# Electronic Supplementary Material (ESI) for CrystEngComm.
# This journal is © The Royal Society of Chemistry 2015

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_w
_database_code_depnum_ccdc_archive 'CCDC 960996'
_audit_update_record             
;
2015-08-04 deposited with the CCDC.
2015-08-07 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C51 H43 Co7 O43.50'
_chemical_formula_weight         1764.36

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'
O O 0.0106 0.0060 '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'

_symmetry_cell_setting           Trigonal
_symmetry_space_group_name_H-M   P31c

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'y, x, z+1/2'
'x-y, -y, z+1/2'
'-x, -x+y, z+1/2'

_cell_length_a                   16.2712(4)
_cell_length_b                   16.2712(4)
_cell_length_c                   17.2772(8)
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_volume                     3961.3(2)
_cell_formula_units_Z            2
_cell_measurement_temperature    296(2)
_cell_measurement_reflns_used    ?
_cell_measurement_theta_min      ?
_cell_measurement_theta_max      ?

_exptl_crystal_description       prism
_exptl_crystal_colour            red
_exptl_crystal_size_max          0.19
_exptl_crystal_size_mid          0.18
_exptl_crystal_size_min          0.16
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.479
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1772
_exptl_absorpt_coefficient_mu    1.520
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.7611
_exptl_absorpt_correction_T_max  0.7931
_exptl_absorpt_process_details   ?

