#------------------------------------------------------------------------------
#$Date: 2022-04-19 00:52:54 +0300 (Tue, 19 Apr 2022) $
#$Revision: 274561 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/12/99/7129984.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_7129984
loop_
_publ_author_name
'Tian, Jiaxin'
'Cordier, Marie'
'Bour, Christophe'
'Auffrant, Audrey'
'Gandon, Vincent'
_publ_section_title
;
 A Cyclic Divalent N(I) Species Isoelectronic to Carbodiphosphoranes
;
_journal_name_full               'Chemical Communications'
_journal_paper_doi               10.1039/D2CC01637K
_journal_year                    2022
_chemical_formula_moiety         'C34 H26 N P2, F6 P'
_chemical_formula_sum            'C34 H26 F6 N P3'
_chemical_formula_weight         655.47
_space_group_crystal_system      triclinic
_space_group_IT_number           1
_space_group_name_Hall           'P 1'
_space_group_name_H-M_alt        'P 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2022-03-03 deposited with the CCDC.	2022-04-18 downloaded from the CCDC.
;
_cell_angle_alpha                101.997(2)
_cell_angle_beta                 91.033(2)
_cell_angle_gamma                111.831(2)
_cell_formula_units_Z            1
_cell_length_a                   8.2282(7)
_cell_length_b                   9.5081(8)
_cell_length_c                   10.7126(8)
_cell_measurement_reflns_used    7940
_cell_measurement_temperature    150.0(1)
_cell_measurement_theta_max      26.7171
_cell_measurement_theta_min      2.3718
_cell_volume                     756.79(11)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'PLATON (Spek, 2009)'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_structure_solution    SHELXT(Sheldrick,2014)
_diffrn_ambient_temperature      150(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.991
_diffrn_measurement_device_type  'Kappa APEX II'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.0498
_diffrn_reflns_av_unetI/netI     0.0513
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.991
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       -13
_diffrn_reflns_number            19925
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.991
_diffrn_reflns_theta_full        25.240
_diffrn_reflns_theta_max         26.984
_diffrn_reflns_theta_min         1.954
_exptl_absorpt_coefficient_mu    0.260
_exptl_absorpt_correction_T_max  0.7454
_exptl_absorpt_correction_T_min  0.6382
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.438
_exptl_crystal_description       block
_exptl_crystal_F_000             336
_exptl_crystal_size_max          0.180
_exptl_crystal_size_mid          0.140
_exptl_crystal_size_min          0.100
_refine_diff_density_max         0.228
_refine_diff_density_min         -0.197
_refine_diff_density_rms         0.040
_refine_ls_abs_structure_details
;
 Refined as an inversion twin.
;
_refine_ls_abs_structure_Flack   -0.02(8)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.008
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     398
_refine_ls_number_reflns         6488
_refine_ls_number_restraints     3
_refine_ls_restrained_S_all      1.007
_refine_ls_R_factor_all          0.0388
_refine_ls_R_factor_gt           0.0312
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0420P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0739
_refine_ls_wR_factor_ref         0.0774
_reflns_Friedel_coverage         1.000
_reflns_Friedel_fraction_full    0.999
_reflns_Friedel_fraction_max     0.991
_reflns_number_gt                5891
_reflns_number_total             6488
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d2cc01637k2.cif
_cod_data_source_block           tian36_a
_cod_database_code               7129984
_shelx_shelxl_version_number     2014/7
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_min   0.955
_shelx_estimated_absorpt_t_max   0.974
loop_
_space_group_symop_operation_xyz
'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
P1 P 0.69874(8) 0.49686(8) 0.27357(7) 0.01853(16) Uani 1 1 d . . . . .
P2 P 0.67813(8) 0.47416(8) 0.51823(7) 0.01789(16) Uani 1 1 d . . . . .
N1 N 0.7871(3) 0.4676(3) 0.3948(2) 0.0214(5) Uani 1 1 d . . . . .
C1 C 0.5039(3) 0.5217(3) 0.3313(3) 0.0185(6) Uani 1 1 d . . . . .
