#------------------------------------------------------------------------------
#$Date: 2016-03-23 01:26:45 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179141 $
#$URL: svn://www.crystallography.net/cod/cif/4/31/02/4310296.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_4310296
loop_
_publ_author_name
'Vadapalli Chandrasekhar'
'Venkatasubbaiah Krishnan'
'Alexander Steiner'
'Jamie F. Bickley'
_publ_section_title
;
 Cyclotriphosphazene Hydrazides as Efficient Multisite Coordination
 Ligands. η3-fac-non-geminal-N3 Coordination of
 spiro-N3P3[O2C12H8][N(Me)NH2]4(L) in L2CoCl3 and L2M(NO3)2 (M = Ni, Zn,
 Cd)
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              166
_journal_page_last               172
_journal_paper_doi               10.1021/ic034561d
_journal_volume                  43
_journal_year                    2004
_chemical_formula_sum            'C34 H64 Cl3 Co N22 O6 P6'
_chemical_formula_weight         1228.17
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           4
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 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                 94.920(17)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   8.1714(12)
_cell_length_b                   21.337(3)
_cell_length_c                   16.404(2)
_cell_measurement_temperature    213(2)
_cell_volume                     2849.6(7)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      213(2)
_diffrn_measured_fraction_theta_full 0.951
_diffrn_measured_fraction_theta_max 0.951
_diffrn_measurement_device_type  'Stoe IPDS'
_diffrn_measurement_method       /w-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  0.0384
_diffrn_reflns_av_sigmaI/netI    0.0387
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -9
_diffrn_reflns_limit_k_max       24
_diffrn_reflns_limit_k_min       -24
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            18118
_diffrn_reflns_theta_full        24.20
_diffrn_reflns_theta_max         24.20
_diffrn_reflns_theta_min         2.28
_exptl_absorpt_coefficient_mu    0.671
_exptl_absorpt_correction_type   'not applied'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.431
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             1276
_exptl_crystal_size_max          0.4
_exptl_crystal_size_mid          0.4
_exptl_crystal_size_min          0.2
_refine_diff_density_max         0.433
_refine_diff_density_min         -0.403
_refine_diff_density_rms         0.066
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.13(5)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.051
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     707
_refine_ls_number_reflns         8566
_refine_ls_number_restraints     25
_refine_ls_restrained_S_all      3.391
_refine_ls_R_factor_all          0.0451
_refine_ls_R_factor_gt           0.0398
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0672P)²+1.0959P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1038
_refine_ls_wR_factor_ref         0.1077
_reflns_number_gt                7595
_reflns_number_total             8566
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic034561dsi20030806_120741_1.cif
_cod_data_source_block           compound_4
_cod_original_cell_volume        2849.7(7)
_cod_database_code               4310296
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -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
C1 C 1.004(2) 0.5685(7) 0.0296(12) 0.046(4) Uani 1 1 d . . .
H1A H 1.0606 0.5731 0.0837 0.069 Uiso 1 1 calc R . .
H1B H 0.9262 0.6025 0.0196 0.069 Uiso 1 1 calc R . .
H1C H 1.0833 0.5695 -0.0111 0.069 Uiso 1 1 calc R . .
C2 C 0.530(2) 0.5713(9) -0.1022(13) 0.057(5) Uani 1 1 d . . .
H2A H 0.4179 0.5558 -0.1071 0.086 Uiso 1 1 calc R . .
H2B H 0.5764 0.5671 -0.1544 0.086 Uiso 1 1 calc R . .
H2C H 0.5302 0.6151 -0.0864 0.086 Uiso 1 1 calc R . .
C3 C 0.951(2) 0.2674(8) -0.1360(11) 0.052(5) Uani 1 1 d . . .
H3A H 1.0462 0.2848 -0.1595 0.078 Uiso 1 1 calc R . .
H3B H 0.8685 0.2561 -0.1796 0.078 Uiso 1 1 calc R . .
