#------------------------------------------------------------------------------
#$Date: 2016-03-24 17:12:39 +0200 (Thu, 24 Mar 2016) $
#$Revision: 179681 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/03/7000393.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_7000393
loop_
_publ_author_name
'Agostinho, Magno'
'Rosa, Vitor'
'Avilés, Teresa'
'Welter, Richard'
'Braunstein, Pierre'
_publ_section_title
;
 Synthesis and characterization of Co and Ni complexes stabilized by
 keto- and acetamide-derived P,O-type phosphine ligands
;
_journal_issue                   5
_journal_name_full               'Dalton Transactions'
_journal_page_first              814
_journal_page_last               822
_journal_paper_doi               10.1039/b814284j
_journal_year                    2009
_chemical_formula_moiety         'C19 H18 Co I N O P'
_chemical_formula_sum            'C19 H18 Co I N O P'
_chemical_formula_weight         493.14
_chemical_name_systematic
;
?
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 100.1030(13)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   12.6820(2)
_cell_length_b                   8.3580(2)
_cell_length_c                   17.9100(4)
_cell_measurement_reflns_used    5404
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      30.034
_cell_measurement_theta_min      0.998
_cell_volume                     1868.95(7)
_computing_cell_refinement       'Denzo (Nonius B.V., 1998)'
_computing_data_collection       'Collect (Nonius B.V., 1998)'
_computing_data_reduction        'Denzo (Nonius B.V., 1998)'
_computing_molecular_graphics    'PLATON 98 (Spek, 1998)'
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  KappaCCD
_diffrn_measurement_method       'φ scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0298
_diffrn_reflns_av_sigmaI/netI    0.0531
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_k_min       -10
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_number            9352
_diffrn_reflns_theta_full        30.00
_diffrn_reflns_theta_max         30.00
_diffrn_reflns_theta_min         1.63
_exptl_absorpt_coefficient_mu    2.661
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            black
_exptl_crystal_density_diffrn    1.753
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             968
_exptl_crystal_size_max          0.12
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.892
_refine_diff_density_min         -1.093
_refine_diff_density_rms         0.119
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.046
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     217
_refine_ls_number_reflns         5456
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.046
_refine_ls_R_factor_all          0.0591
_refine_ls_R_factor_gt           0.0358
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0387P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0793
_refine_ls_wR_factor_ref         0.0886
_reflns_number_gt                4025
_reflns_number_total             5456
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b814284j.txt
_cod_data_source_block           Complex4
_cod_original_sg_symbol_H-M      P21/c
_cod_database_code               7000393
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'
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
I1 I 0.418629(15) 1.12647(2) 0.141732(10) 0.03266(8) Uani 1 1 d . . .
Co1 Co 0.39002(3) 0.83740(5) 0.093217(19) 0.02287(10) Uani 1 1 d . . .
P1 P 0.23854(5) 0.80641(9) 0.13434(4) 0.02259(15) Uani 1 1 d . . .
O1 O 0.29664(14) 0.9126(2) 0.00373(9) 0.0272(4) Uani 1 1 d . . .
N1 N 0.15032(18) 0.8919(3) 0.06517(12) 0.0269(5) Uani 1 1 d . . .
C1 C 0.1963(2) 0.9304(3) 0.00720(14) 0.0261(6) Uani 1 1 d . . .
C2 C 0.1286(2) 0.9994(4) -0.06313(14) 0.0392(8) Uani 1 1 d . . .
H2A H 0.1581 1.1029 -0.0749 0.059 Uiso 1 1 calc . . .
H2B H 0.0550 1.0141 -0.0544 0.059 Uiso 1 1 calc . . .
H2C H 0.1286 0.9260 -0.1058 0.059 Uiso 1 1 calc . . .
C3 C 0.2155(2) 0.8858(3) 0.22437(14) 0.0235(6) Uani 1 1 d . . .
C4 C 0.2991(2) 0.9062(4) 0.28452(15) 0.0309(7) Uani 1 1 d . . .