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      296(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_type  'Rigaku Mercury375R'
_diffrn_measurement_method       ?
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            33657
_diffrn_reflns_av_R_equivalents  0.0413
_diffrn_reflns_av_sigmaI/netI    0.0224
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_h_max       19
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_theta_min         1.86
_diffrn_reflns_theta_max         25.05
_reflns_number_total             4681
_reflns_number_gt                4633
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
; 
 Refinement of F² against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F² 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
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.1194P)²+8.3022P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    mixed
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.02(2)
_refine_ls_number_reflns         4681
_refine_ls_number_parameters     307
_refine_ls_number_restraints     1
_refine_ls_R_factor_all          0.0538
_refine_ls_R_factor_gt           0.0534
_refine_ls_wR_factor_ref         0.1572
_refine_ls_wR_factor_gt          0.1566
_refine_ls_goodness_of_fit_ref   1.049
_refine_ls_restrained_S_all      1.048
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_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_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
Co1 Co 0.94408(5) 0.59801(5) 0.79344(4) 0.0185(2) Uani 1 1 d . . .
Co2 Co 0.96506(5) 0.72431(5) 0.95064(4) 0.0196(2) Uani 1 1 d . . .
Co3 Co 0.6667 0.3333 0.67580(8) 0.0259(3) Uani 1 3 d S . .
O1 O 0.8289(3) 0.6123(3) 0.7768(3) 0.0272(9) Uani 1 1 d . . .
O2 O 0.8763(3) 0.7269(3) 0.8637(3) 0.0329(10) Uani 1 1 d . . .
O3 O 0.7204(4) 0.9187(3) 0.8831(3) 0.0347(11) Uani 1 1 d . . .
O4 O 0.6723(4) 0.9463(3) 0.7703(3) 0.0352(11) Uani 1 1 d . . .
O5 O 0.7450(4) 0.8024(4) 0.5484(4) 0.0479(14) Uani 1 1 d . . .
O6 O 0.6393(3) 0.8475(3) 0.5145(3) 0.0318(10) Uani 1 1 d . . .
O7 O 0.4019(4) 0.5392(3) 0.3605(3) 0.0368(12) Uani 1 1 d . . .
O8 O 0.3690(3) 0.4054(3) 0.4132(2) 0.0245(9) Uani 1 1 d . . .
O9 O 0.4636(3) 0.4016(3) 0.6910(3) 0.0321(10) Uani 1 1 d . . .
O10 O 0.4601(4) 0.5153(4) 0.7557(3) 0.0423(13) Uani 1 1 d . . .
O11 O 0.9746(3) 0.8534(3) 0.9891(3) 0.0337(10) Uani 1 1 d . . .
O12 O 1.0591(4) 0.7401(4) 1.0421(4) 0.0472(14) Uani 1 1 d . . .
O13 O 0.5595(3) 0.2341(3) 0.7466(3) 0.0340(11) Uani 1 1 d . . .
O14 O 0.5669(5) 0.3435(5) 0.6065(4) 0.0529(15) Uani 1 1 d . . .
O15 O 0.0000 0.0000 0.8888(7) 0.059(3) Uani 1 3 d S . .
O16 O 0.0000 0.0000 0.7218(13) 0.109(12) Uani 0.50 3 d SP . .
C1 C 0.7535(4) 0.7052(4) 0.7783(3) 0.0216(11) Uani 1 1 d . . .
C2 C 0.7533(4) 0.7823(4) 0.8114(4) 0.0259(13) Uani 1 1 d . . .
H2 H 0.7917 0.8129 0.8538 0.031 Uiso 1 1 calc R . .
C3 C 0.6939(4) 0.8141(4) 0.7796(4) 0.0257(12) Uani 1 1 d . . .
C4 C 0.6372(4) 0.7687(4) 0.7167(4) 0.0240(12) Uani 1 1 d . . .
H4 H 0.6002 0.7914 0.6948 0.029 Uiso 1 1 calc R . .
C5 C 0.6354(4) 0.6880(4) 0.6858(3) 0.0194(11) Uani 1 1 d . . .
C6 C 0.6935(4) 0.6579(4) 0.7170(3) 0.0201(11) Uani 1 1 d . . .
H6 H 0.6925 0.6046 0.6964 0.024 Uiso 1 1 calc R . .
C7 C 0.8242(4) 0.6792(4) 0.8093(3) 0.0198(11) Uani 1 1 d . . .
C8 C 0.6965(4) 0.9005(4) 0.8138(4) 0.0255(13) Uani 1 1 d . . .
C9 C 0.5716(4) 0.6387(4) 0.6178(3) 0.0190(11) Uani 1 1 d . . .
C10 C 0.5819(4) 0.6879(4) 0.5499(3) 0.0197(11) Uani 1 1 d . . .
C11 C 0.5237(4) 0.6423(4) 0.4848(3) 0.0224(11) Uani 1 1 d . . .
H11 H 0.5298 0.6768 0.4402 0.027 Uiso 1 1 calc R . .
C12 C 0.4578(4) 0.5460(4) 0.4877(3) 0.0225(12) Uani 1 1 d . . .
C13 C 0.4478(4) 0.4959(4) 0.5565(3) 0.0238(12) Uani 1 1 d . . .
H13 H 0.4053 0.4310 0.5584 0.029 Uiso 1 1 calc R . .
C14 C 0.5008(4) 0.5422(4) 0.6219(3) 0.0207(11) Uani 1 1 d . . .
C15 C 0.6607(4) 0.7865(4) 0.5379(3) 0.0238(12) Uani 1 1 d . . .
C16 C 0.4054(4) 0.4950(4) 0.4176(3) 0.0224(12) Uani 1 1 d . . .
C17 C 0.4754(4) 0.4855(4) 0.6956(3) 0.0245(12) Uani 1 1 d . . .


