#------------------------------------------------------------------------------
#$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $
#$Revision: 130149 $
#$URL: svn://www.crystallography.net/cod/cif/7/10/08/7100867.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_7100867
loop_
_publ_author_name
'M.T. Whited'
'E. Rivard'
'J.C. Peters'
_journal_name_full               'Chemical Communications'
_journal_paper_doi               10.1039/b516046d
_journal_year                    2006
_chemical_formula_sum            'C51 H52 Cl Co N P3 Si'
_chemical_formula_weight         894.32
_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                93.701(4)
_cell_angle_beta                 91.736(4)
_cell_angle_gamma                103.463(4)
_cell_formula_units_Z            4
_cell_length_a                   12.8058(15)
_cell_length_b                   17.612(2)
_cell_length_c                   20.505(3)
_cell_measurement_temperature    100(2)
_cell_volume                     4483.4(10)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.325
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
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               7100867
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
Co1A Co 0.74908(13) 0.93976(9) 0.25614(8) 0.0200(5) Uani 1 1 d . . .
Co1B Co 0.78433(14) 0.44161(10) 0.24812(9) 0.0282(6) Uani 1 1 d . . .
Cl1A Cl 0.7125(2) 0.81076(17) 0.27449(16) 0.0242(9) Uani 1 1 d . . .
Cl1B Cl 0.8197(3) 0.32123(19) 0.23113(18) 0.0374(10) Uani 1 1 d . . .
P1A P 0.7903(3) 1.06203(18) 0.24282(17) 0.0217(9) Uani 1 1 d . . .
P2A P 0.8322(3) 0.92705(19) 0.15948(17) 0.0229(9) Uani 1 1 d . . .
P3A P 0.8835(3) 0.96298(18) 0.33134(17) 0.0228(9) Uani 1 1 d . . .
P1B P 0.7538(3) 0.55387(19) 0.2697(2) 0.0311(10) Uani 1 1 d . . .
P2B P 0.8565(4) 0.4524(2) 0.3512(2) 0.0487(12) Uani 1 1 d . . .
P3B P 0.6036(4) 0.3947(2) 0.2585(2) 0.0509(13) Uani 1 1 d . . .
Si1A Si 0.5811(3) 1.0362(2) 0.30152(19) 0.0283(10) Uani 1 1 d . . .
Si1B Si 0.9214(3) 0.5813(2) 0.1768(2) 0.0401(12) Uani 1 1 d . . .
N1A N 0.5976(8) 0.9522(5) 0.2586(5) 0.021(3) Uani 1 1 d . . .
N1B N 0.8438(10) 0.4838(7) 0.1690(6) 0.050(4) Uani 1 1 d . . .
C1 C 0.5111(10) 0.8919(7) 0.2368(6) 0.022(3) Uani 1 1 d . . .
C2 C 0.4770(10) 0.8786(7) 0.1690(7) 0.022(3) Uani 1 1 d . . .
C3 C 0.3902(11) 0.8188(8) 0.1481(7) 0.030(4) Uani 1 1 d . . .
H3 H 0.3688 0.8117 0.1029 0.036 Uiso 1 1 calc R . .
C4 C 0.3352(11) 0.7704(8) 0.1892(7) 0.034(4) Uani 1 1 d . . .
H4 H 0.2765 0.7295 0.1724 0.041 Uiso 1 1 calc R . .
C5 C 0.3615(11) 0.7784(8) 0.2560(7) 0.034(4) Uani 1 1 d . . .
H5 H 0.3199 0.7446 0.2848 0.040 Uiso 1 1 calc R . .
C6 C 0.4532(10) 0.8390(7) 0.2807(7) 0.028(4) Uani 1 1 d . . .
C7 C 0.5397(11) 0.9309(8) 0.1212(7) 0.038(4) Uani 1 1 d . . .
H7 H 0.6178 0.9385 0.1337 0.045 Uiso 1 1 calc R . .
C8 C 0.5228(11) 0.8977(8) 0.0496(6) 0.038(4) Uani 1 1 d . . .
H8A H 0.5262 0.8425 0.0470 0.058 Uiso 1 1 calc R . .
H8B H 0.5792 0.9273 0.0237 0.058 Uiso 1 1 calc R . .
H8C H 0.4523 0.9019 0.0324 0.058 Uiso 1 1 calc R . .