H4 H 0.3703 0.8809 0.2787 0.037 Uiso 1 1 calc . . .
C5 C 0.2789(2) 0.9635(4) 0.35330(14) 0.0389(8) Uani 1 1 d . . .
H5 H 0.3365 0.9754 0.3947 0.047 Uiso 1 1 calc . . .
C6 C 0.1770(3) 1.0032(4) 0.36248(14) 0.0405(8) Uani 1 1 d . . .
H6 H 0.1645 1.0444 0.4096 0.049 Uiso 1 1 calc . . .
C7 C 0.0924(2) 0.9829(4) 0.30259(17) 0.0397(8) Uani 1 1 d . . .
H7 H 0.0217 1.0104 0.3086 0.048 Uiso 1 1 calc . . .
C8 C 0.1112(2) 0.9224(4) 0.23398(15) 0.0314(6) Uani 1 1 d . . .
H8 H 0.0530 0.9058 0.1935 0.038 Uiso 1 1 calc . . .
C9 C 0.1929(2) 0.6005(3) 0.13822(15) 0.0261(6) Uani 1 1 d . . .
C10 C 0.1385(2) 0.5305(4) 0.07238(15) 0.0338(7) Uani 1 1 d . . .
H10 H 0.1225 0.5921 0.0272 0.041 Uiso 1 1 calc . . .
C11 C 0.1072(3) 0.3714(4) 0.07192(19) 0.0397(8) Uani 1 1 d . . .
H11 H 0.0701 0.3242 0.0266 0.048 Uiso 1 1 calc . . .
C12 C 0.1301(2) 0.2819(4) 0.1374(2) 0.0409(8) Uani 1 1 d . . .
H12 H 0.1089 0.1729 0.1373 0.049 Uiso 1 1 calc . . .
C13 C 0.1843(3) 0.3515(4) 0.20378(18) 0.0385(8) Uani 1 1 d . . .
H13 H 0.2000 0.2899 0.2489 0.046 Uiso 1 1 calc . . .
C14 C 0.2152(2) 0.5096(4) 0.20410(14) 0.0314(6) Uani 1 1 d . . .
H14 H 0.2519 0.5568 0.2496 0.038 Uiso 1 1 calc . . .
C15 C 0.5374(2) 0.7666(4) 0.15088(16) 0.0345(7) Uani 1 1 d . . .
H15 H 0.5746 0.8165 0.1955 0.041 Uiso 1 1 calc . . .
C16 C 0.4781(2) 0.7058(4) 0.02610(16) 0.0330(7) Uani 1 1 d . . .
H16 H 0.4689 0.7052 -0.0277 0.040 Uiso 1 1 calc . . .
C17 C 0.5475(2) 0.8061(4) 0.07424(17) 0.0337(7) Uani 1 1 d . . .
H17 H 0.5930 0.8857 0.0592 0.040 Uiso 1 1 calc . . .
C18 C 0.4233(2) 0.6044(3) 0.07090(16) 0.0309(7) Uani 1 1 d . . .
H18 H 0.3703 0.5269 0.0523 0.037 Uiso 1 1 calc . . .
C19 C 0.4623(2) 0.6407(3) 0.14832(15) 0.0300(7) Uani 1 1 d . . .
H19 H 0.4417 0.5894 0.1908 0.036 Uiso 1 1 calc . . .
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'
I I -0.4742 1.8119 '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'
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
O1 Co1 C18 105.43(10) . . ?
O1 Co1 C19 145.23(11) . . ?
C18 Co1 C19 40.59(12) . . ?
O1 Co1 C15 152.20(10) . . ?
C18 Co1 C15 67.93(13) . . ?
C19 Co1 C15 40.29(12) . . ?
O1 Co1 C16 90.33(10) . . ?
C18 Co1 C16 40.38(11) . . ?
C19 Co1 C16 67.41(11) . . ?
C15 Co1 C16 66.89(12) . . ?
O1 Co1 C17 111.70(10) . . ?
C18 Co1 C17 67.40(12) . . ?
