#------------------------------------------------------------------------------
#$Date: 2019-12-09 10:58:38 +0200 (Mon, 09 Dec 2019) $
#$Revision: 244954 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/55/64/1556468.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_1556468
loop_
_publ_author_name
'Casey, W.H.'
'Olmstead, M.M.'
'Hazlett, C.R.'
'Lamar, C.'
'Forbes, T.Z.'
_publ_section_title
;
 A New Nanometer-Sized Ga(III)-Oxyhydroxide Cation
;
_journal_name_full               Inorganics
_journal_page_first              21
_journal_page_last               26
_journal_paper_doi               10.3390/inorganics3010021
_journal_volume                  3
_journal_year                    2015
_chemical_formula_moiety         'C23  H43  Cl2  Co1  N1  P2  O1'
_chemical_formula_sum            'C23 H43 Cl2 Co N O P2'
_chemical_formula_weight         541.35
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_cell_angle_alpha                93.512(7)
_cell_angle_beta                 91.976(7)
_cell_angle_gamma                99.812(7)
_cell_formula_units_Z            4
_cell_length_a                   12.128(4)
_cell_length_b                   15.363(5)
_cell_length_c                   15.542(5)
_cell_measurement_reflns_used    0
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      0
_cell_measurement_theta_min      0
_cell_measurement_wavelength     0.71075
_cell_volume                     2845.1(16)
_computing_molecular_graphics    'Ortep for Windows (Farrugia, 2012)'
_computing_publication_material  'WinGX publication routines (Farrugia, 2012)'
_computing_structure_refinement  'SHELXL-2014 (Sheldrick, 2014)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.971
_diffrn_measured_fraction_theta_max 0.972
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71075
_diffrn_reflns_av_R_equivalents  0.1963
_diffrn_reflns_Laue_measured_fraction_full 0.971
_diffrn_reflns_Laue_measured_fraction_max 0.972
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            22343
_diffrn_reflns_point_group_measured_fraction_full 0.971
_diffrn_reflns_point_group_measured_fraction_max 0.972
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.999
_diffrn_reflns_theta_min         3.036
_exptl_absorpt_coefficient_mu    0.918
_exptl_absorpt_correction_T_max  0.863
_exptl_absorpt_correction_T_min  0.564
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Jacobson, R. (1998) Private communication'
_exptl_crystal_colour            blue
_exptl_crystal_density_diffrn    1.264
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       chunk
_exptl_crystal_F_000             1148
_exptl_crystal_size_max          0.28
_exptl_crystal_size_mid          0.18
_exptl_crystal_size_min          0.16
_refine_diff_density_max         1.151
_refine_diff_density_min         -0.8
_refine_diff_density_rms         0.094
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.029
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_constraints    0
_refine_ls_number_parameters     558
_refine_ls_number_reflns         10844
_refine_ls_number_restraints     5
_refine_ls_restrained_S_all      1.028
_refine_ls_R_factor_all          0.2223
_refine_ls_R_factor_gt           0.0977
_refine_ls_shift/su_max          0
_refine_ls_shift/su_mean         0
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0746P)²+5.2968P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1905
_refine_ls_wR_factor_ref         0.243
_reflns_number_gt                4849
_reflns_number_total             10844
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            Inorganics-205-3-21-_2_.cif
_cod_data_source_block           shelx-1
_cod_database_code               1556468
_shelx_estimated_absorpt_t_min   0.783
_shelx_estimated_absorpt_t_max   0.867
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_calc_flag
_atom_site_disorder_assembly
_atom_site_disorder_group
Co1 Co 0.62416(9) 0.39720(7) 0.75736(7) 0.0389(3) Uani 1 d . .
Co2 Co 0.14717(10) 0.80353(8) 0.73260(9) 0.0553(4) Uani 1 d . .
Cl1 Cl 0.6851(2) 0.38216(19) 0.89695(14) 0.0681(8) Uani 1 d . .
Cl2 Cl 0.64273(18) 0.54839(14) 0.74606(14) 0.0487(6) Uani 1 d . .
Cl3 Cl 0.2305(8) 0.9296(6) 0.6722(5) 0.062(4) Uani 0.55(5) d A 1
Cl4 Cl 0.1554(2) 0.67413(18) 0.65027(15) 0.0641(7) Uani 1 d . .
P1 P 0.77326(18) 0.34400(14) 0.67606(13) 0.0379(5) Uani 1 d . .
P2 P 0.41350(19) 0.35460(16) 0.77188(14) 0.0436(6) Uani 1 d . .
P4 P 0.29422(18) 0.80928(15) 0.85686(14) 0.0408(6) Uani 1 d . .
P3 P -0.04621(18) 0.83307(15) 0.72484(16) 0.0450(6) Uani 1 d . .
N1 N 0.5459(5) 0.3742(4) 0.6186(4) 0.0388(16) Uani 1 d . .
N2 N 0.0600(5) 0.7119(4) 0.8304(4) 0.0332(15) Uani 1 d . .
C1 C 0.6048(7) 0.3509(5) 0.5516(5) 0.039(2) Uani 1 d . .
C2 C 0.5689(9) 0.3588(6) 0.4676(6) 0.060(3) Uani 1 d . .
H2 H 0.6133 0.3471 0.4221 0.072 Uiso 1 calc . .
C3 C 0.4682(10) 0.3837(7) 0.4521(6) 0.068(3) Uani 1 d . .
H3 H 0.4424 0.3882 0.3957 0.081 Uiso 1 calc . .
C4 C 0.4049(8) 0.4023(6) 0.5197(6) 0.055(3) Uani 1 d . .
H4 H 0.3356 0.4191 0.51 0.066 Uiso 1 calc . .
C5 C 0.4454(7) 0.3955(5) 0.6028(5) 0.043(2) Uani 1 d . .
C6 C 0.7032(7) 0.3085(6) 0.5696(5) 0.046(2) Uani 1 d . .
H6A H 0.7567 0.3221 0.5253 0.056 Uiso 1 calc . .
H6B H 0.6793 0.2447 0.5663 0.056 Uiso 1 calc . .
C7 C 0.3790(7) 0.4143(6) 0.6793(5) 0.049(2) Uani 1 d . .
H7A H 0.2998 0.3974 0.6638 0.059 Uiso 1 calc . .
H7B H 0.3938 0.4774 0.6952 0.059 Uiso 1 calc . .