C9 C 0.5153(12) 1.0133(7) 0.1215(7) 0.042(4) Uani 1 1 d . . .
H9A H 0.4398 1.0079 0.1079 0.062 Uiso 1 1 calc R . .
H9B H 0.5615 1.0447 0.0911 0.062 Uiso 1 1 calc R . .
H9C H 0.5292 1.0392 0.1657 0.062 Uiso 1 1 calc R . .
C10 C 0.4822(10) 0.8444(7) 0.3542(6) 0.028(4) Uani 1 1 d . . .
H10 H 0.5534 0.8824 0.3623 0.033 Uiso 1 1 calc R . .
C11 C 0.4934(12) 0.7658(8) 0.3769(7) 0.044(4) Uani 1 1 d . . .
H11A H 0.5118 0.7713 0.4240 0.065 Uiso 1 1 calc R . .
H11B H 0.5504 0.7487 0.3534 0.065 Uiso 1 1 calc R . .
H11C H 0.4253 0.7268 0.3680 0.065 Uiso 1 1 calc R . .
C12 C 0.4031(11) 0.8729(9) 0.3956(7) 0.048(4) Uani 1 1 d . . .
H12A H 0.3871 0.9195 0.3779 0.071 Uiso 1 1 calc R . .
H12B H 0.4335 0.8861 0.4405 0.071 Uiso 1 1 calc R . .
H12C H 0.3367 0.8317 0.3957 0.071 Uiso 1 1 calc R . .
C13 C 0.6029(11) 1.0497(7) 0.3924(6) 0.033(4) Uani 1 1 d . . .
H13A H 0.5616 1.0035 0.4121 0.049 Uiso 1 1 calc R . .
H13B H 0.5790 1.0961 0.4088 0.049 Uiso 1 1 calc R . .
H13C H 0.6795 1.0567 0.4041 0.049 Uiso 1 1 calc R . .
C14 C 0.4450(10) 1.0541(8) 0.2840(7) 0.034(4) Uani 1 1 d . . .
H14A H 0.4497 1.0919 0.2506 0.051 Uiso 1 1 calc R . .
H14B H 0.4187 1.0749 0.3241 0.051 Uiso 1 1 calc R . .
H14C H 0.3952 1.0047 0.2681 0.051 Uiso 1 1 calc R . .
C15 C 0.6923(10) 1.1151(7) 0.2725(7) 0.031(4) Uani 1 1 d . . .
H15 H 0.6964 1.1697 0.2731 0.037 Uiso 1 1 calc R . .
C16 C 0.8063(10) 1.0777(7) 0.1556(6) 0.027(3) Uani 1 1 d . . .
C17 C 0.7980(12) 1.1461(8) 0.1286(8) 0.041(4) Uani 1 1 d . . .
H17 H 0.7859 1.1891 0.1552 0.049 Uiso 1 1 calc R . .
C18 C 0.8075(13) 1.1502(9) 0.0633(8) 0.049(5) Uani 1 1 d . . .
H18 H 0.8018 1.1972 0.0448 0.059 Uiso 1 1 calc R . .
C19 C 0.8248(14) 1.0911(9) 0.0232(7) 0.056(5) Uani 1 1 d . . .
H19 H 0.8307 1.0964 -0.0225 0.067 Uiso 1 1 calc R . .
C20 C 0.8339(12) 1.0209(9) 0.0502(7) 0.046(4) Uani 1 1 d . . .
H20 H 0.8470 0.9788 0.0229 0.055 Uiso 1 1 calc R . .
C21 C 0.8238(11) 1.0139(7) 0.1161(7) 0.035(4) Uani 1 1 d . . .
C22 C 0.7805(10) 0.8431(7) 0.0992(6) 0.019(3) Uani 1 1 d U . .
C23 C 0.8356(12) 0.8326(8) 0.0446(7) 0.037(4) Uani 1 1 d . . .
H23 H 0.9029 0.8672 0.0386 0.045 Uiso 1 1 calc R . .
C24 C 0.7934(15) 0.7711(10) -0.0022(8) 0.056(5) Uani 1 1 d . . .
H24 H 0.8299 0.7648 -0.0411 0.067 Uiso 1 1 calc R . .
C25 C 0.6985(15) 0.7203(10) 0.0091(9) 0.056(5) Uani 1 1 d . . .