_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
Co1 O4 1.991(4) 2_765 ?
Co1 O9 2.012(5) 3_665 ?
Co1 O1 2.021(4) . ?
Co1 O8 2.098(4) 5_665 ?
Co1 O7 2.263(5) 5_665 ?
Co2 O6 2.036(4) 4 ?
Co2 O3 2.036(4) 2_765 ?
Co2 O2 2.098(4) . ?
Co2 O12 2.125(5) . ?
Co2 O11 2.133(5) . ?
Co2 O8 2.196(4) 5_665 ?
Co3 O13 2.081(5) 2_655 ?
Co3 O13 2.081(5) . ?
Co3 O13 2.081(5) 3_665 ?
Co3 O14 2.089(6) 2_655 ?
Co3 O14 2.089(6) 3_665 ?
Co3 O14 2.089(6) . ?
O1 C7 1.260(7) . ?
O2 C7 1.244(8) . ?
O3 C8 1.248(8) . ?
O3 Co2 2.036(4) 3_675 ?
O4 C8 1.251(8) . ?
O4 Co1 1.991(4) 3_675 ?
O5 C15 1.275(8) . ?
O6 C15 1.270(8) . ?
O6 Co2 2.036(4) 4_554 ?
O7 C16 1.239(8) . ?
O7 Co1 2.263(5) 5_564 ?
O8 C16 1.271(7) . ?
O8 Co1 2.098(4) 5_564 ?
O8 Co2 2.196(4) 5_564 ?
O9 C17 1.281(8) . ?
O9 Co1 2.012(5) 2_655 ?
O10 C17 1.224(8) . ?
C1 C2 1.379(8) . ?
C1 C6 1.384(8) . ?
C1 C7 1.510(8) . ?
C2 C3 1.415(8) . ?
C2 H2 0.9300 . ?
C3 C4 1.377(9) . ?
C3 C8 1.507(8) . ?
C4 C5 1.406(8) . ?
C4 H4 0.9300 . ?
C5 C6 1.372(8) . ?
C5 C9 1.507(8) . ?
C6 H6 0.9300 . ?
C9 C10 1.383(8) . ?
C9 C14 1.410(8) . ?
C10 C11 1.417(8) . ?
C10 C15 1.486(8) . ?
C11 C12 1.387(8) . ?
C11 H11 0.9300 . ?
C12 C13 1.404(8) . ?
C12 C16 1.476(8) . ?
C13 C14 1.391(8) . ?
C13 H13 0.9300 . ?
C14 C17 1.504(8) . ?

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
O4 Co1 O9 98.0(2) 2_765 3_665 ?
O4 Co1 O1 104.4(2) 2_765 . ?
O9 Co1 O1 96.59(19) 3_665 . ?
O4 Co1 O8 99.1(2) 2_765 5_665 ?
O9 Co1 O8 145.56(18) 3_665 5_665 ?
O1 Co1 O8 107.70(17) . 5_665 ?
O4 Co1 O7 155.6(2) 2_765 5_665 ?
O9 Co1 O7 95.75(18) 3_665 5_665 ?
O1 Co1 O7 93.8(2) . 5_665 ?
O8 Co1 O7 59.39(16) 5_665 5_665 ?
O6 Co2 O3 176.3(2) 4 2_765 ?
O6 Co2 O2 88.8(2) 4 . ?
O3 Co2 O2 90.7(2) 2_765 . ?
O6 Co2 O12 93.1(2) 4 . ?
O3 Co2 O12 87.8(2) 2_765 . ?
O2 Co2 O12 172.5(2) . . ?
O6 Co2 O11 94.63(19) 4 . ?
O3 Co2 O11 88.97(19) 2_765 . ?
O2 Co2 O11 85.14(19) . . ?
O12 Co2 O11 87.5(2) . . ?
O6 Co2 O8 87.24(18) 4 5_665 ?
O3 Co2 O8 89.20(18) 2_765 5_665 ?
O2 Co2 O8 97.52(17) . 5_665 ?
O12 Co2 O8 89.8(2) . 5_665 ?