C2 C 0.4947(3) 0.5129(3) 0.4598(3) 0.0174(6) Uani 1 1 d . . . . .
C3 C 0.3582(3) 0.5364(3) 0.5253(3) 0.0227(6) Uani 1 1 d . . . . .
H3 H 0.3516 0.5319 0.6129 0.027 Uiso 1 1 calc R U . . .
C4 C 0.2331(4) 0.5663(4) 0.4596(3) 0.0260(6) Uani 1 1 d . . . . .
H4 H 0.1402 0.5836 0.5030 0.031 Uiso 1 1 calc R U . . .
C5 C 0.2412(4) 0.5715(4) 0.3308(3) 0.0291(7) Uani 1 1 d . . . . .
H5 H 0.1520 0.5895 0.2869 0.035 Uiso 1 1 calc R U . . .
C6 C 0.3772(4) 0.5507(4) 0.2660(3) 0.0245(6) Uani 1 1 d . . . . .
H6 H 0.3838 0.5562 0.1786 0.029 Uiso 1 1 calc R U . . .
C7 C 0.8218(4) 0.6601(4) 0.2067(3) 0.0228(6) Uani 1 1 d . . . . .
C8 C 0.8150(4) 0.6016(4) 0.0805(3) 0.0290(7) Uani 1 1 d . . . . .
H8 H 0.8647 0.6664 0.0233 0.035 Uiso 1 1 calc R U . . .
C9 C 0.7270(4) 0.4326(4) 0.0360(3) 0.0289(7) Uani 1 1 d . . . . .
H9 H 0.7199 0.3815 -0.0513 0.035 Uiso 1 1 calc R U . . .
C10 C 0.6568(4) 0.3536(4) 0.1248(3) 0.0221(6) Uani 1 1 d . . . . .
C11 C 0.8973(4) 0.8237(4) 0.2778(3) 0.0264(7) Uani 1 1 d . . . . .
C12 C 0.9739(4) 0.8649(4) 0.4044(3) 0.0341(8) Uani 1 1 d . . . . .
H12 H 0.9731 0.7862 0.4467 0.041 Uiso 1 1 calc R U . . .
C13 C 1.0505(5) 1.0192(5) 0.4680(4) 0.0488(10) Uani 1 1 d . . . . .
H13 H 1.1040 1.0468 0.5535 0.059 Uiso 1 1 calc R U . . .
C14 C 1.0498(5) 1.1339(4) 0.4077(5) 0.0538(11) Uani 1 1 d . . . . .
H14 H 1.1014 1.2401 0.4524 0.065 Uiso 1 1 calc R U . . .
C15 C 0.9744(5) 1.0951(5) 0.2828(5) 0.0515(11) Uani 1 1 d . . . . .
H15 H 0.9756 1.1745 0.2413 0.062 Uiso 1 1 calc R U . . .
C16 C 0.8979(4) 0.9415(4) 0.2188(4) 0.0372(8) Uani 1 1 d . . . . .
H16 H 0.8446 0.9151 0.1333 0.045 Uiso 1 1 calc R U . . .
C17 C 0.5689(4) 0.1843(4) 0.1097(3) 0.0242(7) Uani 1 1 d . . . . .
C18 C 0.4387(4) 0.1208(4) 0.1855(3) 0.0334(7) Uani 1 1 d . . . . .
H18 H 0.4064 0.1881 0.2496 0.040 Uiso 1 1 calc R U . . .
C19 C 0.3554(5) -0.0383(4) 0.1693(4) 0.0409(9) Uani 1 1 d . . . . .
H19 H 0.2658 -0.0801 0.2214 0.049 Uiso 1 1 calc R U . . .
C20 C 0.4030(5) -0.1361(4) 0.0772(3) 0.0390(9) Uani 1 1 d . . . . .
H20 H 0.3470 -0.2457 0.0666 0.047 Uiso 1 1 calc R U . . .
C21 C 0.5308(5) -0.0762(4) 0.0006(4) 0.0387(8) Uani 1 1 d . . . . .
H21 H 0.5611 -0.1446 -0.0639 0.046 Uiso 1 1 calc R U . . .