H25 H 0.6700 0.6778 -0.0222 0.067 Uiso 1 1 calc R . .
C26 C 0.6428(15) 0.7288(10) 0.0646(9) 0.063(5) Uani 1 1 d . . .
H26 H 0.5768 0.6929 0.0714 0.076 Uiso 1 1 calc R . .
C27 C 0.6862(11) 0.7922(8) 0.1113(7) 0.033(4) Uani 1 1 d . . .
H27 H 0.6503 0.7990 0.1503 0.040 Uiso 1 1 calc R . .
C28 C 0.9760(11) 0.9311(7) 0.1573(6) 0.026(3) Uani 1 1 d . . .
C29 C 1.0534(13) 1.0013(8) 0.1587(7) 0.042(4) Uani 1 1 d . . .
H29 H 1.0313 1.0493 0.1589 0.050 Uiso 1 1 calc R . .
C30 C 1.1620(13) 1.0026(9) 0.1599(7) 0.048(4) Uani 1 1 d . . .
H30 H 1.2144 1.0509 0.1615 0.058 Uiso 1 1 calc R . .
C31 C 1.1923(13) 0.9330(10) 0.1589(7) 0.045(4) Uani 1 1 d . . .
H31 H 1.2666 0.9333 0.1595 0.054 Uiso 1 1 calc R . .
C32 C 1.1184(12) 0.8632(9) 0.1571(6) 0.031(4) Uani 1 1 d . . .
H32 H 1.1410 0.8154 0.1547 0.037 Uiso 1 1 calc R . .
C33 C 1.0123(11) 0.8623(8) 0.1586(6) 0.031(4) Uani 1 1 d . . .
H33 H 0.9615 0.8138 0.1605 0.037 Uiso 1 1 calc R . .
C34 C 0.9217(10) 1.1079(7) 0.2822(6) 0.026(3) Uani 1 1 d . . .
C35 C 0.9793(12) 1.1823(8) 0.2735(7) 0.041(4) Uani 1 1 d . . .
H35 H 0.9487 1.2135 0.2460 0.049 Uiso 1 1 calc R . .
C36 C 1.0776(12) 1.2132(9) 0.3022(9) 0.054(5) Uani 1 1 d . . .
H36 H 1.1138 1.2655 0.2957 0.065 Uiso 1 1 calc R . .
C37 C 1.1259(12) 1.1677(9) 0.3417(8) 0.052(5) Uani 1 1 d . . .
H37 H 1.1962 1.1880 0.3609 0.063 Uiso 1 1 calc R . .
C38 C 1.0691(11) 1.0919(7) 0.3524(7) 0.035(4) Uani 1 1 d . . .
H38 H 1.1004 1.0612 0.3801 0.042 Uiso 1 1 calc R . .
C39 C 0.9673(10) 1.0607(7) 0.3231(6) 0.023(3) Uani 1 1 d . . .
C40 C 0.9763(11) 0.8980(7) 0.3409(6) 0.021(3) Uani 1 1 d . . .
C41 C 1.0714(12) 0.9125(8) 0.3114(7) 0.031(4) Uani 1 1 d . . .
H41 H 1.0931 0.9581 0.2881 0.037 Uiso 1 1 calc R . .
C42 C 1.1406(13) 0.8569(10) 0.3160(7) 0.045(4) Uani 1 1 d . . .
H42 H 1.2086 0.8669 0.2968 0.054 Uiso 1 1 calc R . .
C43 C 1.1065(13) 0.7918(9) 0.3476(7) 0.036(4) Uani 1 1 d . . .
H43 H 1.1495 0.7546 0.3491 0.043 Uiso 1 1 calc R . .
C44 C 1.0105(12) 0.7783(8) 0.3778(7) 0.037(4) Uani 1 1 d . . .
H44 H 0.9880 0.7331 0.4014 0.044 Uiso 1 1 calc R . .
C45 C 0.9443(11) 0.8338(8) 0.3731(7) 0.034(4) Uani 1 1 d . . .
H45 H 0.8770 0.8245 0.3931 0.041 Uiso 1 1 calc R . .
C46 C 0.8338(10) 0.9696(7) 0.4133(7) 0.024(3) Uani 1 1 d . . .
C47 C 0.8754(11) 1.0308(8) 0.4610(7) 0.034(4) Uani 1 1 d . . .