H3C H 0.9833 0.2304 -0.1042 0.078 Uiso 1 1 calc R . .
C4 C 0.478(2) 0.3393(9) -0.2221(11) 0.048(4) Uani 1 1 d . . .
H4A H 0.4120 0.3022 -0.2334 0.072 Uiso 1 1 calc R . .
H4B H 0.5441 0.3473 -0.2675 0.072 Uiso 1 1 calc R . .
H4C H 0.4074 0.3750 -0.2148 0.072 Uiso 1 1 calc R . .
C5 C 0.796(2) 0.5011(9) 0.2512(11) 0.055(5) Uani 1 1 d . . .
H5A H 0.7527 0.5356 0.2173 0.082 Uiso 1 1 calc R . .
H5B H 0.8813 0.5165 0.2909 0.082 Uiso 1 1 calc R . .
H5C H 0.7081 0.4828 0.2796 0.082 Uiso 1 1 calc R . .
C6 C 1.267(2) 0.4271(9) 0.3393(11) 0.055(5) Uani 1 1 d . . .
H6A H 1.3473 0.3952 0.3292 0.082 Uiso 1 1 calc R . .
H6B H 1.2031 0.4136 0.3833 0.082 Uiso 1 1 calc R . .
H6C H 1.3231 0.4660 0.3547 0.082 Uiso 1 1 calc R . .
C7 C 0.732(2) 0.2003(7) 0.0921(11) 0.046(4) Uani 1 1 d . . .
H7A H 0.6356 0.2052 0.1220 0.069 Uiso 1 1 calc R . .
H7B H 0.8011 0.1673 0.1171 0.069 Uiso 1 1 calc R . .
H7C H 0.6988 0.1894 0.0357 0.069 Uiso 1 1 calc R . .
C8 C 1.190(3) 0.1850(10) 0.2226(13) 0.064(5) Uani 1 1 d . . .
H8A H 1.1936 0.1437 0.1982 0.096 Uiso 1 1 calc R . .
H8B H 1.1307 0.1830 0.2712 0.096 Uiso 1 1 calc R . .
H8C H 1.3017 0.1993 0.2375 0.096 Uiso 1 1 calc R . .
C9 C 0.713(2) 0.4821(7) -0.3668(10) 0.041(4) Uani 1 1 d . . .
C10 C 0.570(2) 0.4537(9) -0.3967(11) 0.053(5) Uani 1 1 d . . .
H10 H 0.4839 0.4481 -0.3629 0.063 Uiso 1 1 calc R . .
C11 C 0.554(3) 0.4334(11) -0.4770(14) 0.072(7) Uani 1 1 d . . .
H11 H 0.4562 0.4139 -0.4979 0.087 Uiso 1 1 calc R . .
C12 C 0.680(3) 0.4417(11) -0.5267(13) 0.068(6) Uani 1 1 d . . .
H12 H 0.6696 0.4271 -0.5809 0.082 Uiso 1 1 calc R . .
C13 C 0.820(3) 0.4712(9) -0.4968(11) 0.057(5) Uani 1 1 d . . .
H13 H 0.9050 0.4775 -0.5314 0.069 Uiso 1 1 calc R . .
C14 C 0.842(2) 0.4926(8) -0.4156(10) 0.045(4) Uani 1 1 d . . .
C15 C 0.992(2) 0.5279(8) -0.3835(11) 0.049(4) Uani 1 1 d . . .
C16 C 1.063(3) 0.5724(11) -0.4294(15) 0.078(7) Uani 1 1 d . . .
H16 H 1.0148 0.5815 -0.4821 0.093 Uiso 1 1 calc R . .
C17 C 1.203(4) 0.6042(13) -0.4011(18) 0.098(9) Uani 1 1 d . . .
H17 H 1.2492 0.6338 -0.4348 0.117 Uiso 1 1 calc R . .