O11 Co2 O8 176.79(18) . 5_665 ?
O13 Co3 O13 89.0(2) 2_655 . ?
O13 Co3 O13 89.0(2) 2_655 3_665 ?
O13 Co3 O13 89.0(2) . 3_665 ?
O13 Co3 O14 90.9(2) 2_655 2_655 ?
O13 Co3 O14 89.7(2) . 2_655 ?
O13 Co3 O14 178.7(2) 3_665 2_655 ?
O13 Co3 O14 89.7(2) 2_655 3_665 ?
O13 Co3 O14 178.7(2) . 3_665 ?
O13 Co3 O14 90.9(2) 3_665 3_665 ?
O14 Co3 O14 90.4(3) 2_655 3_665 ?
O13 Co3 O14 178.7(2) 2_655 . ?
O13 Co3 O14 90.9(2) . . ?
O13 Co3 O14 89.7(2) 3_665 . ?
O14 Co3 O14 90.4(3) 2_655 . ?
O14 Co3 O14 90.4(3) 3_665 . ?
C7 O1 Co1 119.7(4) . . ?
C7 O2 Co2 142.2(4) . . ?
C8 O3 Co2 133.3(4) . 3_675 ?
C8 O4 Co1 130.2(4) . 3_675 ?
C15 O6 Co2 125.7(4) . 4_554 ?
C16 O7 Co1 87.0(3) . 5_564 ?
C16 O8 Co1 93.7(4) . 5_564 ?
C16 O8 Co2 139.3(4) . 5_564 ?
Co1 O8 Co2 101.21(17) 5_564 5_564 ?
C17 O9 Co1 101.5(4) . 2_655 ?
C2 C1 C6 120.1(5) . . ?
C2 C1 C7 117.2(5) . . ?
C6 C1 C7 122.6(5) . . ?
C1 C2 C3 118.9(5) . . ?
C1 C2 H2 120.5 . . ?
C3 C2 H2 120.5 . . ?
C4 C3 C2 120.5(5) . . ?
C4 C3 C8 120.5(5) . . ?
C2 C3 C8 118.9(5) . . ?
C3 C4 C5 119.7(5) . . ?
C3 C4 H4 120.2 . . ?
C5 C4 H4 120.2 . . ?
C6 C5 C4 119.3(5) . . ?
C6 C5 C9 122.1(5) . . ?
C4 C5 C9 118.6(5) . . ?
C5 C6 C1 121.4(5) . . ?
C5 C6 H6 119.3 . . ?
C1 C6 H6 119.3 . . ?
O2 C7 O1 124.0(5) . . ?
O2 C7 C1 118.0(5) . . ?
O1 C7 C1 117.9(5) . . ?
O3 C8 O4 126.0(5) . . ?
O3 C8 C3 117.2(6) . . ?
O4 C8 C3 116.8(5) . . ?
C10 C9 C14 118.8(5) . . ?
C10 C9 C5 120.2(5) . . ?
C14 C9 C5 121.1(5) . . ?
C9 C10 C11 120.9(5) . . ?
C9 C10 C15 122.2(5) . . ?
C11 C10 C15 116.4(5) . . ?
C12 C11 C10 120.0(5) . . ?
C12 C11 H11 120.0 . . ?
C10 C11 H11 120.0 . . ?
C11 C12 C13 119.0(5) . . ?
C11 C12 C16 120.6(5) . . ?
C13 C12 C16 120.1(5) . . ?
C14 C13 C12 120.8(5) . . ?
C14 C13 H13 119.6 . . ?
C12 C13 H13 119.6 . . ?
C13 C14 C9 120.2(5) . . ?
C13 C14 C17 116.7(5) . . ?
C9 C14 C17 123.1(5) . . ?
O5 C15 O6 125.1(6) . . ?
O5 C15 C10 117.3(5) . . ?
O6 C15 C10 117.5(5) . . ?
O7 C16 O8 119.2(5) . . ?
O7 C16 C12 120.6(5) . . ?
O8 C16 C12 120.1(5) . . ?
O10 C17 O9 121.5(6) . . ?
O10 C17 C14 121.5(6) . . ?
O9 C17 C14 116.8(5) . . ?