H47 H 0.9358 1.0708 0.4520 0.041 Uiso 1 1 calc R . .
C48 C 0.8295(13) 1.0335(9) 0.5208(7) 0.035(4) Uani 1 1 d . . .
H48 H 0.8557 1.0776 0.5510 0.042 Uiso 1 1 calc R . .
C49 C 0.7494(12) 0.9761(10) 0.5375(6) 0.036(4) Uani 1 1 d . . .
H49 H 0.7214 0.9775 0.5799 0.043 Uiso 1 1 calc R . .
C50 C 0.7079(11) 0.9143(8) 0.4916(7) 0.035(4) Uani 1 1 d . . .
H50 H 0.6497 0.8735 0.5024 0.042 Uiso 1 1 calc R . .
C51 C 0.7496(11) 0.9110(8) 0.4303(7) 0.032(4) Uani 1 1 d . . .
H51 H 0.7199 0.8680 0.3997 0.038 Uiso 1 1 calc R . .
C52 C 0.8346(16) 0.4362(9) 0.1097(9) 0.073(6) Uani 1 1 d D . .
C53 C 0.9226(13) 0.4012(8) 0.0907(8) 0.058(5) Uani 1 1 d D . .
C54 C 0.9082(12) 0.3545(9) 0.0307(8) 0.064(5) Uani 1 1 d D . .
H54 H 0.9642 0.3307 0.0173 0.076 Uiso 1 1 calc R . .
C55 C 0.8149(13) 0.3421(9) -0.0095(7) 0.075(7) Uani 1 1 d DU . .
H55 H 0.8098 0.3111 -0.0497 0.090 Uiso 1 1 calc R . .
C56 C 0.7302(13) 0.3739(9) 0.0078(11) 0.083(7) Uani 1 1 d D . .
H56 H 0.6680 0.3658 -0.0206 0.099 Uiso 1 1 calc R . .
C57 C 0.7366(14) 0.4195(10) 0.0695(8) 0.062(5) Uani 1 1 d . . .
C58 C 1.0267(11) 0.4173(8) 0.1272(8) 0.040(4) Uani 1 1 d . . .
H58 H 1.0196 0.4463 0.1698 0.049 Uiso 1 1 calc R . .
C59 C 1.0597(14) 0.3426(10) 0.1422(9) 0.072(6) Uani 1 1 d . . .
H59A H 1.0024 0.3091 0.1649 0.108 Uiso 1 1 calc R . .
H59B H 1.1259 0.3557 0.1701 0.108 Uiso 1 1 calc R . .
H59C H 1.0722 0.3149 0.1013 0.108 Uiso 1 1 calc R . .
C60 C 1.1160(12) 0.4679(9) 0.0913(7) 0.054(5) Uani 1 1 d . . .
H60A H 1.1223 0.4418 0.0484 0.080 Uiso 1 1 calc R . .
H60B H 1.1841 0.4761 0.1169 0.080 Uiso 1 1 calc R . .
H60C H 1.0992 0.5187 0.0854 0.080 Uiso 1 1 calc R . .
C61 C 0.6461(12) 0.4535(9) 0.0860(9) 0.057(5) Uani 1 1 d . . .
H61 H 0.6341 0.4473 0.1336 0.069 Uiso 1 1 calc R . .
C62 C 0.5459(18) 0.4141(11) 0.0499(10) 0.119(10) Uani 1 1 d . . .
H62A H 0.5513 0.4255 0.0038 0.178 Uiso 1 1 calc R . .
H62B H 0.4861 0.4329 0.0683 0.178 Uiso 1 1 calc R . .
H62C H 0.5334 0.3575 0.0532 0.178 Uiso 1 1 calc R . .
C63 C 0.6631(14) 0.5403(9) 0.0756(10) 0.083(7) Uani 1 1 d . . .
H63A H 0.7251 0.5700 0.1030 0.124 Uiso 1 1 calc R . .
H63B H 0.5988 0.5581 0.0877 0.124 Uiso 1 1 calc R . .
H63C H 0.6764 0.5486 0.0295 0.124 Uiso 1 1 calc R . .
C64 C 0.9371(15) 0.6251(10) 0.0939(8) 0.081(6) Uani 1 1 d . . .
H64A H 0.9216 0.5829 0.0589 0.121 Uiso 1 1 calc R . .
