Supplementary Material (ESI) for Dalton Transactions This journal is © The Royal Society of Chemistry 2003 data_global _journal_coden_Cambridge 222 _publ_contact_author_name 'Prof Jeffrey Long' _publ_contact_author_address ; Dept. of Chemistry University of California Berkeley CA 94720-1460 UNITED STATES OF AMERICA ; _publ_contact_author_phone '510 642-0860' _publ_contact_author_fax '510 643-3832' _publ_contact_author_email jlong@cchem.berkeley.edu _publ_requested_coeditor_name ? _publ_requested_journal 'Dalton Transactions' #============================================================================== # 3. TITLE AND AUTHOR LIST _publ_section_title ; Synthesis and Characterization of a Decanuclear Cobalt Cluster containing Two Interstitial Phosphorous Atoms ; loop_ _publ_author_name _publ_author_address 'Hong, Chang Seop' ; Department of Chemistry University of California, Berkeley United States of America ; 'Berben, Louise A.' ; Department of Chemistry University of California, Berkeley United States of America ; 'Long, Jeffrey R.' ; Department of Chemistry University of California, Berkeley United States of America ; #============================================================================== data_csh10c _database_code_CSD 205220 _audit_creation_method SHELXL _chemical_name_systematic ; ? ; _chemical_name_common ? _chemical_formula_moiety ? _chemical_formula_structural ? _chemical_formula_analytical ? _chemical_formula_sum 'C39 H41 Co10 N2 O23 P2' _chemical_formula_weight 1556.98 _chemical_melting_point ? _chemical_compound_source synthetic 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' P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' Co Co 0.3494 0.9721 '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' _symmetry_cell_setting triclinic _symmetry_space_group_name_H-M P-1 _symmetry_Int_Tables_number 2 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-x, -y, -z' _cell_length_a 10.0788(2) _cell_length_b 11.8610(4) _cell_length_c 22.9170(8) _cell_angle_alpha 82.2430(10) _cell_angle_beta 79.0640(10) _cell_angle_gamma 86.4050(10) _cell_volume 2663.30(14) _cell_formula_units_Z 2 _cell_measurement_temperature 155(2) _cell_measurement_reflns_used 408 _cell_measurement_theta_min ? _cell_measurement_theta_max ? _exptl_crystal_description block _exptl_crystal_colour 'dark brown ' _exptl_crystal_size_max 0.50 _exptl_crystal_size_mid 0.15 _exptl_crystal_size_min 0.10 _exptl_crystal_density_meas ? _exptl_crystal_density_diffrn 1.942 _exptl_crystal_density_method ? _exptl_crystal_F_000 1546 _exptl_absorpt_coefficient_mu 3.168 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_correction_T_min 0.723 _exptl_absorpt_correction_T_max 1 _exptl_absorpt_process_details 'Blessing, Acta Cryst. (1995) A51 33' _exptl_special_details ; ? ; _diffrn_ambient_temperature 155(2) _diffrn_radiation_wavelength 0.71073 _diffrn_radiation_type MoK\a _diffrn_radiation_source 'fine-focus sealed tube' _diffrn_radiation_monochromator graphite _diffrn_measurement_device SMART _diffrn_measurement_method 'omega scans with profile analysis' _diffrn_standards_number ? _diffrn_standards_interval_count ? _diffrn_standards_interval_time ? _diffrn_standards_decay_% ? _diffrn_reflns_number 13547 _diffrn_reflns_av_R_equivalents 0.0462 _diffrn_reflns_av_sigmaI/netI 0.0757 _diffrn_reflns_limit_h_min -12 _diffrn_reflns_limit_h_max 11 _diffrn_reflns_limit_k_min -13 _diffrn_reflns_limit_k_max 14 _diffrn_reflns_limit_l_min -24 _diffrn_reflns_limit_l_max 27 _diffrn_reflns_theta_min 1.82 _diffrn_reflns_theta_max 25.63 _reflns_number_total 8563 _reflns_number_observed 6069 _reflns_observed_criterion >2sigma(I) _computing_data_collection 'SMART (Siemens, 1995)' _computing_cell_refinement ; SMART (Siemens, 1995), SAINT (Siemens, 