#------------------------------------------------------------------------------
#$Date: 2016-02-20 05:06:23 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176774 $
#$URL: svn://www.crystallography.net/cod/cif/2/20/77/2207700.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2207700
loop_
_publ_author_name
'Ren, Yong'
'Yu, Guang-Ao'
'Liu, Sheng-Hua'
_publ_section_title
;
 (Di-tert-butylphosphino)cobaltocenium hexafluorophosphate
;
_journal_coeditor_code           XU6062
_journal_issue                   12
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m2714
_journal_page_last               m2715
_journal_paper_doi               10.1107/S1600536805038596
_journal_volume                  61
_journal_year                    2005
_chemical_formula_iupac          '[Co (C18 H27 P)] P F6'
_chemical_formula_moiety         'C18 H27 Co P +, F6 P -'
_chemical_formula_sum            'C18 H27 Co F6 P2'
_chemical_formula_weight         478.27
_chemical_name_systematic
;
(Di-tert-butylphosphino)cobaltocenium hexafluorophosphate
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 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                 108.4620(11)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   12.2603(11)
_cell_length_b                   15.2255(12)
_cell_length_c                   12.3230(11)
_cell_measurement_reflns_used    3154
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      22.1
_cell_measurement_theta_min      2.2
_cell_volume                     2181.9(3)
_computing_cell_refinement       'SAINT (Bruker, 1997)'
_computing_data_collection       'SMART (Bruker, 1997)'
_computing_data_reduction        SAINT
_computing_molecular_graphics    'SHELXTL (Bruker, 2001)'
_computing_publication_material  SHELXTL
_computing_structure_refinement  'SHELXL97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 1.00
_diffrn_measured_fraction_theta_max 1.00
_diffrn_measurement_device_type  'Bruker SMART CCD area-detector'
_diffrn_measurement_method       'φ and ω'
_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  0.030
_diffrn_reflns_av_sigmaI/netI    0.039
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -9
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            12636
_diffrn_reflns_theta_full        27.0
_diffrn_reflns_theta_max         27.0
_diffrn_reflns_theta_min         2.0
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    0.983
_exptl_absorpt_correction_T_max  0.822
_exptl_absorpt_correction_T_min  0.685
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS; Sheldrick, 1996)'
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.456
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             984
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.30
_exptl_crystal_size_min          0.20
_refine_diff_density_max         0.73
_refine_diff_density_min         -0.39
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.027
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     250
_refine_ls_number_reflns         4754
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.027
_refine_ls_R_factor_all          0.081
_refine_ls_R_factor_gt           0.060
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w = 1/[σ²(Fo²)+(0.1021P)²+0.9195P] where P = (Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.167
_refine_ls_wR_factor_ref         0.184
_reflns_number_gt                3415
_reflns_number_total             4754