C8 C 0.8176(8) 0.2408(6) 0.7116(6) 0.051(2) Uani 1 d . .
C9 C 0.7106(8) 0.1825(6) 0.7411(6) 0.061(3) Uani 1 d . .
H9A H 0.6571 0.1681 0.6932 0.073 Uiso 1 calc . .
H9B H 0.7292 0.1291 0.7619 0.073 Uiso 1 calc . .
H9C H 0.679 0.2143 0.7864 0.073 Uiso 1 calc . .
C10 C 0.8672(9) 0.1880(6) 0.6409(6) 0.069(3) Uani 1 d . .
H10A H 0.8142 0.1737 0.5927 0.083 Uiso 1 calc . .
H10B H 0.9348 0.2228 0.6228 0.083 Uiso 1 calc . .
H10C H 0.8838 0.1344 0.6629 0.083 Uiso 1 calc . .
C11 C 0.9018(8) 0.2633(7) 0.7880(6) 0.066(3) Uani 1 d . .
H11A H 0.8708 0.2965 0.8326 0.079 Uiso 1 calc . .
H11B H 0.9184 0.2097 0.8099 0.079 Uiso 1 calc . .
H11C H 0.9694 0.298 0.7698 0.079 Uiso 1 calc . .
C12 C 0.8960(7) 0.4306(6) 0.6541(6) 0.049(2) Uani 1 d . .
C13 C 0.9900(8) 0.3959(7) 0.6078(6) 0.067(3) Uani 1 d . .
H13A H 1.0145 0.3506 0.6398 0.081 Uiso 1 calc . .
H13B H 0.9632 0.3715 0.5511 0.081 Uiso 1 calc . .
H13C H 1.0516 0.4435 0.6033 0.081 Uiso 1 calc . .
C14A C 0.933(3) 0.487(2) 0.739(2) 0.058(12) Uiso 0.5 d . .
H14A H 0.9575 0.4508 0.7814 0.087 Uiso 0.5 calc . .
H14B H 0.994 0.5339 0.7287 0.087 Uiso 0.5 calc . .
H14C H 0.8715 0.5128 0.7602 0.087 Uiso 0.5 calc . .
C14B C 0.946(3) 0.475(2) 0.740(2) 0.053(11) Uiso 0.5 d . .
H14D H 0.968 0.4311 0.7754 0.08 Uiso 0.5 calc . .
H14E H 1.0111 0.5181 0.7301 0.08 Uiso 0.5 calc . .
H14F H 0.892 0.5036 0.7685 0.08 Uiso 0.5 calc . .
C15A C 0.864(2) 0.4995(19) 0.6007(17) 0.053(9) Uiso 0.5 d . .
H15A H 0.8315 0.4727 0.5461 0.08 Uiso 0.5 calc . .
H15B H 0.8095 0.5281 0.6299 0.08 Uiso 0.5 calc . .
H15C H 0.9285 0.5426 0.5915 0.08 Uiso 0.5 calc . .
C15B C 0.837(2) 0.4914(18) 0.5914(17) 0.048(8) Uiso 0.5 d . .
H15D H 0.7644 0.46 0.5712 0.072 Uiso 0.5 calc . .
H15E H 0.8286 0.5455 0.6229 0.072 Uiso 0.5 calc . .
H15F H 0.8825 0.5047 0.5431 0.072 Uiso 0.5 calc . .
C16 C 0.3395(8) 0.2374(6) 0.7487(6) 0.058(3) Uani 1 d . .
C17 C 0.3746(9) 0.2028(6) 0.6632(7) 0.078(3) Uani 1 d . .
H17A H 0.4548 0.2113 0.6632 0.116 Uiso 1 calc . .
H17B H 0.3445 0.1409 0.654 0.116 Uiso 1 calc . .
H17C H 0.3468 0.2343 0.618 0.116 Uiso 1 calc . .
C18 C 0.3837(12) 0.1805(8) 0.8181(8) 0.109(5) Uani 1 d . .
H18A H 0.3633 0.2001 0.8742 0.163 Uiso 1 calc . .
H18B H 0.3512 0.1194 0.8058 0.163 Uiso 1 calc . .
H18C H 0.4638 0.1872 0.8167 0.163 Uiso 1 calc . .
C19 C 0.2134(9) 0.2243(8) 0.7494(9) 0.108(5) Uani 1 d . .
H19A H 0.1914 0.2465 0.8041 0.163 Uiso 1 calc . .
H19B H 0.1854 0.2558 0.7043 0.163 Uiso 1 calc . .
H19C H 0.183 0.1624 0.7403 0.163 Uiso 1 calc . .
C20 C 0.3516(8) 0.4132(7) 0.8639(6) 0.060(3) Uani 1 d . .
C21 C 0.3551(9) 0.3609(8) 0.9441(6) 0.082(3) Uani 1 d . .
H21A H 0.3078 0.3041 0.9338 0.098 Uiso 1 calc . .
H21B H 0.4306 0.3529 0.9568 0.098 Uiso 1 calc . .
H21C H 0.329 0.3928 0.9921 0.098 Uiso 1 calc . .
C22 C 0.2317(8) 0.4303(8) 0.8410(8) 0.095(4) Uani 1 d . .
H22A H 0.1825 0.3747 0.828 0.115 Uiso 1 calc . .
H22B H 0.2049 0.4614 0.8892 0.115 Uiso 1 calc . .
H22C H 0.2335 0.4651 0.7918 0.115 Uiso 1 calc . .
C23 C 0.4269(8) 0.5011(6) 0.8840(6) 0.069(3) Uani 1 d . .
H23A H 0.427 0.5362 0.8349 0.083 Uiso 1 calc . .
H23B H 0.4002 0.5316 0.9326 0.083 Uiso 1 calc . .
H23C H 0.5017 0.4917 0.8973 0.083 Uiso 1 calc . .
C24 C 0.1220(7) 0.6764(5) 0.8879(5) 0.039(2) Uani 1 d . .
C25 C 0.0710(8) 0.6233(6) 0.9488(6) 0.052(2) Uani 1 d . .
H25 H 0.1146 0.5984 0.9877 0.062 Uiso 1 calc . .
C26 C -0.0431(9) 0.6070(6) 0.9524(6) 0.061(3) Uani 1 d . .
H26 H -0.0776 0.5721 0.9939 0.073 Uiso 1 calc . .