1995) ; _computing_data_reduction ; SAINT (Siemens, 1995), XPREP (Siemens, 1995) ; _computing_structure_solution 'SHELXS-86 (Sheldrick, 1990)' _computing_structure_refinement 'SHELXL-93 (Sheldrick, 1993)' _computing_molecular_graphics ? _computing_publication_material ? _refine_special_details ; Refinement on F^2^ for ALL reflections except for 2 with very negative F^2^ or flagged by the user for potential systematic errors. Weighted R-factors wR and all goodnesses of fit S are based on F^2^, conventional R-factors R are based on F, with F set to zero for negative F^2^. The observed criterion of F^2^ > 2sigma(F^2^) is used only for calculating R-factor-obs etc. and is not relevant to the choice of reflections for refinement. R-factors based on F^2^ are statistically about twice as large as those based on F, and R- factors based on ALL data will be even larger. ; _refine_ls_structure_factor_coef Fsqd _refine_ls_matrix_type full _refine_ls_weighting_scheme 'calc w=1/[\s^2^(Fo^2^)+(0.0536P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3' _atom_sites_solution_primary direct _atom_sites_solution_secondary difmap _atom_sites_solution_hydrogens geom _refine_ls_hydrogen_treatment ? _refine_ls_extinction_method none _refine_ls_extinction_coef ? _refine_ls_number_reflns 8562 _refine_ls_number_parameters 693 _refine_ls_number_restraints 0 _refine_ls_R_factor_all 0.0730 _refine_ls_R_factor_obs 0.0445 _refine_ls_wR_factor_all 0.1161 _refine_ls_wR_factor_obs 0.1009 _refine_ls_goodness_of_fit_all 0.997 _refine_ls_goodness_of_fit_obs 1.047 _refine_ls_restrained_S_all 0.998 _refine_ls_restrained_S_obs 1.047 _refine_ls_shift/esd_max 0.003 _refine_ls_shift/esd_mean 0.000 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_thermal_displace_type _atom_site_occupancy _atom_site_calc_flag _atom_site_refinement_flags _atom_site_disorder_group P1 P 0.35672(13) 0.16808(11) 0.22552(6) 0.0169(3) Uani 1 d . . P2 P 0.35818(14) 0.38809(11) 0.25713(6) 0.0185(3) Uani 1 d . . Co1 Co 0.35530(7) -0.00316(6) 0.19736(3) 0.0201(2) Uani 1 d . . Co2 Co 0.48880(7) 0.17042(6) 0.13342(3) 0.0185(2) Uani 1 d . . Co3 Co 0.23616(7) 0.18705(6) 0.15082(3) 0.0180(2) Uani 1 d . . Co4 Co 0.37165(7) 0.35393(6) 0.16087(3) 0.0178(2) Uani 1 d . . Co5 Co 0.54634(7) 0.26677(6) 0.23252(3) 0.0179(2) Uani 1 d . . Co6 Co 0.33705(7) 0.20010(6) 0.32207(3) 0.0183(2) Uani 1 d . . Co7 Co 0.17322(7) 0.29260(6) 0.25234(3) 0.0187(2) Uani 1 d . . Co8 Co 0.48367(7) 0.36050(6) 0.33122(3) 0.0209(2) Uani 1 d . . Co9 Co 0.36667(8) 0.55283(6) 0.28844(3) 0.0249(2) Uani 1 d . . Co10 Co 0.21178(7) 0.38394(6) 0.34706(3) 0.0233(2) Uani 1 d . . C1 C 0.4553(6) -0.0788(5) 0.2473(3) 0.0280(14) Uani 1 d . . C2 C 0.4208(5) -0.0827(5) 0.1353(2) 0.0243(13) Uani 1 d . . C3 C 0.1872(6) -0.0488(5) 0.2228(2) 0.0254(13) Uani 1 d . . C4 C 0.3613(5) 0.1368(4) 0.0857(3) 0.0207(12) Uani 1 d . . C5 C 0.6331(6) 0.1034(4) 0.0961(2) 0.0226(13) Uani 1 d . . C6 C 0.0855(6) 0.1432(4) 0.1343(2) 0.0257(13) Uani 1 d . . C7 C 0.5119(5) 0.3152(5) 0.0906(3) 0.0233(13) Uani 1 d . . C8 C 0.2279(5) 0.3377(4) 0.1154(2) 0.0217(12) Uani 1 d . . C9 C 0.3185(6) 0.0538(5) 0.3497(2) 0.0251(13) Uani 1 d . . C10 C 0.3824(5) 0.5014(5) 0.1322(3) 0.0263(13) Uani 1 d . . C11 C 0.6607(6) 0.3503(5) 0.1758(2) 0.0258(13) Uani 1 d . . C12 C 0.6506(5) 0.1376(5) 0.2414(2) 0.0262(13) Uani 1 d . . C13 C 0.6533(6) 0.3329(5) 0.2926(2) 0.0262(13) Uani 1 d . . C14 C 0.4713(5) 0.2106(5) 0.3708(2) 0.0241(13) Uani 1 d . . C15 C 0.1714(6) 0.2332(5) 0.3779(3) 0.0300(14) Uani 1 d . . C16 C 0.0663(5) 0.4005(5) 0.2202(2) 0.0243(13) Uani 1 d . . C17 C 0.0453(6) 0.1895(5) 0.2797(2) 0.0238(13) Uani 1 d . . C18 C 0.5293(6) 0.4222(5) 0.3904(3) 0.038(2) Uani 1 d . . C19 C 0.5280(7) 0.5929(5) 0.2457(3) 0.034(2) Uani 1 d . . C20 C 0.3595(6) 0.6265(5) 0.3534(3) 0.0349(15) Uani 