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            xu6062.cif
_cod_data_source_block           I
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 

The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               2207700
_cod_database_fobs_code          2207700
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_occupancy
_atom_site_type_symbol
Co1 0.47336(4) 0.22288(3) 0.57873(4) 0.0551(2) Uani d . 1 Co
C1 0.5131(5) 0.1818(4) 0.7432(4) 0.0905(16) Uani d . 1 C
H1 0.5906 0.1771 0.7983 0.109 Uiso calc R 1 H
C2 0.4550(5) 0.1164(3) 0.6676(5) 0.0862(15) Uani d . 1 C
H2 0.4845 0.0575 0.6610 0.103 Uiso calc R 1 H
C3 0.3468(4) 0.1495(3) 0.6022(4) 0.0679(10) Uani d . 1 C
H3 0.2884 0.1175 0.5424 0.082 Uiso calc R 1 H
C4 0.3358(3) 0.2381(3) 0.6391(3) 0.0563(9) Uani d . 1 C
C5 0.4408(4) 0.2565(3) 0.7251(3) 0.0749(12) Uani d . 1 C
H5 0.4610 0.3127 0.7651 0.090 Uiso calc R 1 H
C6 0.5721(6) 0.1822(4) 0.4859(6) 0.104(2) Uani d . 1 C
H6 0.6074 0.1241 0.4893 0.124 Uiso calc R 1 H
C7 0.4639(6) 0.2070(4) 0.4143(4) 0.0930(17) Uani d . 1 C
H7 0.4091 0.1697 0.3579 0.112 Uiso calc R 1 H
C8 0.4495(5) 0.2960(4) 0.4357(5) 0.0882(15) Uani d . 1 C
H8 0.3820 0.3321 0.3978 0.106 Uiso calc R 1 H
C9 0.5465(6) 0.3233(4) 0.5194(6) 0.1025(18) Uani d . 1 C
H9 0.5601 0.3825 0.5521 0.123 Uiso calc R 1 H
C10 0.6210(5) 0.2543(6) 0.5495(6) 0.113(2) Uani d . 1 C
H10 0.6973 0.2560 0.6073 0.135 Uiso calc R 1 H
C11 0.1022(4) 0.2363(4) 0.6335(4) 0.0797(13) Uani d . 1 C
C12 0.0639(5) 0.1560(5) 0.5552(5) 0.113(2) Uani d . 1 C
H12A 0.1274 0.1163 0.5671 0.170 Uiso calc R 1 H
H12B 0.0382 0.1747 0.4768 0.170 Uiso calc R 1 H
H12C 0.0021 0.1268 0.5728 0.170 Uiso calc R 1 H
C13 0.1534(5) 0.2037(4) 0.7560(5) 0.0984(17) Uani d . 1 C
H13A 0.1781 0.2530 0.8064 0.148 Uiso calc R 1 H
H13B 0.2180 0.1664 0.7614 0.148 Uiso calc R 1 H
H13C 0.0963 0.1712 0.7775 0.148 Uiso calc R 1 H
C14 -0.0039(5) 0.2916(5) 0.6263(7) 0.127(2) Uani d . 1 C
H14A -0.0601 0.2557 0.6444 0.190 Uiso calc R 1 H
H14B -0.0358 0.3146 0.5503 0.190 Uiso calc R 1 H
H14C 0.0176 0.3393 0.6798 0.190 Uiso calc R 1 H
C15 0.2358(4) 0.4127(3) 0.6458(4) 0.0843(13) Uani d . 1 C
C16 0.1322(5) 0.4725(4) 0.5886(6) 0.122(2) Uani d . 1 C
H16A 0.1530 0.5326 0.6084 0.183 Uiso calc R 1 H
H16B 0.0690 0.4565 0.6148 0.183 Uiso calc R 1 H
H16C 0.1101 0.4656 0.5071 0.183 Uiso calc R 1 H
C17 0.2617(6) 0.4162(4) 0.7769(5) 0.113(2) Uani d . 1 C
H17A 0.3177 0.3722 0.8125 0.170 Uiso calc R 1 H
H17B 0.1923 0.4054 0.7950 0.170 Uiso calc R 1 H
H17C 0.2912 0.4732 0.8047 0.170 Uiso calc R 1 H
C18 0.3359(5) 0.4506(3) 0.6119(6) 0.1085(19) Uani d . 1 C
H18A 0.3183 0.4474 0.5303 0.163 Uiso calc R 1 H
H18B 0.4043 0.4175 0.6481 0.163 Uiso calc R 1 H
H18C 0.3478 0.5108 0.6359 0.163 Uiso calc R 1 H
F1 0.6896(4) 0.4017(3) 0.8093(4) 0.176(2) Uani d . 1 F
F2 0.8297(4) 0.4900(2) 0.8913(4) 0.167(2) Uani d . 1 F
F3 0.7453(5) 0.5924(3) 0.7707(5) 0.208(3) Uani d . 1 F
F4 0.6133(4) 0.5023(3) 0.6782(4) 0.174(2) Uani d . 1 F
F5 0.6516(10) 0.5246(7) 0.8634(10) 0.342(6) Uani d . 1 F
F6 0.7852(6) 0.4629(7) 0.7165(7) 0.289(5) Uani d . 1 F
P1 0.20348(9) 0.30195(7) 0.57573(8) 0.0598(3) Uani d . 1 P
P2 0.71604(11) 0.49767(8) 0.78934(12) 0.0844(4) Uani d . 1 P
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'
F F 0.0171 0.0103 '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'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_publ_flag
C3 Co1 C7 106.2(2) ?
C3 Co1 C2 41.12(19) ?
C7 Co1 C2 118.2(2) ?
C3 Co1 C6 122.9(3) ?
C7 Co1 C6 40.6(3) ?