C27 C -0.1051(8) 0.6429(6) 0.8941(6) 0.051(2) Uani 1 d . .
H27 H -0.1829 0.6326 0.8952 0.062 Uiso 1 calc . .
C28 C -0.0526(7) 0.6941(5) 0.8339(5) 0.043(2) Uani 1 d . .
C29 C 0.2462(7) 0.6953(5) 0.8842(6) 0.045(2) Uani 1 d . .
H29A H 0.2699 0.6548 0.8412 0.054 Uiso 1 calc . .
H29B H 0.28 0.6861 0.9396 0.054 Uiso 1 calc . .
C30 C -0.1190(7) 0.7295(5) 0.7643(5) 0.046(2) Uani 1 d . .
H30A H -0.1898 0.7394 0.7868 0.055 Uiso 1 calc . .
H30B H -0.1354 0.6852 0.7163 0.055 Uiso 1 calc . .
C31 C 0.2981(7) 0.8781(5) 0.9619(5) 0.047(2) Uani 1 d . .
C32 C 0.1934(8) 0.8435(6) 1.0091(6) 0.064(3) Uani 1 d . .
H32A H 0.1282 0.8448 0.9727 0.076 Uiso 1 calc . .
H32B H 0.195 0.7837 1.0232 0.076 Uiso 1 calc . .
H32C H 0.1911 0.88 1.0612 0.076 Uiso 1 calc . .
C33 C 0.2965(9) 0.9743(6) 0.9398(7) 0.074(3) Uani 1 d . .
H33A H 0.3626 0.996 0.9101 0.089 Uiso 1 calc . .
H33B H 0.2313 0.9762 0.9036 0.089 Uiso 1 calc . .
H33C H 0.2945 1.0106 0.9921 0.089 Uiso 1 calc . .
C34 C 0.3976(8) 0.8741(7) 1.0231(6) 0.070(3) Uani 1 d . .
H34A H 0.4659 0.8954 0.9959 0.084 Uiso 1 calc . .
H34B H 0.3929 0.9103 1.075 0.084 Uiso 1 calc . .
H34C H 0.3968 0.814 1.0371 0.084 Uiso 1 calc . .
C35 C 0.4374(7) 0.8114(6) 0.8185(6) 0.049(2) Uani 1 d . .
C36 C 0.4923(7) 0.9081(6) 0.8082(7) 0.066(3) Uani 1 d . .
H36A H 0.4414 0.9372 0.7767 0.08 Uiso 1 calc . .
H36B H 0.51 0.9384 0.8642 0.08 Uiso 1 calc . .
H36C H 0.5597 0.9091 0.7774 0.08 Uiso 1 calc . .
C37 C 0.4258(8) 0.7617(8) 0.7296(7) 0.084(4) Uani 1 d . .
H37A H 0.374 0.7853 0.6934 0.101 Uiso 1 calc . .
H37B H 0.4975 0.7685 0.7042 0.101 Uiso 1 calc . .
H37C H 0.3985 0.7 0.7354 0.101 Uiso 1 calc . .
C38A C 0.512(3) 0.7619(18) 0.8875(17) 0.053(8) Uiso 0.5 d . .
H38A H 0.4711 0.7504 0.9385 0.08 Uiso 0.5 calc . .
H38B H 0.5258 0.707 0.8606 0.08 Uiso 0.5 calc . .
H38C H 0.5823 0.7999 0.9028 0.08 Uiso 0.5 calc . .
C38B C 0.517(3) 0.770(2) 0.8665(18) 0.063(10) Uiso 0.5 d . .
H38D H 0.5292 0.7974 0.9239 0.094 Uiso 0.5 calc . .
H38E H 0.4876 0.7079 0.8692 0.094 Uiso 0.5 calc . .
H38F H 0.5866 0.7765 0.838 0.094 Uiso 0.5 calc . .
C39 C -0.0800(8) 0.9233(6) 0.7988(7) 0.061(3) Uani 1 d . .
C40 C -0.0606(11) 0.8978(8) 0.8922(7) 0.097(4) Uani 1 d . .
H40A H 0.0148 0.8876 0.9002 0.116 Uiso 1 calc . .
H40B H -0.0728 0.9451 0.9321 0.116 Uiso 1 calc . .
H40C H -0.1119 0.8449 0.9022 0.116 Uiso 1 calc . .
C41 C -0.2014(9) 0.9388(7) 0.7896(7) 0.080(3) Uani 1 d . .
H41A H -0.2516 0.8847 0.7976 0.096 Uiso 1 calc . .
H41B H -0.2134 0.9836 0.8323 0.096 Uiso 1 calc . .
H41C H -0.2152 0.9577 0.7331 0.096 Uiso 1 calc . .
C42 C 0.0028(10) 1.0094(7) 0.7863(10) 0.114(5) Uani 1 d . .
H42A H 0.0782 0.9985 0.7922 0.137 Uiso 1 calc . .
H42B H -0.0101 1.0286 0.7297 0.137 Uiso 1 calc . .
H42C H -0.0083 1.0545 0.829 0.137 Uiso 1 calc . .
C43 C -0.1116(8) 0.8342(6) 0.6145(6) 0.058(3) Uani 1 d . .
C44 C -0.2413(9) 0.8064(7) 0.6098(7) 0.083(3) Uani 1 d . .
H44A H -0.2611 0.7488 0.6312 0.1 Uiso 1 calc . .
H44B H -0.274 0.8485 0.6442 0.1 Uiso 1 calc . .
H44C H -0.2689 0.8048 0.551 0.1 Uiso 1 calc . .
C45 C -0.0802(11) 0.9255(8) 0.5805(8) 0.109(5) Uani 1 d . .
H45A H -0.1088 0.9683 0.6172 0.131 Uiso 1 calc . .
H45B H -0.0002 0.941 0.5799 0.131 Uiso 1 calc . .
H45C H -0.1119 0.9249 0.5229 0.131 Uiso 1 calc . .
C46 C -0.0664(12) 0.7663(9) 0.5564(6) 0.105(5) Uani 1 d . .
H46A H -0.0862 0.7087 0.5779 0.126 Uiso 1 calc . .
H46B H -0.0981 0.7656 0.4988 0.126 Uiso 1 calc . .
H46C H 0.0137 0.7817 0.5558 0.126 Uiso 1 calc . .
C47 C 0.500(3) 0.929(3) 0.5298(15) 0.231(18) Uani 1 d . .