1 d . . C21 C 0.2394(7) 0.6262(5) 0.2519(3) 0.044(2) Uani 1 d . . C22 C 0.2235(6) 0.4287(5) 0.4165(3) 0.0341(15) Uani 1 d . . C23 C 0.0442(7) 0.4345(6) 0.3445(3) 0.041(2) Uani 1 d . . O1 O 0.5180(4) -0.1331(3) 0.2786(2) 0.0366(10) Uani 1 d . . O2 O 0.4679(4) -0.1399(3) 0.0995(2) 0.0382(11) Uani 1 d . . O3 O 0.0813(5) -0.0828(4) 0.2403(2) 0.0442(12) Uani 1 d . . O4 O 0.3649(4) 0.1072(3) 0.0386(2) 0.0285(9) Uani 1 d . . O5 O 0.7281(4) 0.0603(3) 0.0696(2) 0.0327(10) Uani 1 d . . O6 O -0.0124(4) 0.1161(4) 0.1221(2) 0.0422(11) Uani 1 d . . O7 O 0.5659(4) 0.3658(3) 0.0457(2) 0.0353(10) Uani 1 d . . O8 O 0.1733(4) 0.3989(3) 0.0816(2) 0.0267(9) Uani 1 d . . O9 O 0.2992(5) -0.0369(3) 0.3716(2) 0.0413(11) Uani 1 d . . O10 O 0.3872(4) 0.5940(3) 0.1111(2) 0.0415(11) Uani 1 d . . O11 O 0.7410(4) 0.4023(4) 0.1430(2) 0.0396(11) Uani 1 d . . O12 O 0.7193(4) 0.0583(3) 0.2469(2) 0.0399(11) Uani 1 d . . O13 O 0.7705(4) 0.3338(4) 0.2902(2) 0.0447(12) Uani 1 d . . O14 O 0.5208(4) 0.1514(3) 0.4069(2) 0.0370(10) Uani 1 d . . O15 O 0.0912(4) 0.1800(4) 0.4140(2) 0.0380(11) Uani 1 d . . O16 O -0.0025(4) 0.4695(3) 0.1995(2) 0.0383(11) Uani 1 d . . O17 O -0.0324(4) 0.1222(4) 0.2974(2) 0.0417(11) Uani 1 d . . O18 O 0.5637(5) 0.4580(4) 0.4287(2) 0.066(2) Uani 1 d . . O19 O 0.6295(5) 0.6164(4) 0.2179(2) 0.0558(14) Uani 1 d . . O20 O 0.3582(5) 0.6755(4) 0.3930(2) 0.0487(12) Uani 1 d . . O21 O 0.1575(6) 0.6710(4) 0.2276(3) 0.076(2) Uani 1 d . . O22 O 0.2220(5) 0.4550(4) 0.4631(2) 0.0508(13) Uani 1 d . . O23 O -0.0671(5) 0.4670(5) 0.3493(2) 0.070(2) Uani 1 d . . N1 N 0.2139(5) 0.1599(4) 0.5839(2) 0.0365(13) Uani 1 d . . C24 C 0.2204(8) 0.1774(7) 0.6478(3) 0.060(2) Uani 1 d . . H24A H 0.1364(8) 0.1537(7) 0.6736(3) 0.072 Uiso 1 calc R . H24B H 0.2929(8) 0.1287(7) 0.6608(3) 0.072 Uiso 1 calc R . C25 C 0.2432(11) 0.2980(7) 0.6555(4) 0.105(4) Uani 1 d . . H25A H 0.2653(75) 0.3000(11) 0.6943(14) 0.158 Uiso 1 calc R . H25B H 0.1626(26) 0.3439(15) 0.6520(33) 0.158 Uiso 1 calc R . H25C H 0.3164(49) 0.3271(22) 0.6250(21) 0.158 Uiso 1 calc R . C26 C 0.0948(6) 0.2265(7) 0.5632(3) 0.056(2) Uani 1 d . . H26A H 0.0967(6) 0.2159(7) 0.5218(3) 0.067 Uiso 1 calc R . H26B H 0.1063(6) 0.3067(7) 0.5642(3) 0.067 Uiso 1 calc R . C27 C -0.0441(8) 0.1954(10) 0.5991(4) 0.117(4) Uani 1 d . . H27A H -0.0634(37) 0.1199(28) 0.5932(30) 0.176 Uiso 1 calc R . H27B H -0.1114(13) 0.2485(42) 0.5859(27) 0.176 Uiso 1 calc R . H27C H -0.0450(28) 0.1981(72) 0.6409(6) 0.176 Uiso 1 calc R . C28 C 0.2033(8) 0.0321(6) 0.5849(3) 0.054(2) Uani 1 d . . H28A H 0.2808(8) -0.0062(6) 0.5994(3) 0.065 Uiso 1 calc R . H28B H 0.1231(8) 0.0077(6) 0.6133(3) 0.065 Uiso 1 calc R . C29 C 0.1964(8) -0.0071(6) 0.5251(4) 0.073(3) Uani 1 d . . H29A H 0.1844(56) -0.0877(10) 0.5306(6) 0.109 Uiso 1 calc R . H29B H 0.2789(23) 0.0101(42) 0.4974(8) 0.109 Uiso 1 calc R . H29C H 0.1216(34) 0.0317(34) 0.5095(12) 0.109 Uiso 1 calc R . C30 C 0.3378(6) 0.2030(5) 0.5404(3) 0.037(2) Uani 1 d . . H30A H 0.3279(6) 0.1921(5) 0.5003(3) 0.044 Uiso 1 calc R . H30B H 0.3420(6) 0.2842(5) 0.5414(3) 0.044 Uiso 1 calc R . C31 C 0.4691(6) 0.1464(6) 0.5525(3) 0.053(2) Uani 1 d . . H31A H 0.5427(7) 0.1798(27) 0.5238(13) 0.079 Uiso 1 calc R . H31B H 0.4683(19) 0.0665(9) 0.5495(20) 0.079 Uiso 1 calc R . H31C H 0.4803(22) 0.1566(33) 0.5922(8) 0.079 Uiso 1 calc R . N2 N -0.0542(4) 0.7512(3) 0.0722(2) 0.0193(10) Uani 1 d . . C32 C -0.0966(5) 0.7388(4) 0.1396(2) 0.0238(13) Uani 1 d . . H32A H -0.0161(5) 0.7307(4) 0.1575(2) 0.029 Uiso 1 calc R . H32B H -0.1459(5) 0.6694(4) 0.1525(2) 0.029 Uiso 1 calc R . C33 C -0.1852(6) 0.8389(5) 0.1634(2) 0.0312(14) Uani 1 d . . H33A H -0.1373(15) 0.9080(6) 0.1510(13) 0.047 Uiso 1 calc R . H33B H -0.2063(29) 0.8258(15) 0.2063(3) 0.047 Uiso 1 calc R . H33C H -0.2674(16) 0.8453(19) 0.1476(12) 0.047 Uiso 1 calc R . C34 C 0.0269(5) 0.8567(4) 0.0490(2) 0.0250(13) Uani 1 d . . H34A H 0.0478(5) 0.8631(4) 0.0056(2) 0.030 Uiso 1 calc R . H34B H -0.0292(5) 0.9230(4) 0.0597(2) 0.030 Uiso 1 calc R . C35 C 0.1572(6) 0.8595(5) 0.0720(3) 0.036(2) Uani 1 d . . H35A H 0.1990(20) 0.9307(13) 0.0569(14) 0.055 Uiso 1 calc R . H35B H 0.2171(16) 0.7981(19) 0.0588(14) 0.055 Uiso 1 calc R . H35C H 0.1384(7) 0.8514(33) 0.1150(3) 0.055 Uiso 1 calc R . C36 C 0.0315(6) 0.6434(5) 0.0587(2) 0.0270(14) Uani 1 d . . H36A H 0.1047(6) 0.6365(5) 0.0812(2) 0.032 Uiso 1 calc R . H36B H -0.0242(6) 0.5779(5) 0.0728(2) 0.032 Uiso 1 calc R . C37 C 0.0912(5) 0.6406(5) -0.0072(2) 0.0309(14) Uani 1 d . . H37A H 0.1468(30) 0.5726(16) -0.0119(3) 0.046 Uiso 1 calc R . H37B H 0.1451(31) 0.7060(17) -0.0218(5) 0.046 Uiso 1 calc R . H37C H 0.0194(5) 0.6416(32) -0.0295(3) 0.046 Uiso 1 calc R . C38 C -0.1758(5) 0.7627(5) 0.0408(2) 0.0247(13) Uani 1 d . . H38A H -0.2235(5) 0.8346(5) 0.0479(2) 0.030 Uiso 1 calc R . H38B H -0.1430(5) 0.7659(5) -0.0020(2) 0.030 Uiso 1 calc R . C39 C -0.2760(6) 0.6680(5) 0.0599(2) 0.0292(14) Uani 1 d . . H39A H -0.3456(20) 0.6801(17) 0.0361(11) 0.044 Uiso 1 calc R . H39B H -0.3159(28) 0.6684(20) 0.1014(5) 0.044 Uiso 1 calc R . H39C H -0.2298(9) 0.5959(5) 0.0543(15) 0.044 Uiso 1 calc R . loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_23 _atom_site_aniso_U_13 _atom_site_aniso_U_12 P1 0.0175(7) 0.0155(7) 0.0186(7) -0.0024(6) -0.0067(6) 0.0035(6) P2 0.0197(8) 0.0152(7) 0.0219(8) -0.0028(6) -0.0082(6) 0.0028(6) Co1 0.0225(4) 0.0153(4) 0.0244(4) -0.0034(3) -0.0099(3) 0.0029(3) Co2 0.0175(4) 0.0188(4) 0.0194(4) -0.0029(3) -0.0053(3) 0.0039(3) Co3 0.0177(4) 0.0163(4) 0.0215(4) -0.0022(3) -0.0086(3) 0.0032(3) Co4 0.0190(4) 0.0156(4) 0.0194(4) -0.0006(3) -0.0071(3) 0.0021(3) Co5 0.0170(4) 0.0175(4) 0.0200(4) -0.0028(3) -0.0066(3) 0.0035(3) Co6 0.0194(4) 0.0174(4) 0.0182(4) -0.0016(3) -0.0059(3) 0.0031(3) Co7 0.0157(4) 0.0184(4) 0.0220(4) -0.0011(3) -0.0063(3) 0.0039(3) Co8 0.0225(4) 0.0199(4) 0.0226(4) -0.0050(3) -0.0096(3) 0.0041(3) Co9 0.0303(5) 0.0165(4) 0.0306(5) -0.0065(3) -0.0114(4) 0.0040(3) Co10 0.0226(4) 0.0236(4) 0.0238(4) -0.0065(3) -0.0047(3) 0.0068(3) C1 0.029(3) 0.025(3) 0.033(3) -0.007(3) -0.014(3) 0.005(3) C2 0.025(3) 0.023(3) 0.028(3) -0.004(3) -0.011(3) 0.003(3) C3 0.029(4) 0.020(3) 0.028(3) -0.004(2) -0.008(3) 0.004(3) C4 0.014(3) 0.015(3) 0.034(3) -0.003(2) -0.007(2) 0.004(2) C5 0.026(3) 0.023(3) 0.020(3) 0.001(2) -0.010(3) 0.001(3) C6 0.038(4) 0.017(3) 0.024(3) 0.002(2) -0.013(3) -0.001(3) C7 0.015(3) 0.028(3) 0.029(3) -0.006(3) -0.007(3) 0.004(2) C8 0.024(3) 0.014(3) 0.028(3) -0.008(2) -0.004(3) 0.000(2) C9 0.028(3) 0.025(3) 0.022(3) -0.002(3) -0.008(3) 0.003(3) C10 0.023(3) 0.028(4) 0.031(3) -0.007(3) -0.009(3) -0.001(3) C11 0.024(3) 0.028(3) 0.027(3) -0.001(3) -0.012(3) 0.000(3) C12 0.023(3) 0.021(3) 0.035(4) -0.001(3) -0.008(3) 0.000(3) C13 0.024(3) 0.030(3) 0.024(3) 0.000(3) -0.008(3) 0.004(3) C14 0.023(3) 0.023(3) 0.030(3) -0.008(3) -0.011(3) 0.002(2) C15 0.031(4) 0.030(3) 0.029(3) -0.008(3) -0.005(3) 0.013(3) C16 0.019(3) 0.026(3) 0.028(3) -0.004(3) -0.005(3) 0.004(3) C17 0.023(3) 0.021(3) 0.029(3) 0.000(3) -0.011(3) 0.005(3) C18 0.039(4) 0.038(4) 0.042(4) -0.017(3) -0.021(3) 0.015(3) C19 0.059(5) 0.024(3) 0.022(3) -0.003(3) -0.008(3) -0.009(3) C20 0.038(4) 0.029(4) 0.039(4) -0.011(3) -0.009(3) 0.003(3) C21 0.057(5) 0.019(3) 0.067(5) -0.010(3) -0.035(4) 0.010(3) C22 0.037(4) 0.035(4) 0.031(4) -0.008(3) -0.006(3) 0.002(3) C23 0.041(4) 0.045(4) 0.040(4) -0.018(3) -0.014(3) 0.015(3) O1 0.041(3) 0.034(3) 0.039(3) -0.002(2) -0.022(2) 0.011(2) O2 0.041(3) 0.034(3) 0.040(3) -0.013(2) -0.005(2) 0.007(2) O3 0.036(3) 0.033(3) 0.061(3) -0.004(2) -0.002(2) -0.003(2) O4 0.035(2) 0.032(2) 0.022(2) -0.010(2) -0.014(2) 0.007(2) O5 