C2 Co1 C6 104.7(2) ?
C3 Co1 C10 159.9(3) ?
C7 Co1 C10 67.4(3) ?
C2 Co1 C10 123.5(3) ?
C6 Co1 C10 39.9(3) ?
C3 Co1 C9 157.6(2) ?
C7 Co1 C9 67.5(2) ?
C2 Co1 C9 161.1(3) ?
C6 Co1 C9 67.1(2) ?
C10 Co1 C9 39.5(3) ?
C3 Co1 C8 121.8(2) ?
C7 Co1 C8 40.7(2) ?
C2 Co1 C8 155.2(3) ?
C6 Co1 C8 67.7(2) ?
C10 Co1 C8 66.6(3) ?
C9 Co1 C8 39.5(2) ?
C3 Co1 C1 68.7(2) ?
C7 Co1 C1 153.0(3) ?
C2 Co1 C1 40.4(2) ?
C6 Co1 C1 118.5(2) ?
C10 Co1 C1 107.9(2) ?
C9 Co1 C1 126.9(3) ?
C8 Co1 C1 164.1(3) ?
C3 Co1 C5 68.5(2) ?
C7 Co1 C5 164.0(2) ?
C2 Co1 C5 68.4(2) ?
C6 Co1 C5 155.0(3) ?
C10 Co1 C5 122.7(3) ?
C9 Co1 C5 111.4(2) ?
C8 Co1 C5 128.3(2) ?
C1 Co1 C5 40.81(19) ?
C3 Co1 C4 41.54(15) ?
C7 Co1 C4 125.8(2) ?
C2 Co1 C4 69.40(16) ?
C6 Co1 C4 161.8(3) ?
C10 Co1 C4 157.5(3) ?
C9 Co1 C4 123.6(2) ?
C8 Co1 C4 110.09(18) ?
C1 Co1 C4 68.84(17) ?
C5 Co1 C4 40.36(17) ?
C2 C1 C5 107.8(4) ?
C2 C1 Co1 69.1(2) ?
C5 C1 Co1 69.8(2) ?
C2 C1 H1 126.1 ?
C5 C1 H1 126.1 ?
Co1 C1 H1 126.1 ?
C1 C2 C3 108.4(4) ?
C1 C2 Co1 70.5(3) ?
C3 C2 Co1 69.3(2) ?
C1 C2 H2 125.8 ?
C3 C2 H2 125.8 ?
Co1 C2 H2 125.8 ?
C2 C3 C4 108.6(4) ?
C2 C3 Co1 69.6(3) ?
C4 C3 Co1 71.3(2) ?
C2 C3 H3 125.7 ?
C4 C3 H3 125.7 ?
Co1 C3 H3 125.7 ?
C5 C4 C3 105.5(4) ?
C5 C4 P1 133.3(3) ?
C3 C4 P1 121.2(3) ?
C5 C4 Co1 68.7(2) ?
C3 C4 Co1 67.2(2) ?
P1 C4 Co1 128.2(2) ?
C4 C5 C1 109.6(4) ?
C4 C5 Co1 70.9(2) ?
C1 C5 Co1 69.4(2) ?
C4 C5 H5 125.2 ?
C1 C5 H5 125.2 ?
Co1 C5 H5 125.2 ?
C10 C6 C7 107.5(5) ?
C10 C6 Co1 70.2(3) ?
C7 C6 Co1 69.6(3) ?
C10 C6 H6 126.2 ?
C7 C6 H6 126.2 ?
Co1 C6 H6 126.2 ?
C6 C7 C8 107.1(5) ?
C6 C7 Co1 69.8(3) ?
C8 C7 Co1 70.4(3) ?
C6 C7 H7 126.4 ?
C8 C7 H7 126.4 ?
Co1 C7 H7 126.4 ?
C9 C8 C7 107.7(5) ?
C9 C8 Co1 70.1(3) ?
C7 C8 Co1 68.9(3) ?
C9 C8 H8 126.1 ?
C7 C8 H8 126.1 ?
Co1 C8 H8 126.1 ?
C10 C9 C8 108.6(6) ?
C10 C9 Co1 69.9(3) ?
C8 C9 Co1 70.4(3) ?
C10 C9 H9 125.7 ?
C8 C9 H9 125.7 ?