C18 C 1.276(3) 0.5928(14) -0.3239(18) 0.098(9) Uani 1 1 d . . .
H18 H 1.3697 0.6154 -0.3042 0.118 Uiso 1 1 calc R . .
C19 C 1.210(3) 0.5483(12) -0.2758(15) 0.071(6) Uani 1 1 d . . .
H19 H 1.2596 0.5395 -0.2232 0.085 Uiso 1 1 calc R . .
C20 C 1.070(2) 0.5167(8) -0.3063(11) 0.047(4) Uani 1 1 d . . .
C21 C 1.000(2) 0.2924(7) 0.4888(10) 0.041(4) Uani 1 1 d . . .
C22 C 1.150(2) 0.3172(9) 0.5150(11) 0.053(5) Uani 1 1 d . . .
H22 H 1.2369 0.3188 0.4812 0.063 Uiso 1 1 calc RD . .
C23 C 1.165(3) 0.3407(9) 0.5970(13) 0.059(5) Uani 1 1 d . . .
H23 H 1.2652 0.3586 0.6183 0.071 Uiso 1 1 calc R . .
C24 C 1.036(3) 0.3372(9) 0.6447(13) 0.065(6) Uani 1 1 d . . .
H24 H 1.0483 0.3524 0.6987 0.078 Uiso 1 1 calc R . .
C25 C 0.890(3) 0.3120(9) 0.6148(12) 0.060(5) Uani 1 1 d . . .
H25 H 0.8020 0.3109 0.6484 0.072 Uiso 1 1 calc R . .
C26 C 0.866(2) 0.2879(8) 0.5356(11) 0.045(4) Uani 1 1 d . . .
C27 C 0.710(2) 0.2571(8) 0.5033(12) 0.050(4) Uani 1 1 d . . .
C28 C 0.624(3) 0.2171(11) 0.5530(15) 0.069(6) Uani 1 1 d . . .
H28 H 0.6641 0.2097 0.6076 0.082 Uiso 1 1 calc R . .
C29 C 0.480(3) 0.1886(12) 0.521(2) 0.095(9) Uani 1 1 d . . .
H29 H 0.4260 0.1612 0.5549 0.114 Uiso 1 1 calc R . .
C30 C 0.412(3) 0.1980(12) 0.4427(18) 0.076(6) Uani 1 1 d . . .
H30 H 0.3127 0.1786 0.4230 0.092 Uiso 1 1 calc R . .
C31 C 0.495(2) 0.2373(10) 0.3945(15) 0.066(6) Uani 1 1 d . . .
H31 H 0.4515 0.2455 0.3406 0.079 Uiso 1 1 calc R . .
C32 C 0.642(2) 0.2651(8) 0.4242(11) 0.047(4) Uani 1 1 d . . .
Cl1 Cl 0.4629(5) 0.3382(2) 0.1905(3) 0.0551(12) Uani 1 1 d . . .
Cl2 Cl 0.2734(5) 0.4295(2) 0.9251(3) 0.0512(11) Uani 1 1 d . . .
Cl3 Cl 0.3326(8) 0.1683(2) 0.9086(5) 0.088(2) Uani 1 1 d . . .
Co1 Co 0.8716(2) 0.38339(8) 0.05928(12) 0.0230(4) Uani 1 1 d . . .
N1 N 0.7592(13) 0.4161(5) -0.0441(8) 0.026(3) Uani 1 1 d . . .
N2 N 0.8003(15) 0.3993(5) -0.2061(7) 0.033(3) Uani 1 1 d . . .
N3 N 0.8449(16) 0.5144(5) -0.1412(8) 0.035(3) Uani 1 1 d . . .
N4 N 0.9843(13) 0.3491(5) 0.1628(7) 0.026(3) Uani 1 1 d . . .
N5 N 0.8842(17) 0.2550(6) 0.2613(8) 0.037(3) Uani 1 1 d . . .