C19 Co1 C17 67.68(12) . . ?
C15 Co1 C17 40.50(11) . . ?
C16 Co1 C17 38.98(12) . . ?
O1 Co1 P1 82.57(5) . . ?
C18 Co1 P1 100.14(8) . . ?
C19 Co1 P1 95.05(8) . . ?
C15 Co1 P1 124.77(8) . . ?
C16 Co1 P1 136.02(9) . . ?
C17 Co1 P1 162.72(9) . . ?
O1 Co1 I1 90.24(6) . . ?
C18 Co1 I1 159.75(8) . . ?
C19 Co1 I1 124.49(9) . . ?
C15 Co1 I1 92.22(10) . . ?
C16 Co1 I1 129.08(9) . . ?
C17 Co1 I1 95.14(9) . . ?
P1 Co1 I1 94.45(2) . . ?
N1 P1 C3 108.08(12) . . ?
N1 P1 C9 104.81(12) . . ?
C3 P1 C9 102.11(12) . . ?
N1 P1 Co1 102.25(8) . . ?
C3 P1 Co1 122.91(9) . . ?
C9 P1 Co1 115.34(9) . . ?
C1 O1 Co1 117.68(15) . . ?
C1 N1 P1 110.89(19) . . ?
O1 C1 N1 125.8(2) . . ?
O1 C1 C2 115.1(2) . . ?
N1 C1 C2 119.1(2) . . ?
C1 C2 H2A 109.5 . . ?
C1 C2 H2B 109.5 . . ?
H2A C2 H2B 109.5 . . ?
C1 C2 H2C 109.5 . . ?
H2A C2 H2C 109.5 . . ?
H2B C2 H2C 109.5 . . ?
C4 C3 C8 119.3(2) . . ?
C4 C3 P1 121.1(2) . . ?
C8 C3 P1 119.5(2) . . ?
C3 C4 C5 119.9(3) . . ?
C3 C4 H4 120.1 . . ?
C5 C4 H4 120.1 . . ?
C6 C5 C4 121.0(3) . . ?
C6 C5 H5 119.5 . . ?
C4 C5 H5 119.5 . . ?
C5 C6 C7 119.6(2) . . ?
C5 C6 H6 120.2 . . ?
C7 C6 H6 120.2 . . ?
C8 C7 C6 120.0(3) . . ?
C8 C7 H7 120.0 . . ?
C6 C7 H7 120.0 . . ?
C7 C8 C3 120.1(3) . . ?
C7 C8 H8 119.9 . . ?
C3 C8 H8 119.9 . . ?
C10 C9 C14 119.2(3) . . ?
C10 C9 P1 118.7(2) . . ?
C14 C9 P1 122.0(2) . . ?
C9 C10 C11 120.5(3) . . ?
C9 C10 H10 119.7 . . ?
C11 C10 H10 119.7 . . ?
C12 C11 C10 119.8(3) . . ?
C12 C11 H11 120.1 . . ?
C10 C11 H11 120.1 . . ?
C11 C12 C13 119.9(3) . . ?
C11 C12 H12 120.0 . . ?
C13 C12 H12 120.0 . . ?
C14 C13 C12 120.1(3) . . ?
C14 C13 H13 119.9 . . ?
C12 C13 H13 119.9 . . ?
C13 C14 C9 120.3(3) . . ?
C13 C14 H14 119.8 . . ?
C9 C14 H14 119.8 . . ?
C19 C15 C17 108.2(3) . . ?
C19 C15 Co1 69.57(16) . . ?
C17 C15 Co1 71.38(16) . . ?
C19 C15 H15 125.9 . . ?
C17 C15 H15 125.9 . . ?
Co1 C15 H15 124.7 . . ?
C17 C16 C18 109.0(3) . . ?
C17 C16 Co1 70.87(16) . . ?
C18 C16 Co1 68.13(15) . . ?
C17 C16 H16 125.5 . . ?
C18 C16 H16 125.5 . . ?
Co1 C16 H16 127.1 . . ?