Co1 C9 H9 125.7 ?
C9 C10 C6 109.1(6) ?
C9 C10 Co1 70.6(3) ?
C6 C10 Co1 69.9(3) ?
C9 C10 H10 125.5 ?
C6 C10 H10 125.5 ?
Co1 C10 H10 125.5 ?
C13 C11 C14 108.2(5) ?
C13 C11 C12 108.2(5) ?
C14 C11 C12 108.5(5) ?
C13 C11 P1 115.5(4) ?
C14 C11 P1 109.5(4) ?
C12 C11 P1 106.8(3) ?
C11 C12 H12A 109.5 ?
C11 C12 H12B 109.5 ?
H12A C12 H12B 109.5 ?
C11 C12 H12C 109.5 ?
H12A C12 H12C 109.5 ?
H12B C12 H12C 109.5 ?
C11 C13 H13A 109.5 ?
C11 C13 H13B 109.5 ?
H13A C13 H13B 109.5 ?
C11 C13 H13C 109.5 ?
H13A C13 H13C 109.5 ?
H13B C13 H13C 109.5 ?
C11 C14 H14A 109.5 ?
C11 C14 H14B 109.5 ?
H14A C14 H14B 109.5 ?
C11 C14 H14C 109.5 ?
H14A C14 H14C 109.5 ?
H14B C14 H14C 109.5 ?
C18 C15 C16 105.6(5) ?
C18 C15 C17 110.8(5) ?
C16 C15 C17 108.9(5) ?
C18 C15 P1 106.5(3) ?
C16 C15 P1 107.3(4) ?
C17 C15 P1 117.0(4) ?
C15 C16 H16A 109.5 ?
C15 C16 H16B 109.5 ?
H16A C16 H16B 109.5 ?
C15 C16 H16C 109.5 ?
H16A C16 H16C 109.5 ?
H16B C16 H16C 109.5 ?
C15 C17 H17A 109.5 ?
C15 C17 H17B 109.5 ?
H17A C17 H17B 109.5 ?
C15 C17 H17C 109.5 ?
H17A C17 H17C 109.5 ?
H17B C17 H17C 109.5 ?
C15 C18 H18A 109.5 ?
C15 C18 H18B 109.5 ?
H18A C18 H18B 109.5 ?
C15 C18 H18C 109.5 ?
H18A C18 H18C 109.5 ?
H18B C18 H18C 109.5 ?
C4 P1 C11 98.9(2) yes
C4 P1 C15 104.50(19) yes
C11 P1 C15 111.6(2) yes
F5 P2 F6 175.7(6) ?
F5 P2 F3 91.7(5) ?
F6 P2 F3 92.2(5) ?
F5 P2 F1 89.0(5) ?
F6 P2 F1 87.1(4) ?
F3 P2 F1 178.6(3) ?
F5 P2 F4 95.3(5) ?
F6 P2 F4 86.7(4) ?
F3 P2 F4 89.3(2) ?
F1 P2 F4 91.8(2) ?
F5 P2 F2 92.3(6) ?
F6 P2 F2 85.7(4) ?
F3 P2 F2 90.0(2) ?
F1 P2 F2 88.8(2) ?
F4 P2 F2 172.4(4) ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_publ_flag
Co1 C3 2.005(4) ?
Co1 C7 2.007(5) ?
Co1 C2 2.009(4) ?
Co1 C6 2.009(5) ?
Co1 C10 2.013(5) ?
Co1 C9 2.023(5) ?
Co1 C8 2.026(4) ?
Co1 C1 2.027(4) ?
Co1 C5 2.032(4) ?
Co1 C4 2.061(4) ?
C1 C2 1.395(8) ?
C1 C5 1.415(6) ?
C1 H1 0.9800 ?
C2 C3 1.410(6) ?
C2 H2 0.9800 ?
C3 C4 1.443(5) ?
C3 H3 0.9800 ?
C4 C5 1.412(6) ?
P1 C4 1.840(4) yes
C5 H5 0.9800 ?
C6 C10 1.372(9) ?
C6 C7 1.393(8) ?
C6 H6 0.9800 ?
C7 C8 1.402(7) ?
C7 H7 0.9800 ?
C8 C9 1.369(8) ?
C8 H8 0.9800 ?
C9 C10 1.364(9) ?