N6 N 0.9407(17) 0.3694(6) 0.3243(8) 0.043(3) Uani 1 1 d . . .
N7 N 0.9156(14) 0.5081(5) 0.0245(7) 0.028(3) Uani 1 1 d . . .
N8 N 1.0159(13) 0.4549(5) 0.0498(8) 0.027(3) Uani 1 1 d D . .
N9 N 0.6261(15) 0.5358(6) -0.0411(8) 0.036(3) Uani 1 1 d . . .
N10 N 0.5570(17) 0.5235(7) 0.0348(9) 0.042(3) Uani 1 1 d D . .
N11 N 0.8836(14) 0.3140(5) -0.0831(7) 0.030(3) Uani 1 1 d . . .
N12 N 0.9955(14) 0.3348(5) -0.0142(8) 0.027(3) Uani 1 1 d D . .
N13 N 0.5874(15) 0.3296(6) -0.1469(8) 0.035(3) Uani 1 1 d . . .
N14 N 0.5141(16) 0.3040(7) -0.0787(9) 0.043(3) Uani 1 1 d D . .
N15 N 0.8642(15) 0.4538(5) 0.1999(8) 0.032(3) Uani 1 1 d . . .
N16 N 0.7492(14) 0.4319(6) 0.1347(8) 0.028(3) Uani 1 1 d D . .
N17 N 1.1585(17) 0.4371(6) 0.2656(9) 0.041(3) Uani 1 1 d . . .
N18 N 1.2289(17) 0.4647(7) 0.1977(10) 0.044(3) Uani 1 1 d D . .
N19 N 0.8241(14) 0.2589(5) 0.0945(7) 0.028(3) Uani 1 1 d . . .
N20 N 0.7266(14) 0.3123(5) 0.0675(8) 0.029(3) Uani 1 1 d D . .
N21 N 1.1080(16) 0.2287(6) 0.1637(9) 0.037(3) Uani 1 1 d . . .
N22 N 1.1861(19) 0.2434(8) 0.0936(11) 0.049(4) Uani 1 1 d D . .
H8X H 1.064(16) 0.464(7) 0.097(5) 0.036(10) Uiso 1 1 d D . .
H8Y H 1.091(14) 0.447(7) 0.018(7) 0.036(10) Uiso 1 1 d D . .
H10X H 0.529(16) 0.560(4) 0.048(10) 0.036(10) Uiso 1 1 d D . .
H10Y H 0.472(13) 0.501(5) 0.019(10) 0.036(10) Uiso 1 1 d D . .
H12X H 1.072(13) 0.355(6) -0.034(9) 0.036(10) Uiso 1 1 d D . .
H12Y H 1.031(16) 0.304(5) 0.014(9) 0.036(10) Uiso 1 1 d D . .
H14X H 0.437(14) 0.331(5) -0.084(10) 0.036(10) Uiso 1 1 d D . .
H14Y H 0.475(17) 0.268(4) -0.097(10) 0.036(10) Uiso 1 1 d D . .
H16X H 0.708(16) 0.463(5) 0.109(9) 0.036(10) Uiso 1 1 d D . .
H16Y H 0.677(14) 0.409(6) 0.153(9) 0.036(10) Uiso 1 1 d D . .
H18X H 1.247(16) 0.499(4) 0.219(9) 0.036(10) Uiso 1 1 d D . .
H18Y H 1.308(13) 0.444(6) 0.185(10) 0.036(10) Uiso 1 1 d D . .
H20X H 0.642(13) 0.318(7) 0.096(7) 0.036(10) Uiso 1 1 d D . .
H20Y H 0.693(16) 0.307(8) 0.017(4) 0.036(10) Uiso 1 1 d D . .
H22X H 1.276(13) 0.264(6) 0.111(10) 0.036(10) Uiso 1 1 d D . .