C16 C17 C15 107.3(3) . . ?
C16 C17 Co1 70.15(15) . . ?
C15 C17 Co1 68.12(14) . . ?
C16 C17 H17 126.3 . . ?
C15 C17 H17 126.3 . . ?
Co1 C17 H17 126.9 . . ?
C19 C18 C16 107.5(3) . . ?
C19 C18 Co1 69.81(16) . . ?
C16 C18 Co1 71.49(17) . . ?
C19 C18 H18 126.3 . . ?
C16 C18 H18 126.3 . . ?
Co1 C18 H18 124.1 . . ?
C15 C19 C18 107.9(2) . . ?
C15 C19 Co1 70.14(16) . . ?
C18 C19 Co1 69.60(16) . . ?
C15 C19 H19 126.0 . . ?
C18 C19 H19 126.0 . . ?
Co1 C19 H19 125.8 . . ?
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
I1 Co1 2.5716(4) . ?
Co1 O1 1.9238(18) . ?
Co1 C18 2.047(3) . ?
Co1 C19 2.050(3) . ?
Co1 C15 2.057(3) . ?
Co1 C16 2.091(3) . ?
Co1 C17 2.101(3) . ?
Co1 P1 2.1901(7) . ?
P1 N1 1.676(2) . ?
P1 C3 1.814(3) . ?
P1 C9 1.821(3) . ?
O1 C1 1.294(3) . ?
N1 C1 1.317(3) . ?
C1 C2 1.509(4) . ?
C2 H2A 0.9800 . ?
C2 H2B 0.9800 . ?
C2 H2C 0.9800 . ?
C3 C4 1.383(4) . ?
C3 C8 1.398(4) . ?
C4 C5 1.387(4) . ?
C4 H4 0.9500 . ?
C5 C6 1.371(4) . ?
C5 H5 0.9500 . ?
C6 C7 1.388(4) . ?
C6 H6 0.9500 . ?
C7 C8 1.387(4) . ?
C7 H7 0.9500 . ?
C8 H8 0.9500 . ?
C9 C10 1.387(4) . ?
C9 C14 1.390(4) . ?
C10 C11 1.388(4) . ?
C10 H10 0.9500 . ?
C11 C12 1.379(5) . ?
C11 H11 0.9500 . ?
C12 C13 1.391(5) . ?
C12 H12 0.9500 . ?
C13 C14 1.379(4) . ?
C13 H13 0.9500 . ?
C14 H14 0.9500 . ?
C15 C19 1.414(4) . ?
C15 C17 1.439(4) . ?
C15 H15 0.9500 . ?
C16 C17 1.399(4) . ?
C16 C18 1.429(4) . ?
C16 H16 0.9500 . ?
C17 H17 0.9500 . ?
C18 C19 1.421(4) . ?
C18 H18 0.9500 . ?
C19 H19 0.9500 . ?
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
O1 Co1 P1 N1 -7.38(10) . . . . ?
C18 Co1 P1 N1 -111.82(12) . . . . ?
C19 Co1 P1 N1 -152.48(12) . . . . ?
C15 Co1 P1 N1 178.09(14) . . . . ?
C16 Co1 P1 N1 -90.11(15) . . . . ?
C17 Co1 P1 N1 -154.2(3) . . . . ?
I1 Co1 P1 N1 82.28(9) . . . . ?
O1 Co1 P1 C3 -128.62(12) . . . . ?
C18 Co1 P1 C3 126.94(14) . . . . ?
C19 Co1 P1 C3 86.28(14) . . . . ?
C15 Co1 P1 C3 56.85(16) . . . . ?
C16 Co1 P1 C3 148.65(15) . . . . ?
C17 Co1 P1 C3 84.6(3) . . . . ?
I1 Co1 P1 C3 -38.97(11) . . . . ?
O1 Co1 P1 C9 105.71(12) . . . . ?
C18 Co1 P1 C9 1.28(13) . . . . ?
C19 Co1 P1 C9 -39.38(13) . . . . ?