0.026(2) 0.033(2) 0.036(2) -0.004(2) 0.000(2) 0.010(2) O6 0.038(3) 0.041(3) 0.054(3) -0.002(2) -0.023(2) -0.009(2) O7 0.034(3) 0.037(3) 0.030(2) 0.003(2) 0.001(2) 0.005(2) O8 0.033(2) 0.020(2) 0.031(2) 0.000(2) -0.020(2) 0.003(2) O9 0.063(3) 0.021(2) 0.039(3) 0.006(2) -0.013(2) -0.004(2) O10 0.058(3) 0.020(2) 0.045(3) 0.013(2) -0.017(2) -0.003(2) O11 0.033(3) 0.048(3) 0.037(3) 0.005(2) -0.008(2) -0.015(2) O12 0.032(2) 0.029(2) 0.064(3) -0.011(2) -0.021(2) 0.015(2) O13 0.025(3) 0.070(3) 0.046(3) -0.018(2) -0.018(2) -0.001(2) O14 0.043(3) 0.032(2) 0.040(3) 0.004(2) -0.026(2) 0.001(2) O15 0.030(2) 0.042(3) 0.033(3) 0.006(2) 0.009(2) 0.002(2) O16 0.034(2) 0.036(3) 0.040(3) 0.005(2) -0.009(2) 0.013(2) O17 0.032(3) 0.042(3) 0.049(3) 0.005(2) -0.006(2) -0.010(2) O18 0.083(4) 0.068(4) 0.066(4) -0.043(3) -0.048(3) 0.019(3) O19 0.061(3) 0.057(3) 0.044(3) -0.014(2) 0.015(3) -0.028(3) O20 0.066(3) 0.039(3) 0.043(3) -0.022(2) -0.006(2) 0.003(2) O21 0.094(4) 0.035(3) 0.124(5) -0.019(3) -0.084(4) 0.026(3) O22 0.074(4) 0.051(3) 0.030(3) -0.013(2) -0.010(2) -0.007(3) O23 0.042(3) 0.088(4) 0.091(4) -0.049(3) -0.028(3) 0.039(3) N1 0.032(3) 0.050(3) 0.025(3) 0.010(2) -0.011(2) 0.003(3) C24 0.071(6) 0.085(6) 0.023(4) -0.002(4) -0.015(4) 0.015(5) C25 0.181(11) 0.081(7) 0.073(7) -0.037(5) -0.074(7) 0.066(7) C26 0.035(4) 0.091(6) 0.035(4) 0.010(4) -0.006(3) 0.017(4) C27 0.026(5) 0.233(14) 0.074(7) 0.015(7) 0.007(4) 0.011(6) C28 0.053(5) 0.056(5) 0.051(5) 0.024(4) -0.021(4) -0.021(4) C29 0.078(6) 0.053(5) 0.100(7) -0.001(5) -0.049(5) -0.013(5) C30 0.034(4) 0.037(4) 0.035(4) 0.009(3) -0.006(3) 0.000(3) C31 0.026(4) 0.061(5) 0.072(5) -0.002(4) -0.015(4) 0.001(3) N2 0.022(2) 0.017(2) 0.021(2) -0.003(2) -0.009(2) 0.005(2) C32 0.027(3) 0.024(3) 0.021(3) -0.002(2) -0.007(2) 0.006(2) C33 0.038(4) 0.028(3) 0.027(3) -0.010(3) -0.003(3) 0.003(3) C34 0.032(3) 0.016(3) 0.026(3) -0.003(2) -0.007(3) 0.003(2) C35 0.037(4) 0.039(4) 0.037(4) -0.009(3) -0.012(3) -0.007(3) C36 0.026(3) 0.022(3) 0.032(3) -0.005(3) -0.007(3) 0.012(3) C37 0.024(3) 0.030(3) 0.038(4) -0.013(3) 0.000(3) 0.007(3) C38 0.024(3) 0.028(3) 0.025(3) -0.004(2) -0.015(3) 0.007(3) C39 0.027(3) 0.031(3) 0.032(3) -0.009(3) -0.009(3) 0.004(3) _geom_special_details ; All esds (except the esd in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell esds are taken into account individually in the estimation of esds in distances, angles and torsion angles; correlations between esds in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell esds is used for estimating esds involving l.s. planes. ; 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 Co1 2.2142(15) . ? P1 Co3 2.2603(15) . ? P1 Co6 2.2649(15) . ? P1 Co2 2.2696(15) . ? P1 Co7 2.3347(14) . ? P1 Co5 2.3443(15) . ? P1 Co4 2.4804(15) . ? P1 P2 2.803(2) . ? P2 Co9 2.182(2) . ? P2 Co7 2.269(2) . ? P2 Co4 2.2735(15) . ? P2 Co8 2.2811(15) . ? P2 Co10 2.292(2) . ? P2 Co5 2.3359(15) . ? P2 Co6 2.5051(15) . ? Co1 C3 1.777(6) . ? Co1 C1 1.782(6) . ? Co1 C2 1.810(6) . ? Co1 Co2 2.6423(10) . ? Co1 Co3 2.6769(9) . ? Co2 C5 1.745(5) . ? Co2 C7 1.863(6) . ? Co2 C4 1.929(5) . ? Co2 Co3 2.5010(10) . ? Co2 Co4 2.5086(9) . ? Co2 Co5 2.8431(10) . ? Co3 C6 1.758(6) . ? Co3 C8 1.864(5) . ? Co3 C4 1.899(5) . ? Co3 Co4 2.5333(10) . ? Co3 Co7 2.7403(10) . ? Co4 C10 1.786(6) . ? Co4 C8 1.971(5) . ? Co4 C7 2.014(5) . ? Co4 Co7 2.6652(10) . ? Co4 Co5 2.6971(9) . ? Co5 C11 1.797(6) . ? Co5 C12 1.813(5) . ? Co5 C13 2.152(6) . ? Co5 Co8 2.6077(10) . ? Co5 Co6 2.7231(10) . ? Co6 C9 1.774(6) . ? Co6 C14 1.930(5) . ? Co6 C15 1.954(6) . ? Co6 Co10 2.5286(9) . ? Co6 Co8 2.5348(10) . ? Co6 Co7 2.6046(9) . ? Co7 C17 1.799(6) . ? Co7 C16 1.794(5) . ? Co7 Co10 2.6543(10) . ? Co8 C18 1.769(6) . ? Co8 C13 1.803(6) . ? Co8 C14 1.884(5) . ? Co8 Co9 2.6558(10) . ? Co8 Co10 