#------------------------------------------------------------------------------
#$Date: 2017-09-11 03:39:10 +0300 (Mon, 11 Sep 2017) $
#$Revision: 200432 $
#$URL: file:///home/coder/svn-repositories/cod/cif/8/10/07/8100718.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_8100718
loop_
_publ_author_name
'Tinant, Bernard'
'Declercq, Jean-Paul'
'Wullens, Hilda'
'Devillers, Michel'
_publ_section_title
;
Crystal structure of di(hexaphenyldiphosphazenium) ethanolpentachlorobismuthate
(III), (C₃₆H₃₀P₂N)₂[BiCl₅(C₂H₆O)]
;
_journal_issue                   3
_journal_name_full
'Zeitschrift für Kristallographie - New Crystal Structures'
_journal_page_first              385
_journal_page_last               388
_journal_volume                  217
_journal_year                    2002
_chemical_formula_structural     '[C36 H30 P2 N]2 [BiCl5 C2 H6 O]'
_chemical_formula_sum            'C74 H66 Bi Cl5 N2 O P4'
_chemical_formula_weight         1509.42
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                75.06(2)
_cell_angle_beta                 71.68(2)
_cell_angle_gamma                71.73(2)
_cell_formula_units_Z            2
_cell_length_a                   13.751(3)
_cell_length_b                   16.190(4)
_cell_length_c                   17.100(4)
_cell_measurement_temperature    293(2)
_cell_volume                     3377.8(14)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.484
_refine_diff_density_rms         0.090
_cod_depositor_comments
;
 Marking attached hydrogen atoms.

 Antanas Vaitkus,
 2017-09-11
;
_cod_database_code               8100718
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-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_symmetry_multiplicity
_atom_site_Wyckoff_symbol
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
_atom_site_attached_hydrogens
Bi Bi3+ 0.000223(15) 0.270782(12) 0.221066(12) 0.03774(7) Uani 1 2 i d . . . 0
Cl1 Cl 0.04603(11) 0.14261(9) 0.13254(8) 0.0566(3) Uani 1 2 i d . A . 0
Cl2 Cl -0.06717(11) 0.41112(10) 0.30219(11) 0.0696(4) Uani 1 2 i d . A . 0
Cl3 Cl 0.18098(13) 0.31950(11) 0.12134(11) 0.0747(4) Uani 1 2 i d . A . 0
Cl4 Cl -0.17973(17) 0.22986(15) 0.30240(15) 0.1327(10) Uani 1 2 i d . A . 0
Cl5 Cl 0.09960(16) 0.17263(11) 0.32488(10) 0.0870(6) Uani 1 2 i d . A . 0