C48 C 0.441(3) 1.0039(15) 0.434(2) 0.253(17) Uani 1 d . .
O1 O 0.4473(19) 0.9207(17) 0.4570(19) 0.273(9) Uani 1 d . .
Cl3' Cl 0.221(2) 0.905(3) 0.634(4) 0.186(16) Uani 0.44(5) d A 2
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 0 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 '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'
N N 0.0061 0.0033 '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'
O O 0.0106 0.006 '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
Cl1 Co1 N1 165.36(18) . .
Cl1 Co1 Cl2 104.76(10) . .
N1 Co1 Cl2 89.49(17) . .
Cl1 Co1 P1 100.69(9) . .
N1 Co1 P1 77.49(18) . .
Cl2 Co1 P1 108.01(9) . .
Cl1 Co1 P2 99.72(9) . .
N1 Co1 P2 73.74(17) . .
Cl2 Co1 P2 101.30(8) . .
P1 Co1 P2 138.32(9) . .
N2 Co2 Cl3 160.7(3) . .
N2 Co2 Cl4 85.30(16) . .
Cl3 Co2 Cl4 113.9(3) . .
N2 Co2 Cl3' 174.3(7) . .
Cl4 Co2 Cl3' 98.4(17) . .
N2 Co2 P3 77.31(17) . .
Cl3 Co2 P3 97.2(3) . .
Cl4 Co2 P3 109.08(10) . .
Cl3' Co2 P3 97.3(5) . .
N2 Co2 P4 75.23(17) . .
Cl3 Co2 P4 96.6(2) . .
Cl4 Co2 P4 105.12(9) . .
Cl3' Co2 P4 107.8(13) . .
P3 Co2 P4 133.60(9) . .
C6 P1 C8 103.1(4) . .
C6 P1 C12 105.0(4) . .
C8 P1 C12 112.1(4) . .
C6 P1 Co1 102.6(3) . .
C8 P1 Co1 116.2(3) . .
C12 P1 Co1 115.7(3) . .
C7 P2 C16 105.8(4) . .
C7 P2 C20 102.6(4) . .
C16 P2 C20 112.2(5) . .
C7 P2 Co1 93.7(3) . .
C16 P2 Co1 121.4(3) . .
C20 P2 Co1 116.4(3) . .
C29 P4 C35 105.4(4) . .
C29 P4 C31 104.9(4) . .
C35 P4 C31 110.7(4) . .
C29 P4 Co2 94.7(3) . .
C35 P4 Co2 112.7(3) . .
C31 P4 Co2 124.9(3) . .
C30 P3 C39 106.0(4) . .
C30 P3 C43 103.4(4) . .
C39 P3 C43 111.7(4) . .
C30 P3 Co2 99.2(3) . .
C39 P3 Co2 117.4(3) . .
C43 P3 Co2 116.5(3) . .
C5 N1 C1 118.9(7) . .
C5 N1 Co1 119.0(5) . .
C1 N1 Co1 121.6(5) . .
C24 N2 C28 118.4(7) . .
C24 N2 Co2 119.7(5) . .
C28 N2 Co2 121.9(5) . .
N1 C1 C2 121.1(8) . .
N1 C1 C6 118.3(7) . .
C2 C1 C6 120.4(8) . .
C3 C2 C1 119.4(9) . .
C3 C2 H2 120.3 . .
C1 C2 H2 120.3 . .
C2 C3 C4 119.7(9) . .
C2 C3 H3 120.2 . .
C4 C3 H3 120.2 . .
C3 C4 C5 118.9(9) . .
C3 C4 H4 120.5 . .
C5 C4 H4 120.5 . .
N1 C5 C4 121.7(8) . .
N1 C5 C7 117.1(7) . .
C4 C5 C7 121.1(8) . .
C1 C6 P1 113.5(5) . .
C1 C6 H6A 108.9 . .
P1 C6 H6A 108.9 . .
C1 C6 H6B 108.9 . .
P1 C6 H6B 108.9 . .
H6A C6 H6B 107.7 . .
C5 C7 P2 112.0(6) . .
C5 C7 H7A 109.2 . .
P2 C7 H7A 109.2 . .
C5 C7 H7B 109.2 . .
P2 C7 H7B 109.2 . .
H7A C7 H7B 107.9 . .
C11 C8 C10 109.3(8) . .
C11 C8 C9 109.0(7) . .
C10 C8 C9 108.3(8) . .
C11 C8 P1 109.8(6) . .
C10 C8 P1 114.2(6) . .
C9 C8 P1 106.0(6) . .
C8 C9 H9A 109.5 . .
C8 C9 H9B 109.5 . .
H9A C9 H9B 109.5 . .
C8 C9 H9C 109.5 . .
H9A C9 H9C 109.5 . .
H9B C9 H9C 109.5 . .
C8 C10 H10A 109.5 . .
C8 C10 H10B 109.5 . .
H10A C10 H10B 109.5 . .
C8 C10 H10C 109.5 . .
H10A C10 H10C 109.5 . .
H10B C10 H10C 109.5 . .
C8 C11 H11A 109.5 . .
C8 C11 H11B 109.5 . .
H11A C11 H11B 109.5 . .
C8 C11 H11C 109.5 . .
H11A C11 H11C 109.5 . .
H11B C11 H11C 109.5 . .
C15A C12 C14B 108.3(18) . .
C15A C12 C13 105.9(12) . .
C14B C12 C13 106.8(15) . .
C15A C12 C14A 99.7(17) . .
C14B C12 C14A 10(2) . .
C13 C12 C14A 114.8(16) . .
C15A C12 C15B 11.8(18) . .
C14B C12 C15B 116.5(18) . .
C13 C12 C15B 109.7(11) . .
C14A C12 C15B 107.1(17) . .
C15A C12 P1 112.3(12) . .
C14B C12 P1 108.2(15) . .
C13 C12 P1 115.0(6) . .
C14A C12 P1 108.2(15) . .
C15B C12 P1 100.9(11) . .
C12 C13 H13A 109.5 . .
C12 C13 H13B 109.5 . .
H13A C13 H13B 109.5 . .
C12 C13 H13C 109.5 . .
H13A C13 H13C 109.5 . .
H13B C13 H13C 109.5 . .
C12 C14A H14A 109.5 . .
C12 C14A H14B 109.5 . .
H14A C14A H14B 109.5 . .
C12 C14A H14C 109.5 . .