C15 Co1 P1 C9 -68.82(16) . . . . ?
C16 Co1 P1 C9 22.99(16) . . . . ?
C17 Co1 P1 C9 -41.1(3) . . . . ?
I1 Co1 P1 C9 -164.63(10) . . . . ?
C18 Co1 O1 C1 105.9(2) . . . . ?
C19 Co1 O1 C1 95.5(2) . . . . ?
C15 Co1 O1 C1 177.7(3) . . . . ?
C16 Co1 O1 C1 143.8(2) . . . . ?
C17 Co1 O1 C1 177.3(2) . . . . ?
P1 Co1 O1 C1 7.34(19) . . . . ?
I1 Co1 O1 C1 -87.11(19) . . . . ?
C3 P1 N1 C1 138.3(2) . . . . ?
C9 P1 N1 C1 -113.3(2) . . . . ?
Co1 P1 N1 C1 7.4(2) . . . . ?
Co1 O1 C1 N1 -4.7(4) . . . . ?
Co1 O1 C1 C2 176.4(2) . . . . ?
P1 N1 C1 O1 -2.8(4) . . . . ?
P1 N1 C1 C2 176.1(2) . . . . ?
N1 P1 C3 C4 -147.1(2) . . . . ?
C9 P1 C3 C4 102.7(3) . . . . ?
Co1 P1 C3 C4 -28.6(3) . . . . ?
N1 P1 C3 C8 34.8(3) . . . . ?
C9 P1 C3 C8 -75.3(3) . . . . ?
Co1 P1 C3 C8 153.3(2) . . . . ?
C8 C3 C4 C5 -0.4(5) . . . . ?
P1 C3 C4 C5 -178.5(2) . . . . ?
C3 C4 C5 C6 -1.1(5) . . . . ?
C4 C5 C6 C7 1.3(5) . . . . ?
C5 C6 C7 C8 0.1(5) . . . . ?
C6 C7 C8 C3 -1.7(5) . . . . ?
C4 C3 C8 C7 1.8(5) . . . . ?
P1 C3 C8 C7 179.9(2) . . . . ?
N1 P1 C9 C10 29.3(2) . . . . ?
C3 P1 C9 C10 142.0(2) . . . . ?
Co1 P1 C9 C10 -82.3(2) . . . . ?
N1 P1 C9 C14 -153.7(2) . . . . ?
C3 P1 C9 C14 -41.0(3) . . . . ?
Co1 P1 C9 C14 94.7(2) . . . . ?
C14 C9 C10 C11 -0.4(4) . . . . ?
P1 C9 C10 C11 176.7(2) . . . . ?
C9 C10 C11 C12 0.1(5) . . . . ?
C10 C11 C12 C13 0.1(5) . . . . ?
C11 C12 C13 C14 -0.1(5) . . . . ?
C12 C13 C14 C9 -0.2(5) . . . . ?
C10 C9 C14 C13 0.5(4) . . . . ?
P1 C9 C14 C13 -176.5(2) . . . . ?
O1 Co1 C15 C19 -119.1(2) . . . . ?
C18 Co1 C15 C19 -37.91(17) . . . . ?
C16 Co1 C15 C19 -81.80(19) . . . . ?
C17 Co1 C15 C19 -118.5(3) . . . . ?
P1 Co1 C15 C19 49.2(2) . . . . ?
I1 Co1 C15 C19 146.18(16) . . . . ?
O1 Co1 C15 C17 -0.6(4) . . . . ?
C18 Co1 C15 C17 80.6(2) . . . . ?
C19 Co1 C15 C17 118.5(3) . . . . ?
C16 Co1 C15 C17 36.69(18) . . . . ?
P1 Co1 C15 C17 167.70(15) . . . . ?
I1 Co1 C15 C17 -95.33(18) . . . . ?
O1 Co1 C16 C17 125.50(18) . . . . ?
C18 Co1 C16 C17 -120.7(3) . . . . ?
C19 Co1 C16 C17 -81.97(19) . . . . ?