H64B H 1.0108 0.6561 0.0911 0.121 Uiso 1 1 calc R . .
H64C H 0.8868 0.6589 0.0891 0.121 Uiso 1 1 calc R . .
C65 C 1.0572(13) 0.6070(10) 0.2142(9) 0.070(6) Uani 1 1 d . . .
H65A H 1.0551 0.5933 0.2597 0.105 Uiso 1 1 calc R . .
H65B H 1.0871 0.6634 0.2128 0.105 Uiso 1 1 calc R . .
H65C H 1.1025 0.5782 0.1900 0.105 Uiso 1 1 calc R . .
C66 C 0.8392(10) 0.6330(8) 0.2305(7) 0.034(4) Uani 1 1 d . . .
H66 H 0.8419 0.6875 0.2358 0.041 Uiso 1 1 calc R . .
C67 C 0.7698(12) 0.5806(7) 0.3580(7) 0.039(4) Uani 1 1 d . . .
C68 C 0.7485(12) 0.6475(8) 0.3883(9) 0.048(5) Uani 1 1 d . . .
H68 H 0.7200 0.6823 0.3634 0.058 Uiso 1 1 calc R . .
C69 C 0.7686(12) 0.6634(10) 0.4543(9) 0.053(5) Uani 1 1 d . . .
H69 H 0.7552 0.7100 0.4745 0.063 Uiso 1 1 calc R . .
C70 C 0.8072(15) 0.6144(11) 0.4916(10) 0.070(6) Uani 1 1 d . . .
H70 H 0.8169 0.6259 0.5376 0.084 Uiso 1 1 calc R . .
C71 C 0.8319(16) 0.5494(9) 0.4641(8) 0.073(6) Uani 1 1 d . . .
H71 H 0.8615 0.5170 0.4910 0.088 Uiso 1 1 calc R . .
C72 C 0.8153(15) 0.5294(10) 0.3982(8) 0.064(5) Uani 1 1 d . . .
C73 C 1.0047(12) 0.4835(9) 0.3509(8) 0.044(4) Uani 1 1 d . . .
C74 C 1.0628(15) 0.5467(10) 0.3889(9) 0.064(5) Uani 1 1 d . . .
H74 H 1.0276 0.5752 0.4183 0.077 Uiso 1 1 calc R . .
C75 C 1.1750(15) 0.5695(11) 0.3843(9) 0.062(5) Uani 1 1 d . . .
H75 H 1.2156 0.6148 0.4090 0.074 Uiso 1 1 calc R . .
C76 C 1.2253(16) 0.5256(13) 0.3437(11) 0.083(6) Uani 1 1 d . . .
H76 H 1.3011 0.5408 0.3403 0.100 Uiso 1 1 calc R . .
C77 C 1.1673(14) 0.4605(9) 0.3085(9) 0.071(6) Uani 1 1 d . . .
H77 H 1.2012 0.4260 0.2843 0.085 Uiso 1 1 calc R . .
C78 C 1.0599(15) 0.4476(11) 0.3096(8) 0.066(6) Uani 1 1 d . . .
H78 H 1.0192 0.4093 0.2781 0.079 Uiso 1 1 calc R . .
C79 C 0.8325(16) 0.3700(10) 0.4030(8) 0.054(5) Uani 1 1 d . . .
C80 C 0.7529(17) 0.3542(13) 0.4444(11) 0.074(6) Uani 1 1 d . . .
H80 H 0.7063 0.3888 0.4489 0.088 Uiso 1 1 calc R . .
C81 C 0.7357(16) 0.2891(13) 0.4812(10) 0.075(6) Uani 1 1 d . . .
H81 H 0.6776 0.2788 0.5096 0.090 Uiso 1 1 calc R . .
C82 C 0.8026(18) 0.2415(10) 0.4755(9) 0.060(5) Uani 1 1 d . . .
H82 H 0.7919 0.1973 0.5009 0.072 Uiso 1 1 calc R . .
C83 C 0.8830(17) 0.2538(10) 0.4360(11) 0.072(6) Uani 1 1 d . . .
H83 H 0.9288 0.2185 0.4331 0.087 Uiso 1 1 calc R . .
C84 C 0.9014(14) 0.3187(9) 0.3980(8) 0.057(5) Uani 1 1 d . . .
H84 H 0.9594 0.3277 0.3694 0.069 Uiso 1 1 calc R . .