O1A O -0.0913(19) 0.382(2) 0.0925(15) 0.34(2) Uani 0.574(16) 2 i d PDU A 1 1
C2A C -0.158(2) 0.4547(18) 0.0420(19) 0.46(4) Uani 0.574(16) 2 i d PDU A 1 0
H2A1 H -0.2110 0.4948 0.0772 0.062(2) Uiso 0.574(16) 2 i calc PR A 1 0
H2A2 H -0.1942 0.4302 0.0163 0.062(2) Uiso 0.574(16) 2 i calc PR A 1 0
C3A C -0.0812(16) 0.5022(9) -0.0244(11) 0.170(12) Uani 0.574(16) 2 i d PDU A 1
0
H3A1 H -0.1200 0.5537 -0.0548 0.062(2) Uiso 0.574(16) 2 i calc PR A 1 0
H3A2 H -0.0347 0.4633 -0.0623 0.062(2) Uiso 0.574(16) 2 i calc PR A 1 0
H3A3 H -0.0403 0.5195 0.0020 0.062(2) Uiso 0.574(16) 2 i calc PR A 1 0
O1B O -0.1205(18) 0.3226(12) 0.1064(13) 0.158(9) Uani 0.426(16) 2 i d PDU A 2 1
C2B C -0.1548(15) 0.3916(13) 0.0498(11) 0.093(8) Uani 0.426(16) 2 i d PDU A 2 0
H2B1 H -0.2313 0.4035 0.0638 0.062(2) Uiso 0.426(16) 2 i calc PR A 2 0
H2B2 H -0.1283 0.3726 -0.0041 0.062(2) Uiso 0.426(16) 2 i calc PR A 2 0
C3B C -0.128(3) 0.4789(16) 0.038(2) 0.32(3) Uani 0.426(16) 2 i d PDU A 2 0
H3B1 H -0.1661 0.5232 0.0015 0.062(2) Uiso 0.426(16) 2 i calc PR A 2 0
H3B2 H -0.0531 0.4718 0.0138 0.062(2) Uiso 0.426(16) 2 i calc PR A 2 0
H3B3 H -0.1469 0.4968 0.0913 0.062(2) Uiso 0.426(16) 2 i calc PR A 2 0
P1 P 0.26834(9) 0.21625(7) 0.66544(7) 0.0308(3) Uani 1 2 i d . . . 0
N2 N 0.3873(3) 0.2227(2) 0.6295(2) 0.0343(8) Uani 1 2 i d . . . 0
P3 P 0.47491(9) 0.22840(7) 0.54345(7) 0.0307(3) Uani 1 2 i d . . . 0
C4 C 0.2126(3) 0.2578(3) 0.7620(3) 0.0351(10) Uani 1 2 i d . . . 0
C5 C 0.2635(4) 0.2178(4) 0.8251(3) 0.0569(14) Uani 1 2 i d . . . 0
H5 H 0.3264 0.1741 0.8148 0.062(2) Uiso 1 2 i calc R . . 0
C6 C 0.2232(5) 0.2415(4) 0.9028(3) 0.0668(17) Uani 1 2 i d . . . 0
H6 H 0.2588 0.2145 0.9445 0.062(2) Uiso 1 2 i calc R . . 0
C7 C 0.1303(5) 0.3048(4) 0.9182(3) 0.0668(17) Uani 1 2 i d . . . 0
H7 H 0.1011 0.3200 0.9711 0.062(2) Uiso 1 2 i calc R . . 0
C8 C 0.0804(5) 0.3457(5) 0.8559(4) 0.077(2) Uani 1 2 i d . . . 0
H8 H 0.0184 0.3903 0.8662 0.062(2) Uiso 1 2 i calc R . . 0
C9 C 0.1199(4) 0.3223(4) 0.7790(3) 0.0549(14) Uani 1 2 i d . . . 0
H9 H 0.0839 0.3501 0.7376 0.062(2) Uiso 1 2 i calc R . . 0
C10 C 0.2575(4) 0.1040(3) 0.6966(3) 0.0352(10) Uani 1 2 i d . . . 0
C11 C 0.3480(4) 0.0347(3) 0.6919(3) 0.0444(12) Uani 1 2 i d . . . 0
H11 H 0.4143 0.0460 0.6670 0.062(2) Uiso 1 2 i calc R . . 0