C15 Co1 C16 C17 -38.08(18) . . . . ?
P1 Co1 C16 C17 -154.88(14) . . . . ?
I1 Co1 C16 C17 34.9(2) . . . . ?
O1 Co1 C16 C18 -113.82(17) . . . . ?
C19 Co1 C16 C18 38.71(18) . . . . ?
C15 Co1 C16 C18 82.60(19) . . . . ?
C17 Co1 C16 C18 120.7(3) . . . . ?
P1 Co1 C16 C18 -34.2(2) . . . . ?
I1 Co1 C16 C18 155.60(14) . . . . ?
C18 C16 C17 C15 0.6(3) . . . . ?
Co1 C16 C17 C15 58.14(19) . . . . ?
C18 C16 C17 Co1 -57.6(2) . . . . ?
C19 C15 C17 C16 0.7(3) . . . . ?
Co1 C15 C17 C16 -59.4(2) . . . . ?
C19 C15 C17 Co1 60.11(19) . . . . ?
O1 Co1 C17 C16 -61.19(19) . . . . ?
C18 Co1 C17 C16 37.12(18) . . . . ?
C19 Co1 C17 C16 81.21(19) . . . . ?
C15 Co1 C17 C16 119.1(3) . . . . ?
P1 Co1 C17 C16 83.0(3) . . . . ?
I1 Co1 C17 C16 -153.50(16) . . . . ?
O1 Co1 C17 C15 179.70(18) . . . . ?
C18 Co1 C17 C15 -82.0(2) . . . . ?
C19 Co1 C17 C15 -37.90(19) . . . . ?
C16 Co1 C17 C15 -119.1(3) . . . . ?
P1 Co1 C17 C15 -36.1(4) . . . . ?
I1 Co1 C17 C15 87.39(19) . . . . ?
C17 C16 C18 C19 -1.6(3) . . . . ?
Co1 C16 C18 C19 -60.85(19) . . . . ?
C17 C16 C18 Co1 59.2(2) . . . . ?
O1 Co1 C18 C19 -170.93(16) . . . . ?
C15 Co1 C18 C19 37.64(17) . . . . ?
C16 Co1 C18 C19 117.4(2) . . . . ?
C17 Co1 C18 C19 81.57(18) . . . . ?
P1 Co1 C18 C19 -85.91(16) . . . . ?
I1 Co1 C18 C19 49.5(3) . . . . ?
O1 Co1 C18 C16 71.62(18) . . . . ?
C19 Co1 C18 C16 -117.4(2) . . . . ?
C15 Co1 C18 C16 -79.81(18) . . . . ?
C17 Co1 C18 C16 -35.87(17) . . . . ?
P1 Co1 C18 C16 156.64(16) . . . . ?
I1 Co1 C18 C16 -67.9(3) . . . . ?
C17 C15 C19 C18 -1.7(3) . . . . ?
Co1 C15 C19 C18 59.6(2) . . . . ?
C17 C15 C19 Co1 -61.2(2) . . . . ?
C16 C18 C19 C15 2.0(3) . . . . ?
Co1 C18 C19 C15 -59.9(2) . . . . ?
C16 C18 C19 Co1 61.9(2) . . . . ?
O1 Co1 C19 C15 134.38(19) . . . . ?
C18 Co1 C19 C15 118.9(2) . . . . ?
C16 Co1 C19 C15 80.42(19) . . . . ?
C17 Co1 C19 C15 38.09(18) . . . . ?
P1 Co1 C19 C15 -141.37(16) . . . . ?
I1 Co1 C19 C15 -42.44(19) . . . . ?
O1 Co1 C19 C18 15.5(3) . . . . ?
C15 Co1 C19 C18 -118.9(2) . . . . ?
C16 Co1 C19 C18 -38.52(17) . . . . ?
C17 Co1 C19 C18 -80.84(18) . . . . ?
P1 Co1 C19 C18 99.70(16) . . . . ?
I1 Co1 C19 C18 -161.37(13) . . . . ?
