#------------------------------------------------------------------------------
#$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $
#$Revision: 130149 $
#$URL: svn://www.crystallography.net/cod/cif/4/06/19/4061991.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_4061991
_journal_name_full               Organometallics
_journal_year                    2003
_chemical_formula_moiety         'C87 H88 Au2 O8 P2'
_chemical_formula_sum            'C87 H88 Au2 O8 P2'
_chemical_formula_weight         1717.45
_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                88.42(3)
_cell_angle_beta                 86.27(3)
_cell_angle_gamma                82.76(3)
_cell_formula_units_Z            2
_cell_length_a                   14.828(3)
_cell_length_b                   16.138(3)
_cell_length_c                   16.669(3)
_cell_measurement_temperature    301(2)
_cell_volume                     3947.9(13)
_diffrn_ambient_temperature      301(2)
_exptl_crystal_density_diffrn    1.445
_cod_database_code               4061991
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_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Au1 Au 0.282097(14) -0.277019(13) 0.301928(15) 0.05747(9) Uani 1 1 d . . .
Au2 Au 0.343413(14) 0.119911(15) 0.635240(14) 0.05824(9) Uani 1 1 d . . .
P1 P 0.35010(10) -0.37184(9) 0.38986(10) 0.0556(4) Uani 1 1 d . . .
P2 P 0.43841(9) 0.08570(9) 0.73633(9) 0.0529(4) Uani 1 1 d . . .
O1 O 0.0194(2) 0.1634(2) 0.0479(2) 0.0510(9) Uani 1 1 d . . .
O2 O -0.1145(3) 0.2683(2) -0.0319(2) 0.0676(11) Uani 1 1 d . . .
O3 O -0.1453(4) 0.4395(3) 0.0148(4) 0.0941(16) Uani 1 1 d . . .
O4 O -0.0971(4) 0.4891(3) 0.1740(4) 0.1049(18) Uani 1 1 d . . .
O5 O 0.0283(3) 0.3754(2) 0.2543(2) 0.0592(10) Uani 1 1 d . . .
O6 O -0.0531(2) 0.2251(2) 0.2149(2) 0.0532(9) Uani 1 1 d . . .
O7 O 0.1333(2) 0.2670(2) 0.1296(2) 0.0510(9) Uani 1 1 d . . .
O8 O 0.0306(6) 0.6846(6) 0.2909(6) 0.180(4) Uani 1 1 d . . .
C1 C 0.2282(4) -0.1828(3) 0.2317(4) 0.0568(14) Uani 1 1 d . . .
C2 C 0.1970(3) -0.1208(3) 0.1984(3) 0.0495(13) Uani 1 1 d . . .
C3 C 0.1538(3) -0.0455(3) 0.1619(3) 0.0467(12) Uani 1 1 d . . .
C4 C 0.0607(3) -0.0222(3) 0.1774(3) 0.0483(12) Uani 1 1 d . . .
H4 H 0.0286 -0.0546 0.2133 0.058 Uiso 1 1 calc R . .
C5 C 0.0142(3) 0.0477(3) 0.1413(3) 0.0454(12) Uani 1 1 d . . .
C6 C 0.0633(3) 0.0959(3) 0.0887(3) 0.0448(12) Uani 1 1 d . . .
C7 C 0.1587(3) 0.0781(3) 0.0768(3) 0.0452(12) Uani 1 1 d . . .
C8 C 0.2015(3) 0.0071(3) 0.1131(3) 0.0475(12) Uani 1 1 d . . .
H8 H 0.2643 -0.0057 0.1046 0.057 Uiso 1 1 calc R . .
C9 C -0.0872(3) 0.0697(3) 0.1623(4) 0.0551(14) Uani 1 1 d . . .
H9A H -0.1112 0.1150 0.1272 0.066 Uiso 1 1 calc R . .
H9B H -0.1182 0.0217 0.1531 0.066 Uiso 1 1 calc R . .
C10 C -0.1060(3) 0.0955(3) 0.2485(3) 0.0520(14) Uani 1 1 d . . .
C11 C -0.0878(3) 0.1726(4) 0.2718(3) 0.0515(13) Uani 1 1 d . . .
C12 C -0.0991(3) 0.1978(4) 0.3520(4) 0.0567(15) Uani 1 1 d . . .
C13 C -0.1300(4) 0.1423(5) 0.4087(4) 0.0678(17) Uani 1 1 d . . .