C12 C 0.3397(5) -0.0510(3) 0.7241(3) 0.0569(14) Uani 1 2 i d . . . 0
H12 H 0.4005 -0.0974 0.7215 0.062(2) Uiso 1 2 i calc R . . 0
C13 C 0.2421(6) -0.0677(4) 0.7599(3) 0.0614(17) Uani 1 2 i d . . . 0
H13 H 0.2368 -0.1256 0.7812 0.062(2) Uiso 1 2 i calc R . . 0
C14 C 0.1520(5) 0.0004(4) 0.7644(3) 0.0584(15) Uani 1 2 i d . . . 0
H14 H 0.0859 -0.0115 0.7880 0.062(2) Uiso 1 2 i calc R . . 0
C15 C 0.1592(4) 0.0860(3) 0.7342(3) 0.0471(12) Uani 1 2 i d . . . 0
H15 H 0.0981 0.1321 0.7388 0.062(2) Uiso 1 2 i calc R . . 0
C16 C 0.1862(3) 0.2760(3) 0.5959(3) 0.0378(11) Uani 1 2 i d . . . 0
C17 C 0.1777(4) 0.3658(4) 0.5696(3) 0.0541(14) Uani 1 2 i d . . . 0
H17 H 0.2097 0.3939 0.5918 0.062(2) Uiso 1 2 i calc R . . 0
C18 C 0.1225(5) 0.4138(4) 0.5109(4) 0.0711(18) Uani 1 2 i d . . . 0
H18 H 0.1174 0.4740 0.4937 0.062(2) Uiso 1 2 i calc R . . 0
C19 C 0.0748(5) 0.3731(5) 0.4775(3) 0.077(2) Uani 1 2 i d . . . 0
H19 H 0.0381 0.4055 0.4374 0.062(2) Uiso 1 2 i calc R . . 0
C20 C 0.0815(5) 0.2854(5) 0.5036(3) 0.0680(17) Uani 1 2 i d . . . 0
H20 H 0.0487 0.2580 0.4813 0.062(2) Uiso 1 2 i calc R . . 0
C21 C 0.1365(4) 0.2360(4) 0.5626(3) 0.0557(14) Uani 1 2 i d . . . 0
H21 H 0.1401 0.1760 0.5799 0.062(2) Uiso 1 2 i calc R . . 0
C22 C 0.4267(3) 0.2497(3) 0.4519(3) 0.0319(10) Uani 1 2 i d . . . 0
C23 C 0.3983(4) 0.1851(3) 0.4318(3) 0.0487(13) Uani 1 2 i d . . . 0
H23 H 0.4129 0.1275 0.4610 0.062(2) Uiso 1 2 i calc R . . 0
C24 C 0.3485(5) 0.2052(4) 0.3688(3) 0.0627(16) Uani 1 2 i d . . . 0
H24 H 0.3291 0.1611 0.3559 0.062(2) Uiso 1 2 i calc R . . 0
C25 C 0.3268(4) 0.2897(4) 0.3244(3) 0.0554(15) Uani 1 2 i d . . . 0
H25 H 0.2917 0.3033 0.2825 0.062(2) Uiso 1 2 i calc R . . 0
C26 C 0.3574(4) 0.3529(4) 0.3426(3) 0.0571(14) Uani 1 2 i d . . . 0
H26 H 0.3443 0.4099 0.3119 0.062(2) Uiso 1 2 i calc R . . 0
C27 C 0.4073(4) 0.3342(3) 0.4055(3) 0.0493(13) Uani 1 2 i d . . . 0
H27 H 0.4281 0.3784 0.4170 0.062(2) Uiso 1 2 i calc R . . 0
C28 C 0.5361(3) 0.3146(3) 0.5346(3) 0.0319(10) Uani 1 2 i d . . . 0
C29 C 0.6266(4) 0.3240(3) 0.4696(3) 0.0463(12) Uani 1 2 i d . . . 0
H29 H 0.6517 0.2884 0.4290 0.062(2) Uiso 1 2 i calc R . . 0
C30 C 0.6777(4) 0.3854(3) 0.4662(3) 0.0522(13) Uani 1 2 i d . . . 0
H30 H 0.7372 0.3922 0.4227 0.062(2) Uiso 1 2 i calc R . . 0
C31 C 0.6416(4) 0.4370(3) 0.5266(4) 0.0556(14) Uani 1 2 i d . . . 0