2.6968(10) . ? Co9 C21 1.782(6) . ? Co9 C19 1.787(7) . ? Co9 C20 1.814(6) . ? Co9 Co10 2.6693(11) . ? Co10 C23 1.765(6) . ? Co10 C22 1.771(6) . ? Co10 C15 1.872(6) . ? C1 O1 1.151(6) . ? C2 O2 1.150(6) . ? C3 O3 1.145(6) . ? C4 O4 1.174(6) . ? C5 O5 1.161(6) . ? C6 O6 1.150(7) . ? C7 O7 1.173(6) . ? C8 O8 1.179(6) . ? C9 O9 1.135(6) . ? C10 O10 1.138(6) . ? C11 O11 1.143(6) . ? C12 O12 1.140(6) . ? C13 O13 1.173(6) . ? C14 O14 1.176(6) . ? C15 O15 1.185(6) . ? C16 O16 1.151(6) . ? C17 O17 1.133(6) . ? C18 O18 1.143(7) . ? C19 O19 1.127(7) . ? C20 O20 1.140(7) . ? C21 O21 1.146(7) . ? C22 O22 1.148(7) . ? C23 O23 1.154(7) . ? N1 C30 1.512(7) . ? N1 C26 1.513(8) . ? N1 C24 1.520(8) . ? N1 C28 1.524(8) . ? C24 C25 1.501(10) . ? C26 C27 1.523(9) . ? C28 C29 1.519(10) . ? C30 C31 1.503(8) . ? N2 C34 1.517(6) . ? N2 C32 1.513(6) . ? N2 C38 1.525(6) . ? N2 C36 1.530(6) . ? C32 C33 1.536(7) . ? C34 C35 1.508(8) . ? C36 C37 1.520(7) . ? C38 C39 1.521(7) . ? 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 Co1 P1 Co3 73.48(5) . . ? Co1 P1 Co6 123.84(6) . . ? Co3 P1 Co6 140.66(7) . . ? Co1 P1 Co2 72.20(5) . . ? Co3 P1 Co2 67.02(4) . . ? Co6 P1 Co2 147.89(7) . . ? Co1 P1 Co7 128.36(7) . . ? Co3 P1 Co7 73.20(5) . . ? Co6 P1 Co7 68.96(4) . . ? Co2 P1 Co7 126.08(6) . . ? Co1 P1 Co5 127.13(6) . . ? Co3 P1 Co5 128.78(6) . . ? Co6 P1 Co5 72.40(5) . . ? Co2 P1 Co5 76.06(5) . . ? Co7 P1 Co5 104.50(6) . . ? Co1 P1 Co4 127.52(6) . . ? Co3 P1 Co4 64.41(4) . . ? Co6 P1 Co4 108.61(6) . . ? Co2 P1 Co4 63.58(4) . . ? Co7 P1 Co4 67.14(4) . . ? Co5 P1 Co4 67.91(4) . . ? Co1 P1 P2 178.04(7) . . ? Co3 P1 P2 104.84(6) . . ? Co6 P1 P2 58.10(4) . . ? Co2 P1 P2 106.27(6) . . ? Co7 P1 P2 51.43(4) . . ? Co5 P1 P2 53.08(4) . . ? Co4 P1 P2 50.53(4) . . ? Co9 P2 Co7 128.47(7) . . ? Co9 P2 Co4 127.01(7) . . ? Co7 P2 Co4 71.86(5) . . ? Co9 P2 Co8 72.99(5) . . ? Co7 P2 Co8 126.90(7) . . ? Co4 P2 Co8 139.73(7) . . ? Co9 P2 Co10 73.19(5) . . ? Co7 P2 Co10 71.17(5) . . ? Co4 P2 Co10 142.18(7) . . ? Co8 P2 Co10 72.26(5) . . ? Co9 P2 Co5 124.24(7) . . ? Co7 P2 Co5 106.92(6) . . ? Co4 P2 Co5 71.61(5) . . ? Co8 P2 Co5 68.77(4) . . ? Co10 P2 Co5 127.49(6) . . ? Co9 P2 Co6 125.48(6) . . ? Co7 P2 Co6 65.92(4) . . ? Co4 P2 Co6 107.49(6) . . ? Co8 P2 Co6 63.76(4) . . ? Co10 P2 Co6 63.43(4) . . ? Co5 P2 Co6 68.35(4) . . ? Co9 P2 P1 175.05(7) . . ? Co7 P2 P1 53.58(4) . . ? Co4 P2 P1 57.37(4) . . ? Co8 P2 P1 102.15(6) . . ? Co10 P2 P1 104.65(6) . . ? Co5 P2 P1 53.35(4) . . ? Co6 P2 P1 50.14(4) . . ? C3 Co1 C1 106.6(3) . . ? C3 Co1 C2 104.4(2) . . ? C1 Co1 C2 95.6(2) . . ? C3 Co1 P1 105.6(2) . . ? C1 Co1 P1 98.5(2) . . ? C2 Co1 P1 141.5(2) . . ? C3 Co1 Co2 140.5(2) . . ? C1 Co1 Co2 109.9(2) . . ? C2 Co1 Co2 86.6(2) . . ? P1 Co1 Co2 54.87(4) . . ? C3 Co1 Co3 84.5(2) . . ? C1 Co1 Co3 152.5(2) . . ? C2 Co1 Co3 106.1(2) . . ? P1 Co1 Co3 54.05(4) . . ? Co2 Co1 Co3 56.09(2) . . ? C5 Co2 C7 97.8(2) . . ? C5 Co2 C4 98.9(2) . . ? C7 Co2 C4 91.0(2) . . ? C5 Co2 P1 141.1(2) . . ? C7 Co2 P1 114.3(2) . . ? C4 Co2 P1 101.8(2) . . ? C5 Co2 Co3 145.5(2) . . ? C7 Co2 Co3 94.4(2) . . ? C4 Co2 Co3 48.7(2) . . ? P1 Co2 Co3 56.31(4) . . ? C5 Co2 Co4 147.2(2) . . ? C7 Co2 Co4 52.4(2) . . ? C4 Co2 Co4 95.32(15) . . ? P1 Co2 Co4 62.31(4) . . ? Co3 Co2 Co4 60.75(3) . . ? C5 Co2 Co1 102.4(2) . . ? C7 Co2 Co1 157.0(2) . . ? C4 Co2 Co1 75.3(2) . . ? P1 Co2 Co1 52.93(4) . . ? Co3 Co2 Co1 62.66(3) . . ? Co4 Co2 Co1 109.70(3) . . ? C5 Co2 Co5 111.0(2) . . ? C7 Co2 Co5 86.6(2) . . ? C4 Co2 Co5 150.1(2) . . ? P1 Co2 Co5 53.16(4) . . ? Co3 Co2 Co5 101.78(3) . . ? Co4 Co2 Co5 60.14(3) . . ? Co1 Co2 Co5 96.11(3) . . ? C6 Co3 C8 98.0(2) . . ? C6 Co3 C4 99.5(2) . . ? C8 Co3 C4 94.5(2) . . ? C6 Co3 P1 140.9(2) . . ? C8 Co3 P1 111.3(2) . . ? C4 Co3 P1 103.2(2) . . ? C6 Co3 Co2 147.5(2) . . ? C8 Co3 Co2 