C85 C 0.6150(11) 0.5539(8) 0.2431(8) 0.044(4) Uani 1 1 d . . .
C86 C 0.5780(11) 0.6189(7) 0.2352(7) 0.040(4) Uani 1 1 d . . .
H86 H 0.6245 0.6693 0.2441 0.048 Uiso 1 1 calc R . .
C87 C 0.4740(12) 0.6117(9) 0.2145(8) 0.054(5) Uani 1 1 d . . .
H87 H 0.4498 0.6577 0.2074 0.065 Uiso 1 1 calc R . .
C88 C 0.4024(14) 0.5398(10) 0.2034(10) 0.081(7) Uani 1 1 d . . .
H88 H 0.3316 0.5361 0.1859 0.097 Uiso 1 1 calc R . .
C89 C 0.4369(14) 0.4707(9) 0.2187(9) 0.068(6) Uani 1 1 d . . .
H89 H 0.3871 0.4212 0.2154 0.082 Uiso 1 1 calc R . .
C90 C 0.5468(12) 0.4769(9) 0.2388(9) 0.063(6) Uani 1 1 d . . .
C91 C 0.5499(12) 0.3695(9) 0.3387(8) 0.046(4) Uani 1 1 d . . .
C92 C 0.5130(14) 0.4225(10) 0.3784(9) 0.056(5) Uani 1 1 d . . .
H92 H 0.5156 0.4738 0.3655 0.067 Uiso 1 1 calc R . .
C93 C 0.4727(18) 0.3999(14) 0.4367(12) 0.099(8) Uani 1 1 d . . .
H93 H 0.4530 0.4376 0.4661 0.119 Uiso 1 1 calc R . .
C94 C 0.4598(17) 0.3252(15) 0.4543(11) 0.097(7) Uani 1 1 d . . .
H94 H 0.4314 0.3107 0.4952 0.116 Uiso 1 1 calc R . .
C95 C 0.4897(16) 0.2697(13) 0.4102(12) 0.086(7) Uani 1 1 d . . .
H95 H 0.4793 0.2167 0.4203 0.104 Uiso 1 1 calc R . .
C96 C 0.5342(13) 0.2937(9) 0.3526(8) 0.048(4) Uani 1 1 d . . .
H96 H 0.5540 0.2569 0.3224 0.058 Uiso 1 1 calc R . .
C97 C 0.5293(12) 0.3143(8) 0.2008(9) 0.048(5) Uani 1 1 d . . .
C98 C 0.4178(14) 0.2817(10) 0.2123(8) 0.058(5) Uani 1 1 d . . .
H98 H 0.3837 0.3029 0.2472 0.070 Uiso 1 1 calc R . .
C99 C 0.3600(14) 0.2172(10) 0.1704(9) 0.057(5) Uani 1 1 d . . .
H99 H 0.2859 0.1947 0.1751 0.069 Uiso 1 1 calc R . .
C100 C 0.4163(15) 0.1898(8) 0.1236(10) 0.056(5) Uani 1 1 d . . .
H100 H 0.3798 0.1460 0.0957 0.067 Uiso 1 1 calc R . .
C101 C 0.5241(16) 0.2214(10) 0.1135(9) 0.065(5) Uani 1 1 d . . .
H101 H 0.5588 0.2015 0.0782 0.078 Uiso 1 1 calc R . .
C102 C 0.5776(14) 0.2806(9) 0.1547(8) 0.048(5) Uani 1 1 d . . .
H102 H 0.6528 0.2993 0.1508 0.058 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
Co1A N1A 2.004(9) . ?
Co1A P1A 2.132(4) . ?
Co1A P3A 2.222(4) . ?
Co1A Cl1A 2.269(3) . ?
Co1A P2A 2.301(4) . ?
Co1B N1B 1.931(13) . ?
Co1B P1B 2.125(4) . ?
Co1B P2B 2.260(5) . ?
Co1B Cl1B 2.277(3) . ?
Co1B P3B 2.291(5) . ?
P1A C34 1.827(13) . ?
P1A C15 1.827(12) . ?
P1A C16 1.838(14) . ?
P2A C28 1.828(14) . ?
P2A C21 1.841(14) . ?
P2A C22 1.846(12) . ?
P3A C46 1.821(14) . ?