C22 C 0.6159(4) 0.0834(4) 0.0166(3) 0.0313(7) Uani 1 1 d . . . . .
H22 H 0.7059 0.1243 -0.0355 0.038 Uiso 1 1 calc R U . . .
C23 C 0.8004(4) 0.6288(3) 0.6526(3) 0.0203(6) Uani 1 1 d . . . . .
C24 C 0.9332(4) 0.6124(4) 0.7228(3) 0.0255(6) Uani 1 1 d . . . . .
H24 H 0.9479 0.5160 0.7068 0.031 Uiso 1 1 calc R U . . .
C25 C 1.0445(4) 0.7383(4) 0.8164(3) 0.0312(7) Uani 1 1 d . . . . .
H25 H 1.1368 0.7283 0.8638 0.037 Uiso 1 1 calc R U . . .
C26 C 1.0216(4) 0.8781(4) 0.8410(3) 0.0328(7) Uani 1 1 d . . . . .
H26 H 1.0977 0.9636 0.9054 0.039 Uiso 1 1 calc R U . . .
C27 C 0.8885(4) 0.8935(4) 0.7722(3) 0.0343(8) Uani 1 1 d . . . . .
H27 H 0.8724 0.9894 0.7898 0.041 Uiso 1 1 calc R U . . .
C28 C 0.7786(4) 0.7699(4) 0.6778(3) 0.0296(7) Uani 1 1 d . . . . .
H28 H 0.6877 0.7812 0.6299 0.036 Uiso 1 1 calc R U . . .
C29 C 0.6104(4) 0.2937(3) 0.5675(3) 0.0213(6) Uani 1 1 d . . . . .
C30 C 0.6332(5) 0.1668(4) 0.4902(3) 0.0341(8) Uani 1 1 d . . . . .
H30 H 0.6883 0.1772 0.4136 0.041 Uiso 1 1 calc R U . . .
C31 C 0.5755(6) 0.0259(4) 0.5249(4) 0.0464(10) Uani 1 1 d . . . . .
H31 H 0.5903 -0.0611 0.4721 0.056 Uiso 1 1 calc R U . . .
C32 C 0.4959(5) 0.0110(4) 0.6367(4) 0.0415(9) Uani 1 1 d . . . . .
H32 H 0.4564 -0.0864 0.6602 0.050 Uiso 1 1 calc R U . . .
C33 C 0.4734(4) 0.1358(4) 0.7142(4) 0.0330(8) Uani 1 1 d . . . . .
H33 H 0.4189 0.1247 0.7909 0.040 Uiso 1 1 calc R U . . .
C34 C 0.5306(4) 0.2782(4) 0.6798(3) 0.0252(6) Uani 1 1 d . . . . .
H34 H 0.5152 0.3647 0.7329 0.030 Uiso 1 1 calc R U . . .
P3 P 0.14904(10) 0.36351(9) 0.89286(8) 0.02499(18) Uani 1 1 d . . . . .
F1 F 0.1229(2) 0.4944(2) 1.00068(19) 0.0394(5) Uani 1 1 d . . . . .
F2 F 0.2154(3) 0.4837(3) 0.8031(2) 0.0509(6) Uani 1 1 d . . . . .
F3 F 0.3471(3) 0.4177(3) 0.9523(2) 0.0537(6) Uani 1 1 d . . . . .
F4 F 0.0817(3) 0.2445(3) 0.9830(2) 0.0561(6) Uani 1 1 d . . . . .
F5 F -0.0487(2) 0.3103(3) 0.8315(2) 0.0449(5) Uani 1 1 d . . . . .
F6 F 0.1741(3) 0.2322(3) 0.7853(2) 0.0513(6) 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'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 '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
N1 P1 C10 116.91(13) . . ?
N1 P1 C1 103.10(12) . . ?
C10 P1 C1 114.03(13) . . ?
N1 P1 C7 119.33(13) . . ?
C10 P1 C7 94.84(14) . . ?
C1 P1 C7 108.95(13) . . ?
N1 P1 P2 33.75(8) . . ?
C10 P1 P2 132.46(10) . . ?