H22Y H 1.19(2) 0.219(7) 0.067(11) 0.036(10) Uiso 1 1 d D . .
O1 O 0.7257(13) 0.5042(5) -0.2854(6) 0.040(3) Uani 1 1 d . . .
O2 O 1.0132(13) 0.4686(5) -0.2574(7) 0.038(2) Uani 1 1 d . . .
O3 O 0.9905(13) 0.2662(5) 0.4093(7) 0.039(2) Uani 1 1 d . . .
O4 O 0.7104(13) 0.3074(6) 0.3715(7) 0.044(3) Uani 1 1 d . . .
P1 P 0.7851(4) 0.49292(16) -0.0561(2) 0.0267(8) Uani 1 1 d . . .
P2 P 0.7562(4) 0.36907(15) -0.1226(2) 0.0275(8) Uani 1 1 d . . .
P3 P 0.8455(5) 0.47039(17) -0.2174(2) 0.0322(9) Uani 1 1 d . . .
P4 P 0.9881(5) 0.39851(15) 0.2412(2) 0.0305(9) Uani 1 1 d . . .
P5 P 0.9519(5) 0.27435(15) 0.1772(2) 0.0286(8) Uani 1 1 d . . .
P6 P 0.8834(5) 0.30054(17) 0.3369(2) 0.0349(9) Uani 1 1 d . . .
O5 O 0.084(3) 0.1581(10) 0.7529(16) 0.125(8) Uani 1 1 d . . .
C33 C 0.164(5) 0.1696(17) 0.682(2) 0.134(14) Uani 1 1 d . . .
O6 O 0.252(5) 0.6092(16) 0.252(2) 0.214(17) Uani 1 1 d . . .
C34 C 0.381(7) 0.615(4) 0.200(4) 0.25(4) Uani 1 1 d . . .
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'
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'
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
C10 C9 C14 121.9(17) . . ?
C10 C9 O1 118.4(16) . . ?
C14 C9 O1 119.7(14) . . ?
C9 C10 C11 119(2) . . ?
C10 C11 C12 121(2) . . ?
C13 C12 C11 119.7(19) . . ?
C12 C13 C14 121.6(19) . . ?
C9 C14 C13 117.1(16) . . ?
C9 C14 C15 120.9(16) . . ?
C13 C14 C15 121.9(17) . . ?
C16 C15 C20 115.8(18) . . ?
C16 C15 C14 122.0(17) . . ?
C20 C15 C14 122.2(15) . . ?
C15 C16 C17 122(2) . . ?
C16 C17 C18 120(2) . . ?
C19 C18 C17 120(2) . . ?
C18 C19 C20 119(2) . . ?
C19 C20 C15 123.1(17) . . ?
C19 C20 O2 117.0(17) . . ?
C15 C20 O2 119.8(15) . . ?
C22 C21 C26 125.2(16) . . ?
C22 C21 O3 114.9(16) . . ?
C26 C21 O3 119.8(15) . . ?
C21 C22 C23 116(2) . . ?
C24 C23 C22 120(2) . . ?
C25 C24 C23 120.8(19) . . ?
C24 C25 C26 122(2) . . ?
C21 C26 C25 115.9(18) . . ?
C21 C26 C27 121.6(15) . . ?
C25 C26 C27 122.5(18) . . ?
C32 C27 C28 115.9(19) . . ?
C32 C27 C26 123.0(16) . . ?
C28 C27 C26 121.1(18) . . ?
C29 C28 C27 120(2) . . ?
C30 C29 C28 124(2) . . ?
C29 C30 C31 117(2) . . ?
C30 C31 C32 121(2) . . ?
C27 C32 C31 123.0(18) . . ?
C27 C32 O4 120.7(16) . . ?
C31 C32 O4 116.0(17) . . ?
N20 Co1 N12 88.8(5) . . ?
N20 Co1 N8 179.4(6) . . ?
N12 Co1 N8 91.0(5) . . ?