C9 H9 0.9800 ?
C10 H10 0.9800 ?
C11 C13 1.522(7) ?
C11 C14 1.529(7) ?
C11 C12 1.536(8) ?
P1 C11 1.900(5) yes
C12 H12A 0.9600 ?
C12 H12B 0.9600 ?
C12 H12C 0.9600 ?
C13 H13A 0.9600 ?
C13 H13B 0.9600 ?
C13 H13C 0.9600 ?
C14 H14A 0.9600 ?
C14 H14B 0.9600 ?
C14 H14C 0.9600 ?
C15 C18 1.529(8) ?
C15 C16 1.539(6) ?
C15 C17 1.546(7) ?
P1 C15 1.879(5) yes
C16 H16A 0.9600 ?
C16 H16B 0.9600 ?
C16 H16C 0.9600 ?
C17 H17A 0.9600 ?
C17 H17B 0.9600 ?
C17 H17C 0.9600 ?
C18 H18A 0.9600 ?
C18 H18B 0.9600 ?
C18 H18C 0.9600 ?
F1 P2 1.533(4) ?
F2 P2 1.558(4) ?
F3 P2 1.521(4) ?
F4 P2 1.541(4) ?
F5 P2 1.443(7) ?
F6 P2 1.512(7) ?
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_publ_flag
C6 H6 F2 2_646 0.98 2.49 3.340(7) 145 yes
C8 H8 F3 3_666 0.98 2.45 3.349(6) 152 yes
C9 H9 F4 . 0.98 2.35 3.304(8) 164 yes
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
C3 Co1 C1 C2 37.9(3)
C7 Co1 C1 C2 -45.8(6)
C6 Co1 C1 C2 -78.9(4)
C10 Co1 C1 C2 -121.0(4)
C9 Co1 C1 C2 -160.5(3)
C8 Co1 C1 C2 171.8(7)
C5 Co1 C1 C2 119.4(4)
C4 Co1 C1 C2 82.7(3)
C3 Co1 C1 C5 -81.4(3)
C7 Co1 C1 C5 -165.2(4)
C2 Co1 C1 C5 -119.4(5)
C6 Co1 C1 C5 161.7(4)
C10 Co1 C1 C5 119.6(4)
C9 Co1 C1 C5 80.1(4)
C8 Co1 C1 C5 52.5(9)
C4 Co1 C1 C5 -36.7(3)
C5 C1 C2 C3 0.1(5)
Co1 C1 C2 C3 -59.2(3)
C5 C1 C2 Co1 59.2(3)
C3 Co1 C2 C1 -119.4(4)
C7 Co1 C2 C1 158.3(3)
C6 Co1 C2 C1 116.9(4)
C10 Co1 C2 C1 78.0(4)
C9 Co1 C2 C1 55.4(8)
C8 Co1 C2 C1 -174.7(4)
C5 Co1 C2 C1 -37.8(3)
C4 Co1 C2 C1 -81.2(3)
C7 Co1 C2 C3 -82.3(3)
C6 Co1 C2 C3 -123.7(4)
C10 Co1 C2 C3 -162.6(3)
C9 Co1 C2 C3 174.8(6)
C8 Co1 C2 C3 -55.3(6)
C1 Co1 C2 C3 119.4(4)
C5 Co1 C2 C3 81.6(3)
C4 Co1 C2 C3 38.2(2)
C1 C2 C3 C4 -1.0(5)
Co1 C2 C3 C4 -60.9(3)
C1 C2 C3 Co1 59.9(3)
C7 Co1 C3 C2 114.6(4)
C6 Co1 C3 C2 73.6(4)
C10 Co1 C3 C2 46.5(8)
C9 Co1 C3 C2 -175.6(5)
C8 Co1 C3 C2 156.1(3)
C1 Co1 C3 C2 -37.3(3)
C5 Co1 C3 C2 -81.3(3)
C4 Co1 C3 C2 -119.1(4)
C7 Co1 C3 C4 -126.3(3)
C2 Co1 C3 C4 119.1(4)