C1 P1 P2 69.35(9) . . ?
C7 P1 P2 130.35(11) . . ?
N1 P2 C29 110.60(13) . . ?
N1 P2 C23 113.14(13) . . ?
C29 P2 C23 108.50(14) . . ?
N1 P2 C2 102.64(12) . . ?
C29 P2 C2 112.91(12) . . ?
C23 P2 C2 109.03(13) . . ?
N1 P2 P1 33.42(8) . . ?
C29 P2 P1 124.01(10) . . ?
C23 P2 P1 123.93(10) . . ?
C2 P2 P1 69.22(9) . . ?
P1 N1 P2 112.83(13) . . ?
C6 C1 C2 121.0(3) . . ?
C6 C1 P1 128.2(2) . . ?
C2 C1 P1 110.72(19) . . ?
C3 C2 C1 120.1(3) . . ?
C3 C2 P2 129.2(2) . . ?
C1 C2 P2 110.7(2) . . ?
C4 C3 C2 118.4(3) . . ?
C4 C3 H3 120.8 . . ?
C2 C3 H3 120.8 . . ?
C3 C4 C5 121.1(3) . . ?
C3 C4 H4 119.5 . . ?
C5 C4 H4 119.5 . . ?
C6 C5 C4 120.8(3) . . ?
C6 C5 H5 119.6 . . ?
C4 C5 H5 119.6 . . ?
C5 C6 C1 118.6(3) . . ?
C5 C6 H6 120.7 . . ?
C1 C6 H6 120.7 . . ?
C8 C7 C11 128.6(3) . . ?
C8 C7 P1 106.0(2) . . ?
C11 C7 P1 125.3(2) . . ?
C7 C8 C9 116.4(3) . . ?
C7 C8 H8 121.8 . . ?
C9 C8 H8 121.8 . . ?
C10 C9 C8 116.5(3) . . ?
C10 C9 H9 121.7 . . ?
C8 C9 H9 121.7 . . ?
C9 C10 C17 128.6(3) . . ?
C9 C10 P1 106.2(2) . . ?
C17 C10 P1 125.3(2) . . ?
C16 C11 C12 118.7(3) . . ?
C16 C11 C7 120.4(3) . . ?
C12 C11 C7 120.9(3) . . ?
C13 C12 C11 120.2(4) . . ?
C13 C12 H12 119.9 . . ?
C11 C12 H12 119.9 . . ?
C12 C13 C14 120.2(4) . . ?
C12 C13 H13 119.9 . . ?
C14 C13 H13 119.9 . . ?
C13 C14 C15 120.4(4) . . ?
C13 C14 H14 119.8 . . ?
C15 C14 H14 119.8 . . ?
C16 C15 C14 119.8(4) . . ?
C16 C15 H15 120.1 . . ?
C14 C15 H15 120.1 . . ?
C15 C16 C11 120.8(4) . . ?
C15 C16 H16 119.6 . . ?
C11 C16 H16 119.6 . . ?
C18 C17 C22 118.6(3) . . ?
C18 C17 C10 121.6(3) . . ?
C22 C17 C10 119.8(3) . . ?
C19 C18 C17 121.2(3) . . ?
C19 C18 H18 119.4 . . ?
C17 C18 H18 119.4 . . ?
C20 C19 C18 119.6(3) . . ?
C20 C19 H19 120.2 . . ?
C18 C19 H19 120.2 . . ?
C21 C20 C19 120.4(3) . . ?
C21 C20 H20 119.8 . . ?
C19 C20 H20 119.8 . . ?
C20 C21 C22 120.5(3) . . ?
C20 C21 H21 119.8 . . ?
C22 C21 H21 119.8 . . ?
C21 C22 C17 119.8(3) . . ?
C21 C22 H22 120.1 . . ?
C17 C22 H22 120.1 . . ?
C24 C23 C28 119.8(3) . . ?
C24 C23 P2 118.5(2) . . ?
C28 C23 P2 121.2(2) . . ?
C23 C24 C25 119.5(3) . . ?
C23 C24 H24 120.3 . . ?