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
O4 Co1 O1 C7 -51.1(5) 2_765 . . . ?
O9 Co1 O1 C7 -151.1(4) 3_665 . . . ?
O8 Co1 O1 C7 53.6(5) 5_665 . . . ?
O7 Co1 O1 C7 112.6(4) 5_665 . . . ?
O6 Co2 O2 C7 -79.4(7) 4 . . . ?
O3 Co2 O2 C7 97.0(7) 2_765 . . . ?
O12 Co2 O2 C7 175.8(16) . . . . ?
O11 Co2 O2 C7 -174.1(8) . . . . ?
O8 Co2 O2 C7 7.7(8) 5_665 . . . ?
C6 C1 C2 C3 -2.5(9) . . . . ?
C7 C1 C2 C3 174.6(6) . . . . ?
C1 C2 C3 C4 0.0(10) . . . . ?
C1 C2 C3 C8 -177.7(6) . . . . ?
C2 C3 C4 C5 2.6(9) . . . . ?
C8 C3 C4 C5 -179.8(6) . . . . ?
C3 C4 C5 C6 -2.7(9) . . . . ?
C3 C4 C5 C9 179.0(6) . . . . ?
C4 C5 C6 C1 0.2(9) . . . . ?
C9 C5 C6 C1 178.5(5) . . . . ?
C2 C1 C6 C5 2.4(9) . . . . ?
C7 C1 C6 C5 -174.5(5) . . . . ?
Co2 O2 C7 O1 -19.6(11) . . . . ?
Co2 O2 C7 C1 162.7(5) . . . . ?
Co1 O1 C7 O2 -15.3(8) . . . . ?
Co1 O1 C7 C1 162.4(4) . . . . ?
C2 C1 C7 O2 1.7(8) . . . . ?
C6 C1 C7 O2 178.7(6) . . . . ?
C2 C1 C7 O1 -176.1(6) . . . . ?
C6 C1 C7 O1 0.9(8) . . . . ?
Co2 O3 C8 O4 -15.2(11) 3_675 . . . ?
Co2 O3 C8 C3 166.5(4) 3_675 . . . ?
Co1 O4 C8 O3 -4.6(10) 3_675 . . . ?
Co1 O4 C8 C3 173.7(4) 3_675 . . . ?
C4 C3 C8 O3 155.7(6) . . . . ?
C2 C3 C8 O3 -26.7(9) . . . . ?
C4 C3 C8 O4 -22.8(9) . . . . ?
C2 C3 C8 O4 154.9(6) . . . . ?
C6 C5 C9 C10 -120.0(6) . . . . ?
C4 C5 C9 C10 58.2(8) . . . . ?
C6 C5 C9 C14 59.8(8) . . . . ?
C4 C5 C9 C14 -122.0(6) . . . . ?
C14 C9 C10 C11 -1.0(9) . . . . ?
C5 C9 C10 C11 178.7(5) . . . . ?
C14 C9 C10 C15 -173.5(6) . . . . ?
C5 C9 C10 C15 6.2(9) . . . . ?
C9 C10 C11 C12 -2.5(9) . . . . ?
C15 C10 C11 C12 170.4(6) . . . . ?
C10 C11 C12 C13 2.0(9) . . . . ?
C10 C11 C12 C16 -172.2(6) . . . . ?
C11 C12 C13 C14 2.0(9) . . . . ?
C16 C12 C13 C14 176.3(6) . . . . ?
C12 C13 C14 C9 -5.7(9) . . . . ?
C12 C13 C14 C17 171.8(6) . . . . ?
C10 C9 C14 C13 5.1(9) . . . . ?
C5 C9 C14 C13 -174.6(6) . . . . ?
C10 C9 C14 C17 -172.2(6) . . . . ?
C5 C9 C14 C17 8.1(9) . . . . ?
Co2 O6 C15 O5 24.6(9) 4_554 . . . ?
Co2 O6 C15 C10 -151.9(4) 4_554 . . . ?
C9 C10 C15 O5 54.0(8) . . . . ?
C11 C10 C15 O5 -118.8(7) . . . . ?
C9 C10 C15 O6 -129.2(6) . . . . ?
C11 C10 C15 O6 58.0(8) . . . . ?
Co1 O7 C16 O8 -8.5(6) 5_564 . . . ?
Co1 O7 C16 C12 166.6(5) 5_564 . . . ?
Co1 O8 C16 O7 9.2(6) 5_564 . . . ?
Co2 O8 C16 O7 -102.7(7) 5_564 . . . ?
Co1 O8 C16 C12 -165.9(5) 5_564 . . . ?
Co2 O8 C16 C12 82.1(7) 5_564 . . . ?
C11 C12 C16 O7 -17.1(9) . . . . ?
C13 C12 C16 O7 168.7(6) . . . . ?
C11 C12 C16 O8 158.0(6) . . . . ?
C13 C12 C16 O8 -16.2(9) . . . . ?
Co1 O9 C17 O10 7.8(7) 2_655 . . . ?
Co1 O9 C17 C14 -167.0(4) 2_655 . . . ?
C13 C14 C17 O10 -128.5(7) . . . . ?
C9 C14 C17 O10 48.9(9) . . . . ?
C13 C14 C17 O9 46.3(8) . . . . ?
C9 C14 C17 O9 -136.4(6) . . . . ?

_diffrn_measured_fraction_theta_max 0.999
_diffrn_reflns_theta_full        25.05
_diffrn_measured_fraction_theta_full 0.999
_refine_diff_density_max         1.762
_refine_diff_density_min         -0.700
_refine_diff_density_rms         0.229