P3A C39 1.824(12) . ?
P3A C40 1.847(12) . ?
P1B C66 1.810(14) . ?
P1B C67 1.833(15) . ?
P1B C85 1.843(13) . ?
P2B C72 1.800(15) . ?
P2B C79 1.828(17) . ?
P2B C73 1.849(16) . ?
P3B C90 1.826(16) . ?
P3B C91 1.843(16) . ?
P3B C97 1.845(16) . ?
Si1A N1A 1.730(10) . ?
Si1A C13 1.868(13) . ?
Si1A C14 1.870(12) . ?
Si1A C15 1.884(14) . ?
Si1B N1B 1.766(13) . ?
Si1B C65 1.823(16) . ?
Si1B C66 1.881(14) . ?
Si1B C64 1.909(18) . ?
N1A C1 1.385(15) . ?
N1B C52 1.42(2) . ?
C1 C2 1.432(17) . ?
C1 C6 1.433(18) . ?
C2 C3 1.378(17) . ?
C2 C7 1.508(19) . ?
C3 C4 1.334(18) . ?
C3 H3 0.9500 . ?
C4 C5 1.392(19) . ?
C4 H4 0.9500 . ?
C5 C6 1.444(18) . ?
C5 H5 0.9500 . ?
C6 C10 1.533(18) . ?
C7 C8 1.535(18) . ?
C7 C9 1.553(18) . ?
C7 H7 1.0000 . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C8 H8C 0.9800 . ?
C9 H9A 0.9800 . ?
C9 H9B 0.9800 . ?
C9 H9C 0.9800 . ?
C10 C12 1.495(18) . ?
C10 C11 1.526(18) . ?
C10 H10 1.0000 . ?
C11 H11A 0.9800 . ?
C11 H11B 0.9800 . ?
C11 H11C 0.9800 . ?
C12 H12A 0.9800 . ?
C12 H12B 0.9800 . ?
C12 H12C 0.9800 . ?
C13 H13A 0.9800 . ?
C13 H13B 0.9800 . ?
C13 H13C 0.9800 . ?
C14 H14A 0.9800 . ?
C14 H14B 0.9800 . ?
C14 H14C 0.9800 . ?
C15 H15 0.9500 . ?
C16 C17 1.382(18) . ?
C16 C21 1.407(18) . ?
C17 C18 1.352(19) . ?
C17 H17 0.9500 . ?
C18 C19 1.35(2) . ?
C18 H18 0.9500 . ?
C19 C20 1.41(2) . ?
C19 H19 0.9500 . ?
C20 C21 1.371(19) . ?
C20 H20 0.9500 . ?
C22 C23 1.366(18) . ?
C22 C27 1.366(18) . ?
C23 C24 1.40(2) . ?
C23 H23 0.9500 . ?
C24 C25 1.37(2) . ?
C24 H24 0.9500 . ?
C25 C26 1.38(2) . ?
C25 H25 0.9500 . ?
C26 C27 1.419(19) . ?
C26 H26 0.9500 . ?
C27 H27 0.9500 . ?
C28 C29 1.392(18) . ?
C28 C33 1.396(17) . ?
C29 C30 1.39(2) . ?
C29 H29 0.9500 . ?
C30 C31 1.37(2) . ?
C30 H30 0.9500 . ?
C31 C32 1.364(19) . ?
C31 H31 0.9500 . ?
C32 C33 1.356(17) . ?
C32 H32 0.9500 . ?
C33 H33 0.9500 . ?
C34 C35 1.372(18) . ?
C34 C39 1.422(17) . ?
C35 C36 1.349(19) . ?
C35 H35 0.9500 . ?
C36 C37 1.40(2) . ?
C36 H36 0.9500 . ?
C37 C38 1.397(18) . ?
C37 H37 0.9500 . ?
C38 C39 1.392(17) . ?
C38 H38 0.9500 . ?
C40 C45 1.333(18) . ?
C40 C41 1.354(18) . ?
C41 C42 1.471(19) . ?
C41 H41 0.9500 . ?
C42 C43 1.34(2) . ?
C42 H42 0.9500 . ?
C43 C44 1.371(19) . ?
C43 H43 0.9500 . ?
C44 C45 1.441(18) . ?
C44 H44 0.9500 . ?
C45 H45 0.9500 . ?
C46 C51 1.379(18) . ?