H13 H -0.1380 0.1577 0.4623 0.081 Uiso 1 1 calc R . .
C14 C -0.1490(4) 0.0656(5) 0.3880(4) 0.079(2) Uani 1 1 d . . .
H14 H -0.1699 0.0291 0.4271 0.094 Uiso 1 1 calc R . .
C15 C -0.1369(4) 0.0422(4) 0.3077(4) 0.0657(16) Uani 1 1 d . . .
H15 H -0.1499 -0.0103 0.2936 0.079 Uiso 1 1 calc R . .
C16 C -0.0738(3) 0.2821(4) 0.3733(4) 0.0622(16) Uani 1 1 d . . .
H16A H -0.0993 0.2963 0.4269 0.075 Uiso 1 1 calc R . .
H16B H -0.1000 0.3242 0.3361 0.075 Uiso 1 1 calc R . .
C17 C 0.0289(3) 0.2827(3) 0.3704(3) 0.0520(13) Uani 1 1 d . . .
C18 C 0.0773(4) 0.2370(4) 0.4279(3) 0.0548(14) Uani 1 1 d . . .
H18 H 0.0462 0.2085 0.4680 0.066 Uiso 1 1 calc R . .
C19 C 0.1715(4) 0.2326(3) 0.4274(3) 0.0520(13) Uani 1 1 d . . .
C20 C 0.2164(4) 0.2719(3) 0.3646(3) 0.0523(13) Uani 1 1 d . . .
H20 H 0.2797 0.2667 0.3622 0.063 Uiso 1 1 calc R . .
C21 C 0.1711(4) 0.3182(3) 0.3059(3) 0.0500(13) Uani 1 1 d . . .
C22 C 0.0758(4) 0.3254(3) 0.3110(3) 0.0503(13) Uani 1 1 d . . .
C23 C 0.2210(4) 0.1898(4) 0.4916(3) 0.0531(13) Uani 1 1 d . . .
C24 C 0.2619(4) 0.1581(4) 0.5446(4) 0.0663(16) Uani 1 1 d . . .
C25 C 0.2241(4) 0.3569(3) 0.2367(3) 0.0584(14) Uani 1 1 d . . .
H25A H 0.1824 0.3949 0.2064 0.070 Uiso 1 1 calc R . .
H25B H 0.2677 0.3891 0.2581 0.070 Uiso 1 1 calc R . .
C26 C 0.2743(4) 0.2917(3) 0.1806(3) 0.0514(13) Uani 1 1 d . . .
C27 C 0.2268(3) 0.2487(3) 0.1293(3) 0.0470(12) Uani 1 1 d . . .
C28 C 0.2696(4) 0.1847(3) 0.0804(3) 0.0508(13) Uani 1 1 d . . .
C29 C 0.3633(4) 0.1661(4) 0.0827(4) 0.0626(15) Uani 1 1 d . . .
H29 H 0.3938 0.1243 0.0502 0.075 Uiso 1 1 calc R . .
C30 C 0.4121(4) 0.2079(4) 0.1316(4) 0.0703(18) Uani 1 1 d . . .
H30 H 0.4749 0.1942 0.1322 0.084 Uiso 1 1 calc R . .
C31 C 0.3677(4) 0.2706(4) 0.1804(4) 0.0674(17) Uani 1 1 d . . .
H31 H 0.4012 0.2989 0.2134 0.081 Uiso 1 1 calc R . .
C32 C 0.2145(4) 0.1368(3) 0.0281(3) 0.0530(13) Uani 1 1 d . . .
H32A H 0.1740 0.1762 -0.0019 0.064 Uiso 1 1 calc R . .
H32B H 0.2557 0.1046 -0.0104 0.064 Uiso 1 1 calc R . .
C33 C -0.0155(4) 0.1410(3) -0.0253(3) 0.0599(15) Uani 1 1 d . . .
H33A H -0.0671 0.1103 -0.0133 0.072 Uiso 1 1 calc R . .
H33B H 0.0311 0.1053 -0.0560 0.072 Uiso 1 1 calc R . .
C34 C -0.0444(4) 0.2181(4) -0.0733(4) 0.0613(15) Uani 1 1 d . . .
H34A H 0.0071 0.2491 -0.0843 0.074 Uiso 1 1 calc R . .
H34B H -0.0649 0.2027 -0.1243 0.074 Uiso 1 1 calc R . .