H31 H 0.6778 0.4775 0.5249 0.062(2) Uiso 1 2 i calc R . . 0
C32 C 0.5521(4) 0.4292(3) 0.5897(3) 0.0547(14) Uani 1 2 i d . . . 0
H32 H 0.5272 0.4654 0.6298 0.062(2) Uiso 1 2 i calc R . . 0
C33 C 0.4987(4) 0.3676(3) 0.5939(3) 0.0436(12) Uani 1 2 i d . . . 0
H33 H 0.4381 0.3624 0.6366 0.062(2) Uiso 1 2 i calc R . . 0
C34 C 0.5808(3) 0.1296(3) 0.5414(3) 0.0309(10) Uani 1 2 i d . . . 0
C35 C 0.6438(4) 0.1035(3) 0.4674(3) 0.0449(12) Uani 1 2 i d . . . 0
H35 H 0.6274 0.1342 0.4172 0.062(2) Uiso 1 2 i calc R . . 0
C36 C 0.7312(4) 0.0324(3) 0.4665(3) 0.0499(13) Uani 1 2 i d . . . 0
H36 H 0.7732 0.0152 0.4161 0.062(2) Uiso 1 2 i calc R . . 0
C37 C 0.7561(4) -0.0130(3) 0.5403(3) 0.0498(13) Uani 1 2 i d . . . 0
H37 H 0.8150 -0.0611 0.5398 0.062(2) Uiso 1 2 i calc R . . 0
C38 C 0.6942(4) 0.0124(3) 0.6145(3) 0.0450(12) Uani 1 2 i d . . . 0
H38 H 0.7114 -0.0187 0.6643 0.062(2) Uiso 1 2 i calc R . . 0
C39 C 0.6071(3) 0.0832(3) 0.6162(3) 0.0361(10) Uani 1 2 i d . . . 0
H39 H 0.5658 0.1002 0.6669 0.062(2) Uiso 1 2 i calc R . . 0
P40 P 0.39179(9) 0.66969(7) 0.15376(7) 0.0318(3) Uani 1 2 i d . . . 0
N41 N 0.3685(3) 0.7559(2) 0.1911(2) 0.0327(8) Uani 1 2 i d . . . 0
P42 P 0.28935(9) 0.85101(7) 0.18843(7) 0.0302(2) Uani 1 2 i d . . . 0
C43 C 0.2864(3) 0.6153(3) 0.1961(3) 0.0355(10) Uani 1 2 i d . . . 0
C44 C 0.2738(4) 0.5550(3) 0.1570(3) 0.0495(13) Uani 1 2 i d . . . 0
H44 H 0.3194 0.5430 0.1057 0.062(2) Uiso 1 2 i calc R . . 0
C45 C 0.1924(5) 0.5133(4) 0.1956(4) 0.0622(16) Uani 1 2 i d . . . 0
H45 H 0.1834 0.4731 0.1697 0.062(2) Uiso 1 2 i calc R . . 0
C46 C 0.1252(5) 0.5303(4) 0.2710(4) 0.0669(18) Uani 1 2 i d . . . 0
H46 H 0.0710 0.5018 0.2960 0.062(2) Uiso 1 2 i calc R . . 0
C47 C 0.1372(4) 0.5886(4) 0.3096(4) 0.0619(15) Uani 1 2 i d . . . 0
H47 H 0.0905 0.6006 0.3605 0.062(2) Uiso 1 2 i calc R . . 0
C48 C 0.2176(4) 0.6299(3) 0.2740(3) 0.0473(12) Uani 1 2 i d . . . 0
H48 H 0.2266 0.6681 0.3019 0.062(2) Uiso 1 2 i calc R . . 0
C49 C 0.4189(4) 0.6868(3) 0.0415(3) 0.0403(11) Uani 1 2 i d . . . 0
C50 C 0.3368(4) 0.7112(3) 0.0023(3) 0.0492(13) Uani 1 2 i d . . . 0
H50 H 0.2672 0.7164 0.0343 0.062(2) Uiso 1 2 i calc R . . 0
C51 C 0.3586(5) 0.7278(4) -0.0841(3) 0.0579(14) Uani 1 2 i d . . . 0
H51 H 0.3037 0.7442 -0.1102 0.062(2) Uiso 1 2 i calc R . . 0