N20 Co1 N16 91.3(5) . . ?
N12 Co1 N16 179.1(6) . . ?
N8 Co1 N16 88.9(5) . . ?
N20 Co1 N1 95.4(5) . . ?
N12 Co1 N1 83.4(5) . . ?
N8 Co1 N1 84.0(5) . . ?
N16 Co1 N1 97.5(5) . . ?
N20 Co1 N4 83.9(5) . . ?
N12 Co1 N4 96.1(5) . . ?
N8 Co1 N4 96.7(5) . . ?
N16 Co1 N4 83.1(5) . . ?
N1 Co1 N4 179.1(5) . . ?
P2 N1 P1 120.4(8) . . ?
P2 N1 Co1 115.7(6) . . ?
P1 N1 Co1 113.1(6) . . ?
P3 N2 P2 124.6(8) . . ?
P3 N3 P1 123.5(7) . . ?
P5 N4 P4 120.0(8) . . ?
P5 N4 Co1 114.2(6) . . ?
P4 N4 Co1 113.7(6) . . ?
P6 N5 P5 123.4(8) . . ?
P6 N6 P4 125.7(9) . . ?
N8 N7 C1 114.1(10) . . ?
N8 N7 P1 112.8(8) . . ?
C1 N7 P1 119.6(10) . . ?
N7 N8 Co1 107.9(7) . . ?
N10 N9 C2 118.0(13) . . ?
N10 N9 P1 114.1(10) . . ?
C2 N9 P1 126.0(13) . . ?
C3 N11 N12 115.1(12) . . ?
C3 N11 P2 120.3(10) . . ?
N12 N11 P2 114.6(9) . . ?
N11 N12 Co1 108.5(8) . . ?
N14 N13 C4 116.6(12) . . ?
N14 N13 P2 114.1(9) . . ?
C4 N13 P2 124.6(11) . . ?
N16 N15 C5 113.3(12) . . ?
N16 N15 P4 114.2(8) . . ?
C5 N15 P4 120.5(11) . . ?
N15 N16 Co1 107.8(8) . . ?
N18 N17 C6 116.9(13) . . ?
N18 N17 P4 114.2(10) . . ?
C6 N17 P4 125.1(13) . . ?
N20 N19 C7 113.6(11) . . ?
N20 N19 P5 112.7(8) . . ?
C7 N19 P5 118.4(10) . . ?
N19 N20 Co1 108.4(8) . . ?
N22 N21 C8 117.9(14) . . ?
N22 N21 P5 113.3(10) . . ?
C8 N21 P5 127.6(14) . . ?
C9 O1 P3 120.0(10) . . ?
C20 O2 P3 124.4(11) . . ?
C21 O3 P6 119.3(9) . . ?
C32 O4 P6 125.6(10) . . ?
N3 P1 N9 106.3(7) . . ?
N3 P1 N7 114.8(7) . . ?
N9 P1 N7 103.7(6) . . ?
N3 P1 N1 116.1(6) . . ?
N9 P1 N1 115.1(7) . . ?
N7 P1 N1 100.2(6) . . ?
N2 P2 N1 116.3(6) . . ?
N2 P2 N13 104.4(7) . . ?
N1 P2 N13 117.7(7) . . ?
N2 P2 N11 116.4(7) . . ?
N1 P2 N11 99.2(6) . . ?
N13 P2 N11 102.6(6) . . ?
N3 P3 O2 114.3(7) . . ?
N3 P3 N2 117.8(7) . . ?
O2 P3 N2 104.4(7) . . ?
N3 P3 O1 104.1(6) . . ?
O2 P3 O1 102.9(6) . . ?
N2 P3 O1 112.5(6) . . ?
N6 P4 N17 104.7(8) . . ?
N6 P4 N15 116.5(7) . . ?
N17 P4 N15 102.6(7) . . ?
N6 P4 N4 115.5(6) . . ?
