.1(11) . . . . ?
F5D_1 F3D_1 F6D_1 F1D_1 14.7(13) . . . . ?
F5D_1 F3D_1 F6D_1 C_1 35.8(6) . . . . ?