C6 Co1 C3 C4 -167.3(3)
C10 Co1 C3 C4 165.6(6)
C9 Co1 C3 C4 -56.5(6)
C8 Co1 C3 C4 -84.9(3)
C1 Co1 C3 C4 81.7(3)
C5 Co1 C3 C4 37.8(2)
C2 C3 C4 C5 1.5(4)
Co1 C3 C4 C5 -58.3(3)
C2 C3 C4 P1 -178.2(3)
Co1 C3 C4 P1 122.0(3)
C2 C3 C4 Co1 59.8(3)
C3 Co1 C4 C5 118.4(4)
C7 Co1 C4 C5 -169.0(3)
C2 Co1 C4 C5 80.5(3)
C6 Co1 C4 C5 154.4(6)
C10 Co1 C4 C5 -48.7(7)
C9 Co1 C4 C5 -84.0(4)
C8 Co1 C4 C5 -126.0(3)
C1 Co1 C4 C5 37.1(3)
C7 Co1 C4 C3 72.7(3)
C2 Co1 C4 C3 -37.9(3)
C6 Co1 C4 C3 36.1(7)
C10 Co1 C4 C3 -167.1(6)
C9 Co1 C4 C3 157.6(3)
C8 Co1 C4 C3 115.6(3)
C1 Co1 C4 C3 -81.3(3)
C5 Co1 C4 C3 -118.4(4)
C3 Co1 C4 P1 -112.6(4)
C7 Co1 C4 P1 -39.9(4)
C2 Co1 C4 P1 -150.5(3)
C6 Co1 C4 P1 -76.5(7)
C10 Co1 C4 P1 80.3(6)
C9 Co1 C4 P1 45.0(4)
C8 Co1 C4 P1 3.0(4)
C1 Co1 C4 P1 166.1(4)
C5 Co1 C4 P1 129.0(4)
C3 C4 C5 C1 -1.5(5)
P1 C4 C5 C1 178.2(3)
Co1 C4 C5 C1 -58.8(3)
C3 C4 C5 Co1 57.3(3)
P1 C4 C5 Co1 -123.0(4)
C2 C1 C5 C4 0.9(5)
Co1 C1 C5 C4 59.7(3)
C2 C1 C5 Co1 -58.8(3)
C3 Co1 C5 C4 -38.8(2)
C7 Co1 C5 C4 34.4(9)
C2 Co1 C5 C4 -83.2(3)
C6 Co1 C5 C4 -161.4(5)
C10 Co1 C5 C4 160.0(4)
C9 Co1 C5 C4 117.1(3)
C8 Co1 C5 C4 75.4(4)
C1 Co1 C5 C4 -120.7(5)
C3 Co1 C5 C1 81.8(4)
C7 Co1 C5 C1 155.0(7)
C2 Co1 C5 C1 37.4(3)
C6 Co1 C5 C1 -40.8(7)
C10 Co1 C5 C1 -79.4(5)
C9 Co1 C5 C1 -122.2(4)
C8 Co1 C5 C1 -164.0(4)
C4 Co1 C5 C1 120.7(5)
C3 Co1 C6 C10 -165.9(4)
C7 Co1 C6 C10 118.4(5)
C2 Co1 C6 C10 -125.2(4)
C9 Co1 C6 C10 36.8(4)
C8 Co1 C6 C10 79.8(4)
C1 Co1 C6 C10 -84.0(5)
C5 Co1 C6 C10 -55.0(7)
C4 Co1 C6 C10 166.4(5)
C3 Co1 C6 C7 75.7(4)
C2 Co1 C6 C7 116.4(4)
C10 Co1 C6 C7 -118.4(5)
C9 Co1 C6 C7 -81.6(4)
C8 Co1 C6 C7 -38.6(3)
C1 Co1 C6 C7 157.6(4)
C5 Co1 C6 C7 -173.4(5)
C4 Co1 C6 C7 48.0(7)
C10 C6 C7 C8 0.6(6)
Co1 C6 C7 C8 60.8(3)
C10 C6 C7 Co1 -60.2(4)
C3 Co1 C7 C6 -122.1(4)
C2 Co1 C7 C6 -79.4(4)
C10 Co1 C7 C6 37.7(4)
C9 Co1 C7 C6 80.6(4)
C8 Co1 C7 C6 117.6(5)
C1 Co1 C7 C6 -47.5(6)
C5 Co1 C7 C6 169.8(7)
C4 Co1 C7 C6 -163.4(3)
C3 Co1 C7 C8 120.3(3)