C52 C 0.4609(5) 0.7202(4) -0.1313(3) 0.0604(15) Uani 1 2 i d . . . 0
H52 H 0.4751 0.7316 -0.1894 0.062(2) Uiso 1 2 i calc R . . 0
C53 C 0.5418(5) 0.6962(4) -0.0939(3) 0.0649(16) Uani 1 2 i d . . . 0
H53 H 0.6110 0.6911 -0.1266 0.062(2) Uiso 1 2 i calc R . . 0
C54 C 0.5218(4) 0.6793(3) -0.0073(3) 0.0523(13) Uani 1 2 i d . . . 0
H54 H 0.5775 0.6630 0.0179 0.062(2) Uiso 1 2 i calc R . . 0
C55 C 0.5074(3) 0.5938(3) 0.1823(3) 0.0370(10) Uani 1 2 i d . . . 0
C56 C 0.5815(4) 0.6239(3) 0.1973(3) 0.0449(12) Uani 1 2 i d . . . 0
H56 H 0.5725 0.6843 0.1918 0.062(2) Uiso 1 2 i calc R . . 0
C57 C 0.6693(4) 0.5653(4) 0.2204(3) 0.0519(13) Uani 1 2 i d . . . 0
H57 H 0.7206 0.5864 0.2281 0.062(2) Uiso 1 2 i calc R . . 0
C58 C 0.6809(4) 0.4768(4) 0.2320(4) 0.0671(17) Uani 1 2 i d . . . 0
H58 H 0.7382 0.4376 0.2508 0.062(2) Uiso 1 2 i calc R . . 0
C59 C 0.6091(5) 0.4451(4) 0.2164(4) 0.0690(17) Uani 1 2 i d . . . 0
H59 H 0.6189 0.3845 0.2226 0.062(2) Uiso 1 2 i calc R . . 0
C60 C 0.5223(4) 0.5028(3) 0.1914(4) 0.0565(15) Uani 1 2 i d . . . 0
H60 H 0.4736 0.4811 0.1805 0.062(2) Uiso 1 2 i calc R . . 0
C61 C 0.2020(3) 0.8650(3) 0.2901(3) 0.0303(10) Uani 1 2 i d . . . 0
C62 C 0.2266(4) 0.8101(3) 0.3622(3) 0.0386(11) Uani 1 2 i d . . . 0
H62 H 0.2878 0.7641 0.3584 0.062(2) Uiso 1 2 i calc R . . 0
C63 C 0.1597(4) 0.8243(3) 0.4393(3) 0.0478(13) Uani 1 2 i d . . . 0
H63 H 0.1754 0.7870 0.4876 0.062(2) Uiso 1 2 i calc R . . 0
C64 C 0.0705(4) 0.8927(4) 0.4457(3) 0.0523(13) Uani 1 2 i d . . . 0
H64 H 0.0260 0.9015 0.4981 0.062(2) Uiso 1 2 i calc R . . 0
C65 C 0.0460(4) 0.9489(3) 0.3747(3) 0.0486(13) Uani 1 2 i d . . . 0
H65 H -0.0141 0.9959 0.3793 0.062(2) Uiso 1 2 i calc R . . 0
C66 C 0.1112(4) 0.9349(3) 0.2973(3) 0.0414(11) Uani 1 2 i d . . . 0
H66 H 0.0947 0.9723 0.2493 0.062(2) Uiso 1 2 i calc R . . 0
C67 C 0.2067(3) 0.8771(3) 0.1176(3) 0.0351(10) Uani 1 2 i d . . . 0
C68 C 0.1237(4) 0.8379(3) 0.1377(3) 0.0467(12) Uani 1 2 i d . . . 0
H68 H 0.1061 0.8035 0.1902 0.062(2) Uiso 1 2 i calc R . . 0
C69 C 0.0671(4) 0.8496(4) 0.0802(4) 0.0614(16) Uani 1 2 i d . . . 0
H69 H 0.0120 0.8226 0.0938 0.062(2) Uiso 1 2 i calc R . . 0
C70 C 0.0918(5) 0.9006(4) 0.0034(4) 0.0669(17) Uani 1 2 i d . . . 0
H70 H 0.0541 0.9076 -0.0355 0.062(2) Uiso 1 2 i calc R . . 0