C35 C -0.1526(5) 0.3360(4) -0.0798(5) 0.084(2) Uani 1 1 d . . .
H35A H -0.1917 0.3160 -0.1176 0.101 Uiso 1 1 calc R . .
H35B H -0.1043 0.3606 -0.1103 0.101 Uiso 1 1 calc R . .
C36 C -0.2059(6) 0.3995(5) -0.0283(5) 0.097(3) Uani 1 1 d . . .
H36A H -0.2417 0.4402 -0.0610 0.116 Uiso 1 1 calc R . .
H36B H -0.2472 0.3733 0.0089 0.116 Uiso 1 1 calc R . .
C37 C -0.1902(6) 0.5016(5) 0.0627(5) 0.097(2) Uani 1 1 d . . .
H37A H -0.2328 0.4782 0.1008 0.116 Uiso 1 1 calc R . .
H37B H -0.2243 0.5434 0.0298 0.116 Uiso 1 1 calc R . .
C38 C -0.1234(7) 0.5407(5) 0.1062(5) 0.111(3) Uani 1 1 d . . .
H38A H -0.0702 0.5473 0.0706 0.133 Uiso 1 1 calc R . .
H38B H -0.1501 0.5956 0.1241 0.133 Uiso 1 1 calc R . .
C39 C -0.0237(6) 0.5117(4) 0.2063(5) 0.098(3) Uani 1 1 d . . .
H39A H -0.0365 0.5697 0.2217 0.118 Uiso 1 1 calc R . .
H39B H 0.0266 0.5074 0.1659 0.118 Uiso 1 1 calc R . .
C40 C 0.0046(5) 0.4599(4) 0.2785(4) 0.078(2) Uani 1 1 d . . .
H40A H 0.0565 0.4803 0.3005 0.094 Uiso 1 1 calc R . .
H40B H -0.0450 0.4633 0.3196 0.094 Uiso 1 1 calc R . .
C41 C -0.1208(4) 0.2801(4) 0.1756(4) 0.0663(16) Uani 1 1 d . . .
H41A H -0.0916 0.3149 0.1370 0.099 Uiso 1 1 calc R . .
H41B H -0.1570 0.3145 0.2147 0.099 Uiso 1 1 calc R . .
H41C H -0.1593 0.2478 0.1485 0.099 Uiso 1 1 calc R . .
C42 C 0.1032(4) 0.3303(4) 0.0726(4) 0.0670(16) Uani 1 1 d . . .
H42A H 0.0378 0.3399 0.0762 0.101 Uiso 1 1 calc R . .
H42B H 0.1243 0.3126 0.0194 0.101 Uiso 1 1 calc R . .
H42C H 0.1271 0.3811 0.0838 0.101 Uiso 1 1 calc R . .
C43 C 0.2785(4) -0.4327(4) 0.4521(4) 0.0613(15) Uani 1 1 d . . .
C44 C 0.2016(5) -0.4552(5) 0.4230(5) 0.094(2) Uani 1 1 d . . .
H44 H 0.1824 -0.4335 0.3738 0.112 Uiso 1 1 calc R . .
C45 C 0.1516(6) -0.5107(6) 0.4669(6) 0.118(3) Uani 1 1 d . . .
H45 H 0.0987 -0.5248 0.4467 0.142 Uiso 1 1 calc R . .
C46 C 0.1780(6) -0.5443(4) 0.5374(6) 0.097(3) Uani 1 1 d . . .
C47 C 0.2542(6) -0.5185(5) 0.5695(5) 0.097(2) Uani 1 1 d . . .
H47 H 0.2718 -0.5385 0.6197 0.117 Uiso 1 1 calc R . .
C48 C 0.3033(5) -0.4632(4) 0.5266(5) 0.085(2) Uani 1 1 d . . .
H48 H 0.3541 -0.4462 0.5482 0.102 Uiso 1 1 calc R . .
C49 C 0.1227(8) -0.6074(5) 0.5810(7) 0.159(5) Uani 1 1 d . . .
H49A H 0.1496 -0.6251 0.6305 0.239 Uiso 1 1 calc R . .
H49B H 0.1225 -0.6549 0.5477 0.239 Uiso 1 1 calc R . .
H49C H 0.0613 -0.5819 0.5923 0.239 Uiso 1 1 calc R . .