H14A C14A H14C 109.5 . .
H14B C14A H14C 109.5 . .
C12 C14B H14D 109.5 . .
C12 C14B H14E 109.5 . .
H14D C14B H14E 109.5 . .
C12 C14B H14F 109.5 . .
H14D C14B H14F 109.5 . .
H14E C14B H14F 109.5 . .
C12 C15A H15A 109.5 . .
C12 C15A H15B 109.5 . .
H15A C15A H15B 109.5 . .
C12 C15A H15C 109.5 . .
H15A C15A H15C 109.5 . .
H15B C15A H15C 109.5 . .
C12 C15B H15D 109.5 . .
C12 C15B H15E 109.5 . .
H15D C15B H15E 109.5 . .
C12 C15B H15F 109.5 . .
H15D C15B H15F 109.5 . .
H15E C15B H15F 109.5 . .
C17 C16 C19 109.8(9) . .
C17 C16 C18 106.2(9) . .
C19 C16 C18 109.1(9) . .
C17 C16 P2 108.7(7) . .
C19 C16 P2 115.3(7) . .
C18 C16 P2 107.3(8) . .
C16 C17 H17A 109.5 . .
C16 C17 H17B 109.5 . .
H17A C17 H17B 109.5 . .
C16 C17 H17C 109.5 . .
H17A C17 H17C 109.5 . .
H17B C17 H17C 109.5 . .
C16 C18 H18A 109.5 . .
C16 C18 H18B 109.5 . .
H18A C18 H18B 109.5 . .
C16 C18 H18C 109.5 . .
H18A C18 H18C 109.5 . .
H18B C18 H18C 109.5 . .
C16 C19 H19A 109.5 . .
C16 C19 H19B 109.5 . .
H19A C19 H19B 109.5 . .
C16 C19 H19C 109.5 . .
H19A C19 H19C 109.5 . .
H19B C19 H19C 109.5 . .
C23 C20 C21 106.9(9) . .
C23 C20 C22 108.5(8) . .
C21 C20 C22 112.0(9) . .
C23 C20 P2 107.1(6) . .
C21 C20 P2 109.2(7) . .
C22 C20 P2 112.8(7) . .
C20 C21 H21A 109.5 . .
C20 C21 H21B 109.5 . .
H21A C21 H21B 109.5 . .
C20 C21 H21C 109.5 . .
H21A C21 H21C 109.5 . .
H21B C21 H21C 109.5 . .
C20 C22 H22A 109.5 . .
C20 C22 H22B 109.5 . .
H22A C22 H22B 109.5 . .
C20 C22 H22C 109.5 . .
H22A C22 H22C 109.5 . .
H22B C22 H22C 109.5 . .
C20 C23 H23A 109.5 . .
C20 C23 H23B 109.5 . .
H23A C23 H23B 109.5 . .
C20 C23 H23C 109.5 . .
H23A C23 H23C 109.5 . .
H23B C23 H23C 109.5 . .
N2 C24 C25 120.5(8) . .
N2 C24 C29 118.7(7) . .
C25 C24 C29 120.8(8) . .
C26 C25 C24 120.4(9) . .
C26 C25 H25 119.8 . .
C24 C25 H25 119.8 . .
C27 C26 C25 118.8(9) . .
C27 C26 H26 120.6 . .
C25 C26 H26 120.6 . .
C26 C27 C28 119.5(9) . .
C26 C27 H27 120.2 . .
C28 C27 H27 120.2 . .
N2 C28 C27 122.4(8) . .
N2 C28 C30 116.7(7) . .
C27 C28 C30 120.9(8) . .
C24 C29 P4 110.9(5) . .
C24 C29 H29A 109.5 . .
P4 C29 H29A 109.5 . .
C24 C29 H29B 109.5 . .
P4 C29 H29B 109.5 . .
H29A C29 H29B 108.1 . .
C28 C30 P3 113.3(6) . .
C28 C30 H30A 108.9 . .
P3 C30 H30A 108.9 . .
C28 C30 H30B 108.9 . .
P3 C30 H30B 108.9 . .
H30A C30 H30B 107.7 . .
C32 C31 C34 106.6(7) . .
C32 C31 C33 109.6(8) . .
C34 C31 C33 110.4(8) . .
C32 C31 P4 108.0(6) . .
C34 C31 P4 114.8(6) . .
C33 C31 P4 107.4(6) . .
C31 C32 H32A 109.5 . .
C31 C32 H32B 109.5 . .
H32A C32 H32B 109.5 . .
C31 C32 H32C 109.5 . .
H32A C32 H32C 109.5 . .
H32B C32 H32C 109.5 . .
C31 C33 H33A 109.5 . .
C31 C33 H33B 109.5 . .
H33A C33 H33B 109.5 . .
C31 C33 H33C 109.5 . .
H33A C33 H33C 109.5 . .
H33B C33 H33C 109.5 . .
C31 C34 H34A 109.5 . .
C31 C34 H34B 109.5 . .
H34A C34 H34B 109.5 . .
C31 C34 H34C 109.5 . .
H34A C34 H34C 109.5 . .
H34B C34 H34C 109.5 . .
C38B C35 C37 104.0(13) . .
C38B C35 C36 107.8(14) . .
C37 C35 C36 108.2(8) . .
C38B C35 C38A 10(2) . .
C37 C35 C38A 110.5(12) . .
C36 C35 C38A 111.9(12) . .
C38B C35 P4 120.0(14) . .
C37 C35 P4 107.2(6) . .
C36 C35 P4 109.1(6) . .
C38A C35 P4 109.9(12) . .
C35 C36 H36A 109.5 . .
C35 C36 H36B 109.5 . .
H36A C36 H36B 109.5 . .
C35 C36 H36C 109.5 . .
H36A C36 H36C 109.5 . .
H36B C36 H36C 109.5 . .
C35 C37 H37A 109.5 . .
C35 C37 H37B 109.5 . .
H37A C37 H37B 109.5 . .
C35 C37 H37C 109.5 . .
H37A C37 H37C 109.5 . .
H37B C37 H37C 109.5 . .
C35 C38A H38A 109.5 . .
C35 C38A H38B 109.5 . .
H38A C38A H38B 109.5 . .
C35 C38A H38C 109.5 . .
H38A C38A H38C 109.5 . .
H38B C38A H38C 109.5 . .
C35 C38B H38D 109.5 . .