C25 C24 H24 120.3 . . ?
C26 C25 C24 120.3(3) . . ?
C26 C25 H25 119.9 . . ?
C24 C25 H25 119.9 . . ?
C27 C26 C25 120.2(3) . . ?
C27 C26 H26 119.9 . . ?
C25 C26 H26 119.9 . . ?
C26 C27 C28 120.1(3) . . ?
C26 C27 H27 120.0 . . ?
C28 C27 H27 120.0 . . ?
C27 C28 C23 120.2(3) . . ?
C27 C28 H28 119.9 . . ?
C23 C28 H28 119.9 . . ?
C34 C29 C30 119.9(3) . . ?
C34 C29 P2 120.7(2) . . ?
C30 C29 P2 119.4(2) . . ?
C31 C30 C29 119.8(3) . . ?
C31 C30 H30 120.1 . . ?
C29 C30 H30 120.1 . . ?
C30 C31 C32 120.1(3) . . ?
C30 C31 H31 120.0 . . ?
C32 C31 H31 120.0 . . ?
C33 C32 C31 120.6(3) . . ?
C33 C32 H32 119.7 . . ?
C31 C32 H32 119.7 . . ?
C32 C33 C34 119.8(3) . . ?
C32 C33 H33 120.1 . . ?
C34 C33 H33 120.1 . . ?
C33 C34 C29 119.8(3) . . ?
C33 C34 H34 120.1 . . ?
C29 C34 H34 120.1 . . ?
F4 P3 F3 91.22(14) . . ?
F4 P3 F6 90.45(14) . . ?
F3 P3 F6 90.09(12) . . ?
F4 P3 F1 89.33(13) . . ?
F3 P3 F1 90.15(11) . . ?
F6 P3 F1 179.69(13) . . ?
F4 P3 F2 179.45(14) . . ?
F3 P3 F2 89.04(13) . . ?
F6 P3 F2 90.03(13) . . ?
F1 P3 F2 90.18(12) . . ?
F4 P3 F5 89.56(13) . . ?
F3 P3 F5 179.18(15) . . ?
F6 P3 F5 89.67(12) . . ?
F1 P3 F5 90.10(11) . . ?
F2 P3 F5 90.18(13) . . ?
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
P1 N1 1.600(2) . ?
P1 C10 1.801(3) . ?
P1 C1 1.807(3) . ?
P1 C7 1.808(3) . ?
P1 P2 2.6775(10) . ?
P2 N1 1.614(2) . ?
P2 C29 1.791(3) . ?
P2 C23 1.792(3) . ?
P2 C2 1.811(3) . ?
C1 C6 1.386(4) . ?
C1 C2 1.398(4) . ?
C2 C3 1.398(4) . ?
C3 C4 1.382(4) . ?
C3 H3 0.9500 . ?
C4 C5 1.393(5) . ?
C4 H4 0.9500 . ?
C5 C6 1.382(4) . ?
C5 H5 0.9500 . ?
C6 H6 0.9500 . ?
C7 C8 1.342(4) . ?
C7 C11 1.469(4) . ?
C8 C9 1.462(4) . ?
C8 H8 0.9500 . ?
C9 C10 1.341(4) . ?
C9 H9 0.9500 . ?
C10 C17 1.470(4) . ?
C11 C16 1.394(5) . ?
C11 C12 1.398(5) . ?
C12 C13 1.377(5) . ?
C12 H12 0.9500 . ?
C13 C14 1.379(6) . ?
C13 H13 0.9500 . ?
C14 C15 1.380(6) . ?
C14 H14 0.9500 . ?
C15 C16 1.373(5) . ?
C15 H15 0.9500 . ?
C16 H16 0.9500 . ?
C17 C18 1.387(4) . ?
C17 C22 1.399(4) . ?
C18 C19 1.380(5) . ?
C18 H18 0.9500 . ?
C19 C20 1.376(5) . ?
C19 H19 0.9500 . ?
C20 C21 1.373(5) . ?
C20 H20 0.9500 . ?
C21 C22 1.386(5) . ?
C21 H21 0.9500 . ?
C22 H22 0.9500 . ?