C50 C 0.4353(4) -0.4490(3) 0.3429(4) 0.0601(15) Uani 1 1 d . . .
C51 C 0.4925(6) -0.4259(5) 0.2834(5) 0.114(3) Uani 1 1 d . . .
H51 H 0.4860 -0.3705 0.2657 0.137 Uiso 1 1 calc R . .
C52 C 0.5618(7) -0.4820(6) 0.2468(6) 0.147(5) Uani 1 1 d . . .
H52 H 0.6038 -0.4630 0.2090 0.176 Uiso 1 1 calc R . .
C53 C 0.5673(6) -0.5664(5) 0.2677(6) 0.118(3) Uani 1 1 d . . .
C54 C 0.5141(5) -0.5869(4) 0.3292(5) 0.091(2) Uani 1 1 d . . .
H54 H 0.5214 -0.6419 0.3483 0.109 Uiso 1 1 calc R . .
C55 C 0.4478(5) -0.5309(4) 0.3670(4) 0.081(2) Uani 1 1 d . . .
H55 H 0.4112 -0.5492 0.4096 0.097 Uiso 1 1 calc R . .
C56 C 0.6388(9) -0.6298(6) 0.2256(8) 0.219(8) Uani 1 1 d . . .
H56A H 0.6717 -0.6020 0.1837 0.328 Uiso 1 1 calc R . .
H56B H 0.6093 -0.6724 0.2029 0.328 Uiso 1 1 calc R . .
H56C H 0.6803 -0.6547 0.2639 0.328 Uiso 1 1 calc R . .
C57 C 0.4072(4) -0.3150(3) 0.4592(4) 0.0552(14) Uani 1 1 d . . .
C58 C 0.3524(4) -0.2611(4) 0.5114(4) 0.0641(16) Uani 1 1 d . . .
H58 H 0.2894 -0.2606 0.5141 0.077 Uiso 1 1 calc R . .
C59 C 0.3911(4) -0.2090(4) 0.5590(4) 0.0681(17) Uani 1 1 d . . .
H59 H 0.3536 -0.1732 0.5932 0.082 Uiso 1 1 calc R . .
C60 C 0.4855(4) -0.2079(4) 0.5575(4) 0.0663(16) Uani 1 1 d . . .
C61 C 0.5385(4) -0.2633(4) 0.5074(4) 0.0680(17) Uani 1 1 d . . .
H61 H 0.6016 -0.2652 0.5061 0.082 Uiso 1 1 calc R . .
C62 C 0.5006(4) -0.3164(4) 0.4585(4) 0.0606(15) Uani 1 1 d . . .
H62 H 0.5383 -0.3530 0.4251 0.073 Uiso 1 1 calc R . .
C63 C 0.5277(5) -0.1493(5) 0.6083(5) 0.094(2) Uani 1 1 d . . .
H63A H 0.5928 -0.1588 0.5998 0.141 Uiso 1 1 calc R . .
H63B H 0.5108 -0.1591 0.6640 0.141 Uiso 1 1 calc R . .
H63C H 0.5064 -0.0926 0.5936 0.141 Uiso 1 1 calc R . .
C64 C 0.4476(4) 0.1734(4) 0.8007(3) 0.0582(14) Uani 1 1 d . . .
C65 C 0.3678(4) 0.2199(4) 0.8342(5) 0.083(2) Uani 1 1 d . . .
H65 H 0.3110 0.2087 0.8200 0.100 Uiso 1 1 calc R . .
C66 C 0.3739(6) 0.2820(5) 0.8878(5) 0.096(2) Uani 1 1 d . . .
H66 H 0.3204 0.3098 0.9114 0.115 Uiso 1 1 calc R . .
C67 C 0.4543(6) 0.3043(4) 0.9078(4) 0.082(2) Uani 1 1 d . . .
C68 C 0.5324(5) 0.2604(4) 0.8740(4) 0.0772(19) Uani 1 1 d . . .
H68 H 0.5886 0.2747 0.8865 0.093 Uiso 1 1 calc R . .
C69 C 0.5299(4) 0.1959(4) 0.8218(4) 0.0653(16) Uani 1 1 d . . .
H69 H 0.5841 0.1671 0.8006 0.078 Uiso 1 1 calc R . .
C70 C 0.4586(7) 0.3735(5) 0.9670(5) 0.129(4) Uani 1 1 d . . .