C35 C38B H38E 109.5 . .
H38D C38B H38E 109.5 . .
C35 C38B H38F 109.5 . .
H38D C38B H38F 109.5 . .
H38E C38B H38F 109.5 . .
C41 C39 C42 110.6(8) . .
C41 C39 C40 107.3(9) . .
C42 C39 C40 107.6(9) . .
C41 C39 P3 114.6(7) . .
C42 C39 P3 109.0(8) . .
C40 C39 P3 107.5(6) . .
C39 C40 H40A 109.5 . .
C39 C40 H40B 109.5 . .
H40A C40 H40B 109.5 . .
C39 C40 H40C 109.5 . .
H40A C40 H40C 109.5 . .
H40B C40 H40C 109.5 . .
C39 C41 H41A 109.5 . .
C39 C41 H41B 109.5 . .
H41A C41 H41B 109.5 . .
C39 C41 H41C 109.5 . .
H41A C41 H41C 109.5 . .
H41B C41 H41C 109.5 . .
C39 C42 H42A 109.5 . .
C39 C42 H42B 109.5 . .
H42A C42 H42B 109.5 . .
C39 C42 H42C 109.5 . .
H42A C42 H42C 109.5 . .
H42B C42 H42C 109.5 . .
C45 C43 C46 109.5(9) . .
C45 C43 C44 109.5(9) . .
C46 C43 C44 106.4(9) . .
C45 C43 P3 110.0(8) . .
C46 C43 P3 107.4(7) . .
C44 C43 P3 113.8(7) . .
C43 C44 H44A 109.5 . .
C43 C44 H44B 109.5 . .
H44A C44 H44B 109.5 . .
C43 C44 H44C 109.5 . .
H44A C44 H44C 109.5 . .
H44B C44 H44C 109.5 . .
C43 C45 H45A 109.5 . .
C43 C45 H45B 109.5 . .
H45A C45 H45B 109.5 . .
C43 C45 H45C 109.5 . .
H45A C45 H45C 109.5 . .
H45B C45 H45C 109.5 . .
C43 C46 H46A 109.5 . .
C43 C46 H46B 109.5 . .
H46A C46 H46B 109.5 . .
C43 C46 H46C 109.5 . .
H46A C46 H46C 109.5 . .
H46B C46 H46C 109.5 . .
C48 C47 O1 129(4) 2_676 .
C47 C48 O1 122(3) 2_676 .
C47 O1 C48 107(3) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Co1 Cl1 2.306(2) .
Co1 N1 2.308(6) .
Co1 Cl2 2.313(2) .
Co1 P1 2.464(2) .
Co1 P2 2.548(3) .
Co2 N2 2.297(6) .
Co2 Cl3 2.297(8) .
Co2 Cl4 2.316(3) .
Co2 Cl3' 2.338(16) .
Co2 P3 2.464(3) .
Co2 P4 2.570(3) .
P1 C6 1.842(8) .
P1 C8 1.867(8) .
P1 C12 1.876(9) .
P2 C7 1.826(8) .
P2 C16 1.878(10) .
P2 C20 1.888(9) .
P4 C29 1.829(8) .
P4 C35 1.852(9) .
P4 C31 1.885(9) .
P3 C30 1.835(8) .
P3 C39 1.855(9) .
P3 C43 1.867(10) .
N1 C5 1.333(10) .
N1 C1 1.348(9) .
N2 C24 1.347(10) .
N2 C28 1.349(9) .
C1 C2 1.380(11) .
C1 C6 1.480(11) .
C2 C3 1.360(13) .
C2 H2 0.93 .
C3 C4 1.367(13) .
C3 H3 0.93 .
C4 C5 1.382(11) .
C4 H4 0.93 .
C5 C7 1.500(12) .
C6 H6A 0.97 .
C6 H6B 0.97 .
C7 H7A 0.97 .
C7 H7B 0.97 .
C8 C11 1.524(12) .
C8 C10 1.526(11) .
C8 C9 1.546(12) .
C9 H9A 0.96 .
C9 H9B 0.96 .
C9 H9C 0.96 .
C10 H10A 0.96 .
C10 H10B 0.96 .
C10 H10C 0.96 .
C11 H11A 0.96 .
C11 H11B 0.96 .
C11 H11C 0.96 .
C12 C15A 1.48(3) .
C12 C14B 1.52(4) .
C12 C13 1.523(11) .
C12 C14A 1.55(4) .
C12 C15B 1.62(3) .
C13 H13A 0.96 .
C13 H13B 0.96 .
C13 H13C 0.96 .
C14A H14A 0.96 .
C14A H14B 0.96 .
C14A H14C 0.96 .
C14B H14D 0.96 .
C14B H14E 0.96 .
C14B H14F 0.96 .
C15A H15A 0.96 .
C15A H15B 0.96 .
C15A H15C 0.96 .
C15B H15D 0.96 .
C15B H15E 0.96 .
C15B H15F 0.96 .
C16 C17 1.503(13) .
C16 C19 1.509(13) .
C16 C18 1.565(14) .
C17 H17A 0.96 .
C17 H17B 0.96 .
C17 H17C 0.96 .
C18 H18A 0.96 .
C18 H18B 0.96 .
C18 H18C 0.96 .
C19 H19A 0.96 .
C19 H19B 0.96 .
C19 H19C 0.96 .
C20 C23 1.505(13) .
C20 C21 1.527(13) .
C20 C22 1.554(13) .
C21 H21A 0.96 .
C21 H21B 0.96 .
C21 H21C 0.96 .
C22 H22A 0.96 .
C22 H22B 0.96 .
C22 H22C 0.96 .
C23 H23A 0.96 .
C23 H23B 0.96 .
C23 H23C 0.96 .
C24 C25 1.381(11) .
C24 C29 1.489(10) .
C25 C26 1.368(12) .
C25 H25 0.93 .
C26 C27 1.359(12) .
C26 H26 0.93 .
C27 C28 1.365(11) .
C27 H27 0.93 .
C28 C30 1.508(11) .
C29 H29A 0.97 .
C29 H29B 0.97 .
C30 H30A 0.97 .
C30 H30B 0.97 .
C31 C32 1.521(12) .
C31 C34 1.523(12) .
C31 C33 1.541(12) .
C32 H32A 0.96 .
C32 H32B 0.96 .
C32 H32C 0.96 .
C33 H33A 0.96 .