C23 C24 1.389(4) . ?
C23 C28 1.392(4) . ?
C24 C25 1.389(4) . ?
C24 H24 0.9500 . ?
C25 C26 1.384(5) . ?
C25 H25 0.9500 . ?
C26 C27 1.378(5) . ?
C26 H26 0.9500 . ?
C27 C28 1.380(5) . ?
C27 H27 0.9500 . ?
C28 H28 0.9500 . ?
C29 C34 1.389(4) . ?
C29 C30 1.391(4) . ?
C30 C31 1.378(5) . ?
C30 H30 0.9500 . ?
C31 C32 1.382(6) . ?
C31 H31 0.9500 . ?
C32 C33 1.375(5) . ?
C32 H32 0.9500 . ?
C33 C34 1.389(4) . ?
C33 H33 0.9500 . ?
C34 H34 0.9500 . ?
P3 F4 1.590(2) . ?
P3 F3 1.590(2) . ?
P3 F6 1.591(2) . ?
P3 F1 1.594(2) . ?
P3 F2 1.594(2) . ?
P3 F5 1.595(2) . ?
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
C10 P1 N1 P2 -127.09(15) . . . . ?
C1 P1 N1 P2 -1.16(17) . . . . ?
C7 P1 N1 P2 119.72(16) . . . . ?
C29 P2 N1 P1 121.01(15) . . . . ?
C23 P2 N1 P1 -117.03(16) . . . . ?
C2 P2 N1 P1 0.30(18) . . . . ?
N1 P1 C1 C6 179.9(3) . . . . ?
C10 P1 C1 C6 -52.4(3) . . . . ?
C7 P1 C1 C6 52.2(3) . . . . ?
P2 P1 C1 C6 179.2(3) . . . . ?
N1 P1 C1 C2 1.8(2) . . . . ?
C10 P1 C1 C2 129.6(2) . . . . ?
C7 P1 C1 C2 -125.9(2) . . . . ?
P2 P1 C1 C2 1.15(16) . . . . ?
C6 C1 C2 C3 -1.2(4) . . . . ?
P1 C1 C2 C3 177.0(2) . . . . ?
C6 C1 C2 P2 -179.9(2) . . . . ?
P1 C1 C2 P2 -1.7(2) . . . . ?
N1 P2 C2 C3 -177.6(3) . . . . ?
C29 P2 C2 C3 63.3(3) . . . . ?
C23 P2 C2 C3 -57.3(3) . . . . ?
P1 P2 C2 C3 -177.4(3) . . . . ?
N1 P2 C2 C1 1.0(2) . . . . ?
C29 P2 C2 C1 -118.1(2) . . . . ?
C23 P2 C2 C1 121.2(2) . . . . ?
P1 P2 C2 C1 1.15(16) . . . . ?
C1 C2 C3 C4 0.8(4) . . . . ?
P2 C2 C3 C4 179.2(2) . . . . ?
C2 C3 C4 C5 0.6(4) . . . . ?
C3 C4 C5 C6 -1.6(5) . . . . ?
C4 C5 C6 C1 1.2(5) . . . . ?
C2 C1 C6 C5 0.2(4) . . . . ?
P1 C1 C6 C5 -177.6(2) . . . . ?
N1 P1 C7 C8 128.3(2) . . . . ?
C10 P1 C7 C8 3.7(2) . . . . ?
C1 P1 C7 C8 -113.8(2) . . . . ?
P2 P1 C7 C8 167.61(17) . . . . ?
N1 P1 C7 C11 -56.8(3) . . . . ?
C10 P1 C7 C11 178.5(3) . . . . ?
C1 P1 C7 C11 61.1(3) . . . . ?
P2 P1 C7 C11 -17.5(3) . . . . ?
C11 C7 C8 C9 -178.5(3) . . . . ?
P1 C7 C8 C9 -3.9(3) . . . . ?
C7 C8 C9 C10 2.1(4) . . . . ?
C8 C9 C10 C17 -176.8(3) . . . . ?
C8 C9 C10 P1 0.9(3) . . . . ?