N17 P4 N4 117.8(7) . . ?
N15 P4 N4 99.5(6) . . ?
N5 P5 N21 107.3(7) . . ?
N5 P5 N4 116.8(7) . . ?
N21 P5 N4 115.0(7) . . ?
N5 P5 N19 114.5(7) . . ?
N21 P5 N19 102.3(7) . . ?
N4 P5 N19 99.9(6) . . ?
N6 P6 O4 104.4(7) . . ?
N6 P6 N5 117.1(7) . . ?
O4 P6 N5 114.0(7) . . ?
N6 P6 O3 112.3(7) . . ?
O4 P6 O3 103.1(6) . . ?
N5 P6 O3 105.3(6) . . ?
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
C1 N7 1.476(18) . ?
C2 N9 1.44(2) . ?
C3 N11 1.46(2) . ?
C4 N13 1.47(2) . ?
C5 N15 1.46(2) . ?
C6 N17 1.45(2) . ?
C7 N19 1.457(19) . ?
C8 N21 1.47(2) . ?
C9 C10 1.37(2) . ?
C9 C14 1.39(2) . ?
C9 O1 1.41(2) . ?
C10 C11 1.38(3) . ?
C11 C12 1.38(3) . ?
C12 C13 1.36(3) . ?
C13 C14 1.40(3) . ?
C14 C15 1.50(2) . ?
C15 C16 1.37(3) . ?
C15 C20 1.39(3) . ?
C16 C17 1.37(3) . ?
C17 C18 1.37(4) . ?
C18 C19 1.37(3) . ?
C19 C20 1.39(3) . ?
C20 O2 1.40(2) . ?
C21 C22 1.37(3) . ?
C21 C26 1.39(3) . ?
C21 O3 1.41(2) . ?
C22 C23 1.43(3) . ?
C23 C24 1.37(3) . ?
C24 C25 1.36(3) . ?
C25 C26 1.40(3) . ?
C26 C27 1.49(3) . ?
C27 C32 1.38(3) . ?
C27 C28 1.41(3) . ?
C28 C29 1.39(4) . ?
C29 C30 1.37(4) . ?
C30 C31 1.37(3) . ?
C31 C32 1.39(3) . ?
C32 O4 1.40(2) . ?
Co1 N20 1.937(12) . ?
Co1 N12 1.939(13) . ?
Co1 N8 1.942(12) . ?
Co1 N16 1.953(13) . ?
Co1 N1 1.985(12) . ?
Co1 N4 2.000(12) . ?
N1 P2 1.630(12) . ?
N1 P1 1.667(12) . ?
N2 P3 1.575(12) . ?
N2 P2 1.583(13) . ?
N3 P3 1.564(14) . ?
N3 P1 1.585(14) . ?
N4 P5 1.637(11) . ?
N4 P4 1.661(12) . ?
N5 P6 1.575(13) . ?
N5 P5 1.585(14) . ?
N6 P6 1.561(14) . ?
N6 P4 1.576(15) . ?
N7 N8 1.441(15) . ?
N7 P1 1.657(11) . ?
N9 N10 1.43(2) . ?
N9 P1 1.625(12) . ?
N11 N12 1.460(16) . ?
N11 P2 1.663(11) . ?
N13 N14 1.42(2) . ?
N13 P2 1.636(12) . ?
N15 N16 1.440(16) . ?
N15 P4 1.660(12) . ?
N17 N18 1.42(2) . ?
N17 P4 1.637(13) . ?
N19 N20 1.438(16) . ?
N19 P5 1.672(11) . ?
N21 N22 1.40(2) . ?
N21 P5 1.635(13) . ?
O1 P3 1.592(10) . ?
O2 P3 1.570(11) . ?
O3 P6 1.593(11) . ?
O4 P6 1.575(12) . ?
O5 C33 1.40(4) . ?
O6 C34 1.42(6) . ?