C71 C 0.1721(5) 0.9418(4) -0.0167(4) 0.0691(17) Uani 1 2 i d . . . 0
H71 H 0.1876 0.9779 -0.0686 0.062(2) Uiso 1 2 i calc R . . 0
C72 C 0.2299(4) 0.9293(3) 0.0402(3) 0.0510(13) Uani 1 2 i d . . . 0
H72 H 0.2850 0.9564 0.0262 0.062(2) Uiso 1 2 i calc R . . 0
C73 C 0.3644(3) 0.9326(3) 0.1569(3) 0.0334(10) Uani 1 2 i d . . . 0
C74 C 0.3140(4) 1.0213(3) 0.1589(3) 0.0505(13) Uani 1 2 i d . . . 0
H74 H 0.2406 1.0391 0.1766 0.062(2) Uiso 1 2 i calc R . . 0
C75 C 0.3725(5) 1.0832(3) 0.1346(4) 0.0614(15) Uani 1 2 i d . . . 0
H75 H 0.3381 1.1425 0.1358 0.062(2) Uiso 1 2 i calc R . . 0
C76 C 0.4805(5) 1.0582(4) 0.1087(4) 0.0647(16) Uani 1 2 i d . . . 0
H76 H 0.5197 1.1000 0.0936 0.062(2) Uiso 1 2 i calc R . . 0
C77 C 0.5306(4) 0.9711(4) 0.1052(4) 0.0647(16) Uani 1 2 i d . . . 0
H77 H 0.6040 0.9540 0.0868 0.062(2) Uiso 1 2 i calc R . . 0
C78 C 0.4733(4) 0.9086(3) 0.1287(3) 0.0509(13) Uani 1 2 i d . . . 0
H78 H 0.5083 0.8498 0.1256 0.062(2) Uiso 1 2 i calc R . . 0
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
Bi Cl5 2.5006(16) . ?
Bi Cl4 2.6241(18) . ?
Bi Cl1 2.6824(15) . ?
Bi Cl2 2.7281(16) . ?
Bi Cl3 2.7530(16) . ?
Bi O1B 2.762(19) . ?
Bi O1A 2.818(19) . ?
O1A C2A 1.507(19) . ?
C2A C3A 1.519(18) . ?
C2A H2A1 0.9700 . ?
C2A H2A2 0.9700 . ?
C3A H3A1 0.9600 . ?
C3A H3A2 0.9600 . ?
C3A H3A3 0.9600 . ?
O1B C2B 1.345(17) . ?
C2B C3B 1.521(17) . ?
C2B H2B1 0.9700 . ?
C2B H2B2 0.9700 . ?
C3B H3B1 0.9600 . ?
C3B H3B2 0.9600 . ?
C3B H3B3 0.9600 . ?
P1 N2 1.583(4) . ?
P1 C16 1.787(4) . ?
P1 C4 1.794(4) . ?
P1 C10 1.797(4) . ?
N2 P3 1.584(4) . ?
P3 C34 1.794(4) . ?
P3 C28 1.795(4) . ?
P3 C22 1.799(4) . ?
C4 C9 1.374(6) . ?
C4 C5 1.381(6) . ?
C5 C6 1.373(7) . ?
C5 H5 0.9300 . ?
C6 C7 1.363(8) . ?
C6 H6 0.9300 . ?
C7 C8 1.362(8) . ?
C7 H7 0.9300 . ?
C8 C9 1.359(7) . ?
C8 H8 0.9300 . ?
C9 H9 0.9300 . ?
C10 C11 1.386(6) . ?
C10 C15 1.388(6) . ?
C11 C12 1.381(6) . ?
C11 H11 0.9300 . ?
C12 C13 1.370(8) . ?
C12 H12 0.9300 . ?
C13 C14 1.372(8) . ?
C13 H13 0.9300 . ?
C14 C15 1.372(7) . ?
C14 H14 0.9300 . ?
C15 H15 0.9300 . ?
C16 C17 1.384(7) . ?
C16 C21 1.389(6) . ?
C17 C18 1.376(7) . ?
C17 H17 0.9300 . ?
C18 C19 1.374(9) . ?
C18 H18 0.9300 . ?
C19 C20 1.358(9) . ?
C19 H19 0.9300 . ?
C20 C21 1.383(7) . ?
C20 H20 0.9300 . ?
C21 H21 0.9300 . ?
C22 C23 1.376(6) . ?
C22 C27 1.386(6) . ?
C23 C24 1.370(7) . ?