N1 P1 C10 C9 -129.0(2) . . . . ?
C1 P1 C10 C9 110.7(2) . . . . ?
C7 P1 C10 C9 -2.6(2) . . . . ?
P2 P1 C10 C9 -165.97(16) . . . . ?
N1 P1 C10 C17 48.7(3) . . . . ?
C1 P1 C10 C17 -71.6(3) . . . . ?
C7 P1 C10 C17 175.2(2) . . . . ?
P2 P1 C10 C17 11.8(3) . . . . ?
C8 C7 C11 C16 30.7(5) . . . . ?
P1 C7 C11 C16 -143.0(3) . . . . ?
C8 C7 C11 C12 -147.6(3) . . . . ?
P1 C7 C11 C12 38.7(4) . . . . ?
C16 C11 C12 C13 -1.0(5) . . . . ?
C7 C11 C12 C13 177.3(3) . . . . ?
C11 C12 C13 C14 0.9(6) . . . . ?
C12 C13 C14 C15 -0.8(6) . . . . ?
C13 C14 C15 C16 0.8(6) . . . . ?
C14 C15 C16 C11 -0.9(6) . . . . ?
C12 C11 C16 C15 1.0(5) . . . . ?
C7 C11 C16 C15 -177.3(3) . . . . ?
C9 C10 C17 C18 -150.8(3) . . . . ?
P1 C10 C17 C18 32.0(4) . . . . ?
C9 C10 C17 C22 29.0(5) . . . . ?
P1 C10 C17 C22 -148.3(2) . . . . ?
C22 C17 C18 C19 -0.6(5) . . . . ?
C10 C17 C18 C19 179.1(3) . . . . ?
C17 C18 C19 C20 0.6(5) . . . . ?
C18 C19 C20 C21 -0.9(5) . . . . ?
C19 C20 C21 C22 1.2(5) . . . . ?
C20 C21 C22 C17 -1.3(5) . . . . ?
C18 C17 C22 C21 1.0(4) . . . . ?
C10 C17 C22 C21 -178.8(3) . . . . ?
N1 P2 C23 C24 -74.8(3) . . . . ?
C29 P2 C23 C24 48.3(3) . . . . ?
C2 P2 C23 C24 171.7(2) . . . . ?
P1 P2 C23 C24 -111.1(2) . . . . ?
N1 P2 C23 C28 97.6(3) . . . . ?
C29 P2 C23 C28 -139.3(2) . . . . ?
C2 P2 C23 C28 -15.9(3) . . . . ?
P1 P2 C23 C28 61.3(3) . . . . ?
C28 C23 C24 C25 -0.8(4) . . . . ?
P2 C23 C24 C25 171.6(2) . . . . ?
C23 C24 C25 C26 1.0(5) . . . . ?
C24 C25 C26 C27 -0.3(5) . . . . ?
C25 C26 C27 C28 -0.5(5) . . . . ?
C26 C27 C28 C23 0.7(5) . . . . ?
C24 C23 C28 C27 0.0(5) . . . . ?
P2 C23 C28 C27 -172.3(3) . . . . ?
N1 P2 C29 C34 173.3(2) . . . . ?
C23 P2 C29 C34 48.6(3) . . . . ?
C2 P2 C29 C34 -72.3(3) . . . . ?
P1 P2 C29 C34 -152.0(2) . . . . ?
N1 P2 C29 C30 -8.8(3) . . . . ?
C23 P2 C29 C30 -133.4(2) . . . . ?
C2 P2 C29 C30 105.6(3) . . . . ?
P1 P2 C29 C30 25.9(3) . . . . ?
C34 C29 C30 C31 0.4(5) . . . . ?
P2 C29 C30 C31 -177.6(3) . . . . ?
C29 C30 C31 C32 -0.3(5) . . . . ?
C30 C31 C32 C33 0.0(6) . . . . ?
C31 C32 C33 C34 0.2(5) . . . . ?
C32 C33 C34 C29 -0.1(5) . . . . ?
C30 C29 C34 C33 -0.2(4) . . . . ?
P2 C29 C34 C33 177.7(2) . . . . ?