95.1(2) . . ? C4 Co3 Co2 49.7(2) . . ? P1 Co3 Co2 56.67(4) . . ? C6 Co3 Co4 146.3(2) . . ? C8 Co3 Co4 50.5(2) . . ? C4 Co3 Co4 95.3(2) . . ? P1 Co3 Co4 62.01(4) . . ? Co2 Co3 Co4 59.77(3) . . ? C6 Co3 Co1 105.2(2) . . ? C8 Co3 Co1 155.7(2) . . ? C4 Co3 Co1 74.9(2) . . ? P1 Co3 Co1 52.47(4) . . ? Co2 Co3 Co1 61.26(3) . . ? Co4 Co3 Co1 107.87(3) . . ? C6 Co3 Co7 108.4(2) . . ? C8 Co3 Co7 80.9(2) . . ? C4 Co3 Co7 152.1(2) . . ? P1 Co3 Co7 54.65(4) . . ? Co2 Co3 Co7 102.98(3) . . ? Co4 Co3 Co7 60.56(3) . . ? Co1 Co3 Co7 98.21(3) . . ? C10 Co4 C8 90.6(2) . . ? C10 Co4 C7 89.9(2) . . ? C8 Co4 C7 89.8(2) . . ? C10 Co4 P2 93.1(2) . . ? C8 Co4 P2 130.5(2) . . ? C7 Co4 P2 139.5(2) . . ? C10 Co4 P1 165.2(2) . . ? C8 Co4 P1 99.5(2) . . ? C7 Co4 P1 100.9(2) . . ? P2 Co4 P1 72.10(5) . . ? C10 Co4 Co2 136.9(2) . . ? C8 Co4 Co2 92.22(15) . . ? C7 Co4 Co2 47.1(2) . . ? P2 Co4 Co2 116.60(4) . . ? P1 Co4 Co2 54.12(4) . . ? C10 Co4 Co3 137.5(2) . . ? C8 Co4 Co3 46.9(2) . . ? C7 Co4 Co3 89.8(2) . . ? P2 Co4 Co3 113.65(5) . . ? P1 Co4 Co3 53.58(4) . . ? Co2 Co4 Co3 59.47(3) . . ? C10 Co4 Co7 118.0(2) . . ? C8 Co4 Co7 81.1(2) . . ? C7 Co4 Co7 150.5(2) . . ? P2 Co4 Co7 53.98(4) . . ? P1 Co4 Co7 53.82(4) . . ? Co2 Co4 Co7 104.94(3) . . ? Co3 Co4 Co7 63.56(3) . . ? C10 Co4 Co5 117.4(2) . . ? C8 Co4 Co5 151.8(2) . . ? C7 Co4 Co5 87.9(2) . . ? P2 Co4 Co5 55.27(4) . . ? P1 Co4 Co5 53.65(4) . . ? Co2 Co4 Co5 66.09(3) . . ? Co3 Co4 Co5 105.06(3) . . ? Co7 Co4 Co5 87.25(3) . . ? C11 Co5 C12 99.5(2) . . ? C11 Co5 C13 83.5(2) . . ? C12 Co5 C13 86.9(2) . . ? C11 Co5 P2 105.1(2) . . ? C12 Co5 P2 155.1(2) . . ? C13 Co5 P2 92.15(15) . . ? C11 Co5 P1 130.5(2) . . ? C12 Co5 P1 93.3(2) . . ? C13 Co5 P1 145.1(2) . . ? P2 Co5 P1 73.57(5) . . ? C11 Co5 Co8 112.2(2) . . ? C12 Co5 Co8 112.1(2) . . ? C13 Co5 Co8 43.19(15) . . ? P2 Co5 Co8 54.62(4) . . ? P1 Co5 Co8 106.40(4) . . ? C11 Co5 Co4 80.9(2) . . ? C12 Co5 Co4 136.7(2) . . ? C13 Co5 Co4 135.49(15) . . ? P2 Co5 Co4 53.12(4) . . ? P1 Co5 Co4 58.44(4) . . ? Co8 Co5 Co4 107.42(3) . . ? C11 Co5 Co6 163.4(2) . . ? C12 Co5 Co6 96.4(2) . . ? C13 Co5 Co6 92.8(2) . . ? P2 Co5 Co6 58.77(4) . . ? P1 Co5 Co6 52.45(4) . . ? Co8 Co5 Co6 56.74(3) . . ? Co4 Co5 Co6 90.70(3) . . ? C11 Co5 Co2 83.5(2) . . ? C12 Co5 Co2 83.1(2) . . ? C13 Co5 Co2 162.1(2) . . ? P2 Co5 Co2 103.19(4) . . ? P1 Co5 Co2 50.78(4) . . ? Co8 Co5 Co2 154.70(4) . . ? Co4 Co5 Co2 53.77(2) . . ? Co6 Co5 Co2 103.03(3) . . ? C9 Co6 C14 90.7(2) . . ? C9 Co6 C15 88.2(2) . . ? C14 Co6 C15 100.8(2) . . ? C9 Co6 P1 93.0(2) . . ? C14 Co6 P1 131.6(2) . . ? C15 Co6 P1 127.6(2) . . ? C9 Co6 P2 164.6(2) . . ? C14 Co6 P2 101.1(2) . . ? C15 Co6 P2 99.2(2) . . ? P1 Co6 P2 71.76(5) . . ? C9 Co6 Co10 135.4(2) . . ? C14 Co6 Co10 94.8(2) . . ? C15 Co6 Co10 47.2(2) . . ? P1 Co6 Co10 114.97(5) . . ? P2 Co6 Co10 54.18(4) . . ? C9 Co6 Co8 138.1(2) . . ? C14 Co6 Co8 47.6(2) . . ? C15 Co6 Co8 101.5(2) . . ? P1 Co6 Co8 111.42(5) . . ? P2 Co6 Co8 53.82(4) . . ? Co10 Co6 Co8 64.36(3) . . ? C9 Co6 Co7 117.2(2) . . ? C14 Co6 Co7 151.6(2) . . ? C15 Co6 Co7 76.4(2) . . ? P1 Co6 Co7 56.78(4) . . ? P2 Co6 Co7 52.67(4) . . ? Co10 Co6 Co7 62.25(3) . . ? Co8 Co6 Co7 104.71(3) . . ? C9 Co6 Co5 120.2(2) . . ? C14 Co6 Co5 81.8(2) . . ? C15 Co6 Co5 151.5(2) . . ? P1 Co6 Co5 55.15(4) . . ? P2 Co6 Co5 52.88(4) . . ? Co10 Co6 Co5 104.39(3) . . ? Co8 Co6 Co5 59.34(3) . . ? Co7 Co6 Co5 87.93(3) . . ? C17 Co7 C16 96.7(2) . . ? C17 Co7 P2 154.5(2) . . ? C16 Co7 P2 103.4(2) . . ? C17 Co7 P1 98.7(2) . . ? C16 Co7 P1 141.5(2) . . ? P2 Co7 P1 74.99(5) . . ? C17 Co7 Co6 94.6(2) . . ? C16 Co7 Co6 157.9(2) . . ? P2 Co7 Co6 61.41(4) . . ? P1 Co7 Co6 54.25(4) . . ? C17 Co7 Co10 106.2(2) . . ? C16 Co7 Co10 100.9(2) . . ? P2 Co7 Co10 54.83(4) . . ? P1 Co7 Co10 108.17(4) . . ? Co6 Co7 Co10 57.47(3) . . ? C17 Co7 Co4 