C33 H33B 0.96 .
C33 H33C 0.96 .
C34 H34A 0.96 .
C34 H34B 0.96 .
C34 H34C 0.96 .
C35 C38B 1.45(3) .
C35 C37 1.527(12) .
C35 C36 1.542(12) .
C35 C38A 1.68(3) .
C36 H36A 0.96 .
C36 H36B 0.96 .
C36 H36C 0.96 .
C37 H37A 0.96 .
C37 H37B 0.96 .
C37 H37C 0.96 .
C38A H38A 0.96 .
C38A H38B 0.96 .
C38A H38C 0.96 .
C38B H38D 0.96 .
C38B H38E 0.96 .
C38B H38F 0.96 .
C39 C41 1.535(12) .
C39 C42 1.544(14) .
C39 C40 1.547(14) .
C40 H40A 0.96 .
C40 H40B 0.96 .
C40 H40C 0.96 .
C41 H41A 0.96 .
C41 H41B 0.96 .
C41 H41C 0.96 .
C42 H42A 0.96 .
C42 H42B 0.96 .
C42 H42C 0.96 .
C43 C45 1.522(14) .
C43 C46 1.523(13) .
C43 C44 1.556(13) .
C44 H44A 0.96 .
C44 H44B 0.96 .
C44 H44C 0.96 .
C45 H45A 0.96 .
C45 H45B 0.96 .
C45 H45C 0.96 .
C46 H46A 0.96 .
C46 H46B 0.96 .
C46 H46C 0.96 .
C47 C48 1.24(3) 2_676
C47 O1 1.27(3) .
C48 C47 1.24(3) 2_676
C48 O1 1.36(3) .
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
C6 H6A Cl4 0.97 2.96 3.880(8) 157.8 2_666
C11 H11A Cl1 0.96 2.97 3.830(10) 150.2 .
C23 H23A Cl2 0.96 2.98 3.450(10) 111.3 .
C25 H25 Cl1 0.93 2.93 3.757(10) 148.8 2_667
C29 H29B Cl1 0.97 2.85 3.784(9) 161.5 2_667
C37 H37A Cl4 0.96 2.93 3.479(11) 117.3 .
C6 H6A Cl4 0.97 2.96 3.880(8) 157.8 2_666
C11 H11A Cl1 0.96 2.97 3.830(10) 150.2 .
C14A H14F Cl2 0.75 3.23 3.80(4) 135.9 .
C14B H14F Cl2 0.96 3.23 4.03(4) 143.1 .
C15A H15B Cl2 0.96 2.8 3.71(3) 157.4 .
C15B H15B Cl2 0.91 2.8 3.59(3) 147 .
C15A H15B Cl2 0.96 2.8 3.71(3) 157.4 .
C15B H15B Cl2 0.91 2.8 3.59(3) 147 .
C23 H23A Cl2 0.96 2.98 3.450(10) 111.3 .
C25 H25 Cl1 0.93 2.93 3.757(10) 148.8 2_667
C29 H29B Cl1 0.97 2.85 3.784(9) 161.5 2_667
C36 H36A Cl3 0.96 2.96 3.826(13) 150.3 .
C37 H37A Cl4 0.96 2.93 3.479(11) 117.3 .
C37 H37A Cl3' 0.96 2.98 3.90(2) 159.7 .
C42 H42A Cl3 0.96 2.94 3.673(18) 133.6 .
C45 H45B Cl3' 0.96 2.94 3.79(3) 148.6 .
C46 H46C Cl4 0.96 2.99 3.556(11) 119.1 .
C6 H6A Cl4 0.97 2.96 3.880(8) 157.8 2_666
C11 H11A Cl1 0.96 2.97 3.830(10) 150.2 .
C14A H14F Cl2 0.75 3.23 3.80(4) 135.9 .
C14B H14F Cl2 0.96 3.23 4.03(4) 143.1 .
C15A H15B Cl2 0.96 2.8 3.71(3) 157.4 .
C15B H15B Cl2 0.91 2.8 3.59(3) 147 .
C15A H15B Cl2 0.96 2.8 3.71(3) 157.4 .
C15B H15B Cl2 0.91 2.8 3.59(3) 147 .
C17 H17A N1 0.96 2.7 3.192(12) 112.5 .
C23 H23A Cl2 0.96 2.98 3.450(10) 111.3 .
C25 H25 Cl1 0.93 2.93 3.757(10) 148.8 2_667
C29 H29B Cl1 0.97 2.85 3.784(9) 161.5 2_667
C36 H36A Cl3 0.96 2.96 3.826(13) 150.3 .
C37 H37A Cl4 0.96 2.93 3.479(11) 117.3 .
C37 H37A Cl3' 0.96 2.98 3.90(2) 159.7 .
C42 H42A Cl3 0.96 2.94 3.673(18) 133.6 .
C45 H45B Cl3' 0.96 2.94 3.79(3) 148.6 .
C46 H46C Cl4 0.96 2.99 3.556(11) 119.1 .
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
C5 N1 C1 C2 7.6(12) . . . .
Co1 N1 C1 C2 -163.5(6) . . . .
C5 N1 C1 C6 -166.5(7) . . . .
Co1 N1 C1 C6 22.3(10) . . . .
N1 C1 C2 C3 -5.2(14) . . . .
C6 C1 C2 C3 168.8(8) . . . .
C1 C2 C3 C4 1.2(15) . . . .
C2 C3 C4 C5 0.3(15) . . . .
C1 N1 C5 C4 -6.1(12) . . . .
Co1 N1 C5 C4 165.3(6) . . . .
C1 N1 C5 C7 175.5(7) . . . .
Co1 N1 C5 C7 -13.1(9) . . . .
C3 C4 C5 N1 2.2(13) . . . .
C3 C4 C5 C7 -179.5(9) . . . .
N1 C1 C6 P1 -30.1(10) . . . .
C2 C1 C6 P1 155.7(7) . . . .
C8 P1 C6 C1 143.5(6) . . . .
C12 P1 C6 C1 -99.0(6) . . . .
Co1 P1 C6 C1 22.4(6) . . . .
N1 C5 C7 P2 -28.1(10) . . . .
C4 C5 C7 P2 153.5(7) . . . .
C16 P2 C7 C5 -77.3(7) . . . .
C20 P2 C7 C5 164.9(6) . . . .
Co1 P2 C7 C5 46.8(6) . . . .