C23 H23 0.9300 . ?
C24 C25 1.373(8) . ?
C24 H24 0.9300 . ?
C25 C26 1.355(7) . ?
C25 H25 0.9300 . ?
C26 C27 1.374(6) . ?
C26 H26 0.9300 . ?
C27 H27 0.9300 . ?
C28 C33 1.370(6) . ?
C28 C29 1.403(6) . ?
C29 C30 1.368(6) . ?
C29 H29 0.9300 . ?
C30 C31 1.369(7) . ?
C30 H30 0.9300 . ?
C31 C32 1.374(7) . ?
C31 H31 0.9300 . ?
C32 C33 1.389(6) . ?
C32 H32 0.9300 . ?
C33 H33 0.9300 . ?
C34 C35 1.374(6) . ?
C34 C39 1.400(6) . ?
C35 C36 1.378(6) . ?
C35 H35 0.9300 . ?
C36 C37 1.373(7) . ?
C36 H36 0.9300 . ?
C37 C38 1.370(7) . ?
C37 H37 0.9300 . ?
C38 C39 1.372(6) . ?
C38 H38 0.9300 . ?
C39 H39 0.9300 . ?
P40 N41 1.583(4) . ?
P40 C43 1.792(4) . ?
P40 C55 1.796(5) . ?
P40 C49 1.800(5) . ?
N41 P42 1.582(4) . ?
P42 C67 1.798(4) . ?
P42 C73 1.799(4) . ?
P42 C61 1.800(4) . ?
C43 C44 1.394(6) . ?
C43 C48 1.398(6) . ?
C44 C45 1.388(7) . ?
C44 H44 0.9300 . ?
C45 C46 1.367(8) . ?
C45 H45 0.9300 . ?
C46 C47 1.357(8) . ?
C46 H46 0.9300 . ?
C47 C48 1.368(7) . ?
C47 H47 0.9300 . ?
C48 H48 0.9300 . ?
C49 C54 1.384(7) . ?
C49 C50 1.393(7) . ?
C50 C51 1.384(7) . ?
C50 H50 0.9300 . ?
C51 C52 1.369(7) . ?
C51 H51 0.9300 . ?
C52 C53 1.358(8) . ?
C52 H52 0.9300 . ?
C53 C54 1.388(7) . ?
C53 H53 0.9300 . ?
C54 H54 0.9300 . ?
C55 C56 1.372(6) . ?
C55 C60 1.397(6) . ?
C56 C57 1.379(7) . ?
C56 H56 0.9300 . ?
C57 C58 1.360(7) . ?
C57 H57 0.9300 . ?
C58 C59 1.366(7) . ?
C58 H58 0.9300 . ?
C59 C60 1.377(7) . ?
C59 H59 0.9300 . ?
C60 H60 0.9300 . ?
C61 C62 1.389(6) . ?
C61 C66 1.394(6) . ?
C62 C63 1.378(6) . ?
C62 H62 0.9300 . ?
C63 C64 1.367(7) . ?
C63 H63 0.9300 . ?
C64 C65 1.382(7) . ?
C64 H64 0.9300 . ?
C65 C66 1.375(6) . ?
C65 H65 0.9300 . ?
C66 H66 0.9300 . ?
C67 C72 1.376(6) . ?
C67 C68 1.386(6) . ?
C68 C69 1.378(7) . ?
C68 H68 0.9300 . ?
C69 C70 1.363(8) . ?
C69 H69 0.9300 . ?
C70 C71 1.373(8) . ?
C70 H70 0.9300 . ?
C71 C72 1.380(7) . ?
C71 H71 0.9300 . ?
C72 H72 0.9300 . ?
C73 C78 1.380(6) . ?
C73 C74 1.389(6) . ?
C74 C75 1.380(7) . ?
C74 H74 0.9300 . ?
C75 C76 1.367(8) . ?
C75 H75 0.9300 . ?
C76 C77 1.369(8) . ?
C76 H76 0.9300 . ?
C77 C78 1.377(7) . ?
C77 H77 0.9300 . ?
C78 H78 0.9300 . ?