143.2(2) . . ? C16 Co7 Co4 88.3(2) . . ? P2 Co7 Co4 54.16(4) . . ? P1 Co7 Co4 59.04(4) . . ? Co6 Co7 Co4 94.05(3) . . ? Co10 Co7 Co4 108.59(3) . . ? C17 Co7 Co3 87.3(2) . . ? C16 Co7 Co3 93.8(2) . . ? P2 Co7 Co3 106.60(4) . . ? P1 Co7 Co3 52.15(4) . . ? Co6 Co7 Co3 105.71(3) . . ? Co10 Co7 Co3 158.45(4) . . ? Co4 Co7 Co3 55.87(2) . . ? C18 Co8 C13 96.6(3) . . ? C18 Co8 C14 96.5(3) . . ? C13 Co8 C14 92.3(2) . . ? C18 Co8 P2 144.2(2) . . ? C13 Co8 P2 104.2(2) . . ? C14 Co8 P2 111.2(2) . . ? C18 Co8 Co6 136.4(2) . . ? C13 Co8 Co6 108.8(2) . . ? C14 Co8 Co6 49.1(2) . . ? P2 Co8 Co6 62.43(4) . . ? C18 Co8 Co5 151.5(2) . . ? C13 Co8 Co5 54.8(2) . . ? C14 Co8 Co5 85.9(2) . . ? P2 Co8 Co5 56.61(4) . . ? Co6 Co8 Co5 63.93(3) . . ? C18 Co8 Co9 93.2(2) . . ? C13 Co8 Co9 114.4(2) . . ? C14 Co8 Co9 150.4(2) . . ? P2 Co8 Co9 51.79(4) . . ? Co6 Co8 Co9 106.87(3) . . ? Co5 Co8 Co9 98.73(3) . . ? C18 Co8 Co10 105.4(2) . . ? C13 Co8 Co10 157.3(2) . . ? C14 Co8 Co10 90.6(2) . . ? P2 Co8 Co10 54.06(4) . . ? Co6 Co8 Co10 57.71(3) . . ? Co5 Co8 Co10 102.97(3) . . ? Co9 Co8 Co10 59.82(3) . . ? C21 Co9 C19 108.1(3) . . ? C21 Co9 C20 103.2(3) . . ? C19 Co9 C20 101.1(3) . . ? C21 Co9 P2 97.6(2) . . ? C19 Co9 P2 98.2(2) . . ? C20 Co9 P2 145.4(2) . . ? C21 Co9 Co8 150.7(2) . . ? C19 Co9 Co8 88.5(2) . . ? C20 Co9 Co8 96.8(2) . . ? P2 Co9 Co8 55.22(4) . . ? C21 Co9 Co10 95.8(2) . . ? C19 Co9 Co10 147.0(2) . . ? C20 Co9 Co10 94.9(2) . . ? P2 Co9 Co10 55.30(4) . . ? Co8 Co9 Co10 60.85(3) . . ? C23 Co10 C22 97.6(3) . . ? C23 Co10 C15 97.0(3) . . ? C22 Co10 C15 95.9(3) . . ? C23 Co10 P2 116.6(2) . . ? C22 Co10 P2 133.0(2) . . ? C15 Co10 P2 109.8(2) . . ? C23 Co10 Co6 132.0(2) . . ? C22 Co10 Co6 117.0(2) . . ? C15 Co10 Co6 50.0(2) . . ? P2 Co10 Co6 62.39(4) . . ? C23 Co10 Co7 80.6(2) . . ? C22 Co10 Co7 171.7(2) . . ? C15 Co10 Co7 76.4(2) . . ? P2 Co10 Co7 53.99(4) . . ? Co6 Co10 Co7 60.28(3) . . ? C23 Co10 Co9 105.0(2) . . ? C22 Co10 Co9 90.6(2) . . ? C15 Co10 Co9 156.0(2) . . ? P2 Co10 Co9 51.51(4) . . ? Co6 Co10 Co9 106.64(3) . . ? Co7 Co10 Co9 97.70(3) . . ? C23 Co10 Co8 164.3(2) . . ? C22 Co10 Co8 84.9(2) . . ? C15 Co10 Co8 98.2(2) . . ? P2 Co10 Co8 53.67(4) . . ? Co6 Co10 Co8 57.93(3) . . ? Co7 Co10 Co8 99.02(3) . . ? Co9 Co10 Co8 59.33(3) . . ? O1 C1 Co1 176.3(5) . . ? O2 C2 Co1 173.8(5) . . ? O3 C3 Co1 176.9(5) . . ? O4 C4 Co3 140.8(4) . . ? O4 C4 Co2 137.5(4) . . ? Co3 C4 Co2 81.6(2) . . ? O5 C5 Co2 177.9(5) . . ? O6 C6 Co3 178.3(5) . . ? O7 C7 Co2 144.1(4) . . ? O7 C7 Co4 135.2(4) . . ? Co2 C7 Co4 80.5(2) . . ? O8 C8 Co3 142.2(4) . . ? O8 C8 Co4 135.1(4) . . ? Co3 C8 Co4 82.6(2) . . ? O9 C9 Co6 174.0(5) . . ? O10 C10 Co4 176.1(5) . . ? O11 C11 Co5 174.2(5) . . ? O12 C12 Co5 178.0(5) . . ? O13 C13 Co8 149.8(5) . . ? O13 C13 Co5 128.1(4) . . ? Co8 C13 Co5 82.0(2) . . ? O14 C14 Co8 138.9(5) . . ? O14 C14 Co6 137.8(5) . . ? Co8 C14 Co6 83.3(2) . . ? O15 C15 Co10 140.6(4) . . ? O15 C15 Co6 136.6(4) . . ? Co10 C15 Co6 82.7(2) . . ? O16 C16 Co7 179.8(6) . . ? O17 C17 Co7 178.0(5) . . ? O18 C18 Co8 176.7(5) . . ? O19 C19 Co9 178.5(6) . . ? O20 C20 Co9 177.5(6) . . ? O21 C21 Co9 178.1(6) . . ? O22 C22 Co10 175.1(6) . . ? O23 C23 Co10 172.8(6) . . ? C30 N1 C26 105.8(4) . . ? C30 N1 C24 111.6(5) . . ? C26 N1 C24 110.9(5) . . ? C30 N1 C28 110.9(5) . . ? C26 N1 C28 112.0(5) . . ? C24 N1 C28 105.7(5) . . ? C25 C24 N1 114.1(6) . . ? N1 C26 C27 115.9(6) . . ? C29 C28 N1 115.5(5) . . ? C31 C30 N1 114.6(5) . . ? C34 N2 C32 111.5(4) . . ? C34 N2 C38 106.5(4) . . ? C32 N2 C38 111.8(4) . . ? C34 N2 C36 110.8(4) . . ? C32 N2 C36 105.4(4) . . ? C38 N2 C36 110.9(4) . . ? N2 C32 C33 114.3(4) . . ? C35 C34 N2 115.2(4) . . ? C37 C36 N2 114.3(4) . . ? C39 C38 N2 115.5(4) . . ? _refine_diff_density_max 0.645 _refine_diff_density_min -0.991 _refine_diff_density_rms 0.127