H70A H 0.3979 0.3968 0.9843 0.194 Uiso 1 1 calc R . .
H70B H 0.4903 0.4163 0.9413 0.194 Uiso 1 1 calc R . .
H70C H 0.4903 0.3510 1.0127 0.194 Uiso 1 1 calc R . .
C71 C 0.5545(3) 0.0475(3) 0.7019(3) 0.0506(13) Uani 1 1 d . . .
C72 C 0.5945(4) 0.0856(4) 0.6355(4) 0.0629(16) Uani 1 1 d . . .
H72 H 0.5602 0.1273 0.6071 0.076 Uiso 1 1 calc R . .
C73 C 0.6843(4) 0.0623(4) 0.6112(4) 0.0683(17) Uani 1 1 d . . .
H73 H 0.7098 0.0896 0.5671 0.082 Uiso 1 1 calc R . .
C74 C 0.7374(4) -0.0001(4) 0.6500(4) 0.0567(14) Uani 1 1 d . . .
C75 C 0.6966(4) -0.0395(3) 0.7156(4) 0.0588(15) Uani 1 1 d . . .
H75 H 0.7306 -0.0827 0.7426 0.071 Uiso 1 1 calc R . .
C76 C 0.6074(3) -0.0160(3) 0.7415(3) 0.0546(14) Uani 1 1 d . . .
H76 H 0.5822 -0.0429 0.7859 0.066 Uiso 1 1 calc R . .
C77 C 0.8373(4) -0.0218(4) 0.6258(4) 0.0771(19) Uani 1 1 d . . .
H77A H 0.8532 0.0112 0.5794 0.116 Uiso 1 1 calc R . .
H77B H 0.8494 -0.0800 0.6133 0.116 Uiso 1 1 calc R . .
H77C H 0.8729 -0.0103 0.6694 0.116 Uiso 1 1 calc R . .
C78 C 0.4010(3) 0.0068(3) 0.8071(3) 0.0529(13) Uani 1 1 d . . .
C79 C 0.4199(4) 0.0047(4) 0.8882(3) 0.0593(14) Uani 1 1 d . . .
H79 H 0.4525 0.0445 0.9078 0.071 Uiso 1 1 calc R . .
C80 C 0.3901(4) -0.0562(4) 0.9390(4) 0.0628(16) Uani 1 1 d . . .
H80 H 0.4031 -0.0569 0.9929 0.075 Uiso 1 1 calc R . .
C81 C 0.3410(4) -0.1170(4) 0.9121(4) 0.0613(16) Uani 1 1 d . . .
C82 C 0.3245(4) -0.1150(4) 0.8326(4) 0.0640(16) Uani 1 1 d . . .
H82 H 0.2931 -0.1558 0.8130 0.077 Uiso 1 1 calc R . .
C83 C 0.3529(3) -0.0542(4) 0.7802(4) 0.0593(15) Uani 1 1 d . . .
H83 H 0.3396 -0.0542 0.7264 0.071 Uiso 1 1 calc R . .
C84 C 0.3095(5) -0.1827(5) 0.9695(5) 0.091(2) Uani 1 1 d . . .
H84A H 0.3283 -0.1737 1.0223 0.136 Uiso 1 1 calc R . .
H84B H 0.3358 -0.2370 0.9518 0.136 Uiso 1 1 calc R . .
H84C H 0.2443 -0.1791 0.9712 0.136 Uiso 1 1 calc R . .
C85 C -0.0926(8) 0.7838(7) 0.2683(8) 0.156(5) Uani 1 1 d . . .
H85A H -0.1056 0.7418 0.2326 0.234 Uiso 1 1 calc R . .
H85B H -0.0844 0.8342 0.2382 0.234 Uiso 1 1 calc R . .
H85C H -0.1424 0.7949 0.3078 0.234 Uiso 1 1 calc R . .
C86 C -0.0080(9) 0.7538(8) 0.3091(9) 0.144(5) Uani 1 1 d . . .
C87 C 0.0253(10) 0.8091(9) 0.3652(7) 0.205(7) Uani 1 1 d . . .
H87A H 0.0798 0.7817 0.3871 0.307 Uiso 1 1 calc R . .
H87B H -0.0204 0.8225 0.4080 0.307 Uiso 1 1 calc R . .
H87C H 0.0383 0.8596 0.3374 0.307 Uiso 1 1 calc R . .
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
Au1 C1 2.010(6) . ?