C46 C47 1.403(18) . ?
C47 C48 1.379(19) . ?
C47 H47 0.9500 . ?
C48 C49 1.332(19) . ?
C48 H48 0.9500 . ?
C49 C50 1.387(19) . ?
C49 H49 0.9500 . ?
C50 C51 1.382(19) . ?
C50 H50 0.9500 . ?
C51 H51 0.9500 . ?
C52 C57 1.44(2) . ?
C52 C53 1.46(2) . ?
C53 C54 1.42(2) . ?
C53 C58 1.47(2) . ?
C54 C55 1.396(10) . ?
C54 H54 0.9500 . ?
C55 C56 1.378(10) . ?
C55 H55 0.9500 . ?
C56 C57 1.44(2) . ?
C56 H56 0.9500 . ?
C57 C61 1.46(2) . ?
C58 C59 1.52(2) . ?
C58 C60 1.519(19) . ?
C58 H58 1.0000 . ?
C59 H59A 0.9800 . ?
C59 H59B 0.9800 . ?
C59 H59C 0.9800 . ?
C60 H60A 0.9800 . ?
C60 H60B 0.9800 . ?
C60 H60C 0.9800 . ?
C61 C62 1.46(2) . ?
C61 C63 1.52(2) . ?
C61 H61 1.0000 . ?
C62 H62A 0.9800 . ?
C62 H62B 0.9800 . ?
C62 H62C 0.9800 . ?
C63 H63A 0.9800 . ?
C63 H63B 0.9800 . ?
C63 H63C 0.9800 . ?
C64 H64A 0.9800 . ?
C64 H64B 0.9800 . ?
C64 H64C 0.9800 . ?
C65 H65A 0.9800 . ?
C65 H65B 0.9800 . ?
C65 H65C 0.9800 . ?
C66 H66 0.9500 . ?
C67 C68 1.384(19) . ?
C67 C72 1.46(2) . ?
C68 C69 1.37(2) . ?
C68 H68 0.9500 . ?
C69 C70 1.35(2) . ?
C69 H69 0.9500 . ?
C70 C71 1.35(2) . ?
C70 H70 0.9500 . ?
C71 C72 1.37(2) . ?
C71 H71 0.9500 . ?
C73 C78 1.34(2) . ?
C73 C74 1.37(2) . ?
C74 C75 1.41(2) . ?
C74 H74 0.9500 . ?
C75 C76 1.37(2) . ?
C75 H75 0.9500 . ?
C76 C77 1.36(2) . ?
C76 H76 0.9500 . ?
C77 C78 1.34(2) . ?
C77 H77 0.9500 . ?
C78 H78 0.9500 . ?
C79 C80 1.34(2) . ?
C79 C84 1.40(2) . ?
C80 C81 1.39(3) . ?
C80 H80 0.9500 . ?
C81 C82 1.33(2) . ?
C81 H81 0.9500 . ?
C82 C83 1.32(2) . ?
C82 H82 0.9500 . ?
C83 C84 1.40(2) . ?
C83 H83 0.9500 . ?
C84 H84 0.9500 . ?
C85 C86 1.354(18) . ?
C85 C90 1.428(19) . ?
C86 C87 1.361(19) . ?
C86 H86 0.9500 . ?
C87 C88 1.38(2) . ?
C87 H87 0.9500 . ?
C88 C89 1.44(2) . ?
C88 H88 0.9500 . ?
C89 C90 1.43(2) . ?
C89 H89 0.9500 . ?
C91 C96 1.35(2) . ?
C91 C92 1.37(2) . ?
C92 C93 1.36(2) . ?
C92 H92 0.9500 . ?
C93 C94 1.36(3) . ?
C93 H93 0.9500 . ?
C94 C95 1.41(3) . ?
C94 H94 0.9500 . ?
C95 C96 1.38(2) . ?
C95 H95 0.9500 . ?
C96 H96 0.9500 . ?
C97 C102 1.33(2) . ?
C97 C98 1.44(2) . ?
C98 C99 1.42(2) . ?
C98 H98 0.9500 . ?
C99 C100 1.35(2) . ?
C99 H99 0.9500 . ?
C100 C101 1.39(2) . ?
C100 H100 0.9500 . ?
C101 C102 1.34(2) . ?
C101 H101 0.9500 . ?
C102 H102 0.9500 . ?