C6 P1 C8 C11 166.0(6) . . . .
C12 P1 C8 C11 53.5(7) . . . .
Co1 P1 C8 C11 -82.7(7) . . . .
C6 P1 C8 C10 42.8(8) . . . .
C12 P1 C8 C10 -69.7(8) . . . .
Co1 P1 C8 C10 154.2(6) . . . .
C6 P1 C8 C9 -76.4(6) . . . .
C12 P1 C8 C9 171.1(6) . . . .
Co1 P1 C8 C9 34.9(7) . . . .
C6 P1 C12 C15A 50.6(13) . . . .
C8 P1 C12 C15A 161.8(12) . . . .
Co1 P1 C12 C15A -61.8(13) . . . .
C6 P1 C12 C14B 170.1(15) . . . .
C8 P1 C12 C14B -78.6(15) . . . .
Co1 P1 C12 C14B 57.8(15) . . . .
C6 P1 C12 C13 -70.6(7) . . . .
C8 P1 C12 C13 40.6(8) . . . .
Co1 P1 C12 C13 177.0(6) . . . .
C6 P1 C12 C14A 159.6(15) . . . .
C8 P1 C12 C14A -89.2(15) . . . .
Co1 P1 C12 C14A 47.2(15) . . . .
C6 P1 C12 C15B 47.3(11) . . . .
C8 P1 C12 C15B 158.6(10) . . . .
Co1 P1 C12 C15B -65.0(11) . . . .
C7 P2 C16 C17 55.6(8) . . . .
C20 P2 C16 C17 166.8(7) . . . .
Co1 P2 C16 C17 -49.0(8) . . . .
C7 P2 C16 C19 -68.2(9) . . . .
C20 P2 C16 C19 43.0(10) . . . .
Co1 P2 C16 C19 -172.8(7) . . . .
C7 P2 C16 C18 170.0(7) . . . .
C20 P2 C16 C18 -78.8(8) . . . .
Co1 P2 C16 C18 65.5(8) . . . .
C7 P2 C20 C23 -74.5(7) . . . .
C16 P2 C20 C23 172.4(6) . . . .
Co1 P2 C20 C23 26.2(7) . . . .
C7 P2 C20 C21 170.1(7) . . . .
C16 P2 C20 C21 57.0(8) . . . .
Co1 P2 C20 C21 -89.2(8) . . . .
C7 P2 C20 C22 44.9(8) . . . .
C16 P2 C20 C22 -68.3(8) . . . .
Co1 P2 C20 C22 145.5(7) . . . .
C28 N2 C24 C25 -0.2(11) . . . .
Co2 N2 C24 C25 178.1(6) . . . .
C28 N2 C24 C29 179.7(7) . . . .
Co2 N2 C24 C29 -2.1(9) . . . .
N2 C24 C25 C26 -0.8(13) . . . .
C29 C24 C25 C26 179.3(8) . . . .
C24 C25 C26 C27 1.0(14) . . . .
C25 C26 C27 C28 -0.1(14) . . . .
C24 N2 C28 C27 1.1(11) . . . .
Co2 N2 C28 C27 -177.1(6) . . . .
C24 N2 C28 C30 -175.6(7) . . . .
Co2 N2 C28 C30 6.2(9) . . . .
C26 C27 C28 N2 -0.9(13) . . . .
C26 C27 C28 C30 175.6(8) . . . .
N2 C24 C29 P4 37.4(9) . . . .
C25 C24 C29 P4 -142.8(7) . . . .
C35 P4 C29 C24 -161.2(6) . . . .
C31 P4 C29 C24 81.9(6) . . . .
Co2 P4 C29 C24 -46.1(6) . . . .
N2 C28 C30 P3 -30.7(9) . . . .
C27 C28 C30 P3 152.6(7) . . . .
C39 P3 C30 C28 -86.2(7) . . . .
C43 P3 C30 C28 156.2(6) . . . .
Co2 P3 C30 C28 36.0(6) . . . .
C29 P4 C31 C32 -42.1(7) . . . .
C35 P4 C31 C32 -155.4(6) . . . .
Co2 P4 C31 C32 64.7(7) . . . .
C29 P4 C31 C34 76.5(7) . . . .
C35 P4 C31 C34 -36.7(8) . . . .
Co2 P4 C31 C34 -176.7(5) . . . .
C29 P4 C31 C33 -160.3(6) . . . .
C35 P4 C31 C33 86.5(7) . . . .
Co2 P4 C31 C33 -53.5(7) . . . .
C29 P4 C35 C38B -45.8(15) . . . .
C31 P4 C35 C38B 67.2(15) . . . .
Co2 P4 C35 C38B -147.7(14) . . . .
C29 P4 C35 C37 72.4(7) . . . .
C31 P4 C35 C37 -174.7(7) . . . .
Co2 P4 C35 C37 -29.6(7) . . . .
C29 P4 C35 C36 -170.7(6) . . . .
C31 P4 C35 C36 -57.8(7) . . . .
Co2 P4 C35 C36 87.3(6) . . . .
C29 P4 C35 C38A -47.7(11) . . . .
C31 P4 C35 C38A 65.2(12) . . . .
Co2 P4 C35 C38A -149.7(11) . . . .
C30 P3 C39 C41 -71.1(8) . . . .
C43 P3 C39 C41 40.9(9) . . . .
Co2 P3 C39 C41 179.2(6) . . . .
C30 P3 C39 C42 164.3(7) . . . .
C43 P3 C39 C42 -83.7(8) . . . .
Co2 P3 C39 C42 54.7(8) . . . .
C30 P3 C39 C40 48.0(8) . . . .
C43 P3 C39 C40 160.0(7) . . . .
Co2 P3 C39 C40 -61.7(8) . . . .
C30 P3 C43 C45 166.9(7) . . . .
C39 P3 C43 C45 53.3(9) . . . .
Co2 P3 C43 C45 -85.5(8) . . . .
C30 P3 C43 C46 -73.9(8) . . . .
C39 P3 C43 C46 172.5(8) . . . .
Co2 P3 C43 C46 33.7(9) . . . .
C30 P3 C43 C44 43.6(8) . . . .
C39 P3 C43 C44 -70.0(8) . . . .
Co2 P3 C43 C44 151.2(6) . . . .
C48 C47 O1 C48 -17(6) 2_676 . . .
C47 C48 O1 C47 15(6) 2_676 . . .