Au1 P1 2.2774(16) . ?
Au2 C24 2.030(6) . ?
Au2 P2 2.2781(15) . ?
P1 C43 1.798(6) . ?
P1 C57 1.810(6) . ?
P1 C50 1.814(6) . ?
P2 C71 1.815(5) . ?
P2 C64 1.823(6) . ?
P2 C78 1.826(6) . ?
O1 C6 1.383(6) . ?
O1 C33 1.429(6) . ?
O2 C34 1.392(7) . ?
O2 C35 1.416(7) . ?
O3 C37 1.375(9) . ?
O3 C36 1.412(9) . ?
O4 C39 1.339(9) . ?
O4 C38 1.431(8) . ?
O5 C22 1.394(6) . ?
O5 C40 1.426(7) . ?
O6 C11 1.374(6) . ?
O6 C41 1.434(6) . ?
O7 C27 1.380(6) . ?
O7 C42 1.426(6) . ?
O8 C86 1.226(12) . ?
C1 C2 1.187(7) . ?
C2 C3 1.439(7) . ?
C3 C8 1.387(7) . ?
C3 C4 1.393(7) . ?
C4 C5 1.390(7) . ?
C5 C6 1.388(7) . ?
C5 C9 1.520(7) . ?
C6 C7 1.409(7) . ?
C7 C8 1.382(7) . ?
C7 C32 1.520(7) . ?
C9 C10 1.506(8) . ?
C10 C11 1.377(8) . ?
C10 C15 1.384(8) . ?
C11 C12 1.401(8) . ?
C12 C13 1.380(8) . ?
C12 C16 1.514(8) . ?
C13 C14 1.362(9) . ?
C14 C15 1.396(9) . ?
C16 C17 1.521(7) . ?
C17 C18 1.377(7) . ?
C17 C22 1.389(8) . ?
C18 C19 1.390(7) . ?
C19 C20 1.384(8) . ?
C19 C23 1.448(7) . ?
C20 C21 1.374(7) . ?
C21 C22 1.401(7) . ?
C21 C25 1.518(8) . ?
C23 C24 1.173(7) . ?
C25 C26 1.517(8) . ?
C26 C31 1.383(8) . ?
C26 C27 1.393(7) . ?
C27 C28 1.396(7) . ?
C28 C29 1.388(8) . ?
C28 C32 1.520(8) . ?
C29 C30 1.367(9) . ?
C30 C31 1.389(9) . ?
C33 C34 1.492(8) . ?
C35 C36 1.474(10) . ?
C37 C38 1.478(11) . ?
C39 C40 1.498(9) . ?
C43 C44 1.361(9) . ?
C43 C48 1.378(9) . ?
C44 C45 1.396(11) . ?
C45 C46 1.341(12) . ?
C46 C47 1.396(11) . ?
C46 C49 1.526(10) . ?
C47 C48 1.378(9) . ?
C50 C51 1.338(9) . ?
C50 C55 1.363(8) . ?
C51 C52 1.401(10) . ?
C52 C53 1.390(11) . ?
C53 C54 1.313(10) . ?
C53 C56 1.526(10) . ?
C54 C55 1.382(9) . ?
C57 C62 1.381(7) . ?
C57 C58 1.395(8) . ?
C58 C59 1.373(8) . ?
C59 C60 1.400(8) . ?
C60 C61 1.376(9) . ?
C60 C63 1.506(9) . ?
C61 C62 1.391(8) . ?
C64 C69 1.385(8) . ?
C64 C65 1.410(8) . ?
C65 C66 1.377(10) . ?
C66 C67 1.351(11) . ?
C67 C68 1.375(10) . ?
C67 C70 1.521(10) . ?
C68 C69 1.381(9) . ?
C71 C72 1.387(8) . ?
C71 C76 1.389(7) . ?
C72 C73 1.376(8) . ?
C73 C74 1.371(8) . ?
C74 C75 1.393(8) . ?
C74 C77 1.510(8) . ?
C75 C76 1.374(7) . ?
C78 C83 1.386(8) . ?
C78 C79 1.396(8) . ?
C79 C80 1.377(8) . ?
C80 C81 1.393(8) . ?
C81 C82 1.361(8) . ?
C81 C84 1.506(8) . ?
C82 C83 1.384(8) . ?
C85 C86 1.487(17) . ?
C86 C87 1.460(17) . ?