C2 Co1 C7 C8 163.0(3)
C6 Co1 C7 C8 -117.6(5)
C10 Co1 C7 C8 -79.9(4)
C9 Co1 C7 C8 -37.0(3)
C1 Co1 C7 C8 -165.2(5)
C5 Co1 C7 C8 52.2(9)
C4 Co1 C7 C8 79.0(4)
C6 C7 C8 C9 -0.9(5)
Co1 C7 C8 C9 59.6(4)
C6 C7 C8 Co1 -60.5(3)
C3 Co1 C8 C9 163.5(3)
C7 Co1 C8 C9 -119.1(5)
C2 Co1 C8 C9 -157.0(5)
C6 Co1 C8 C9 -80.6(4)
C10 Co1 C8 C9 -37.1(4)
C1 Co1 C8 C9 35.7(9)
C5 Co1 C8 C9 77.0(4)
C4 Co1 C8 C9 118.8(4)
C3 Co1 C8 C7 -77.4(4)
C2 Co1 C8 C7 -37.9(6)
C6 Co1 C8 C7 38.5(4)
C10 Co1 C8 C7 82.0(4)
C9 Co1 C8 C7 119.1(5)
C1 Co1 C8 C7 154.8(7)
C5 Co1 C8 C7 -163.9(3)
C4 Co1 C8 C7 -122.1(3)
C7 C8 C9 C10 0.8(6)
Co1 C8 C9 C10 59.6(4)
C7 C8 C9 Co1 -58.9(3)
C3 Co1 C9 C10 -158.8(5)
C7 Co1 C9 C10 -81.3(5)
C2 Co1 C9 C10 30.2(9)
C6 Co1 C9 C10 -37.2(4)
C8 Co1 C9 C10 -119.4(6)
C1 Co1 C9 C10 72.1(5)
C5 Co1 C9 C10 115.9(4)
C4 Co1 C9 C10 159.6(4)
C3 Co1 C9 C8 -39.4(7)
C7 Co1 C9 C8 38.1(4)
C2 Co1 C9 C8 149.6(6)
C6 Co1 C9 C8 82.2(4)
C10 Co1 C9 C8 119.4(6)
C1 Co1 C9 C8 -168.5(3)
C5 Co1 C9 C8 -124.7(3)
C4 Co1 C9 C8 -81.0(4)
C8 C9 C10 C6 -0.4(7)
Co1 C9 C10 C6 59.6(4)
C8 C9 C10 Co1 -60.0(4)
C7 C6 C10 C9 -0.1(6)
Co1 C6 C10 C9 -60.0(4)
C7 C6 C10 Co1 59.9(3)
C3 Co1 C10 C9 156.4(6)
C7 Co1 C10 C9 81.5(4)
C2 Co1 C10 C9 -168.7(4)
C6 Co1 C10 C9 119.8(6)
C8 Co1 C10 C9 37.2(4)
C1 Co1 C10 C9 -126.9(4)
C5 Co1 C10 C9 -84.5(4)
C4 Co1 C10 C9 -49.1(7)
C3 Co1 C10 C6 36.5(9)
C7 Co1 C10 C6 -38.3(4)
C2 Co1 C10 C6 71.4(5)
C9 Co1 C10 C6 -119.8(6)
C8 Co1 C10 C6 -82.7(4)
C1 Co1 C10 C6 113.3(4)
C5 Co1 C10 C6 155.7(4)
C4 Co1 C10 C6 -168.9(4)
C5 C4 P1 C15 3.6(5)
C3 C4 P1 C15 -176.8(3)
Co1 C4 P1 C15 -92.6(3)
C5 C4 P1 C11 -111.6(4)
C3 C4 P1 C11 68.0(4)
Co1 C4 P1 C11 152.2(3)
C18 C15 P1 C4 62.3(4)
C16 C15 P1 C4 175.0(4)
C17 C15 P1 C4 -62.3(4)
C18 C15 P1 C11 168.3(3)
C16 C15 P1 C11 -79.0(4)
C17 C15 P1 C11 43.7(4)
C13 C11 P1 C4 39.2(4)
C14 C11 P1 C4 161.6(4)
C12 C11 P1 C4 -81.1(4)
C13 C11 P1 C15 -70.4(4)
C14 C11 P1 C15 52.0(5)
C12 C11 P1 C15 169.3(4)
