#------------------------------------------------------------------------------
#$Date: 2016-03-25 13:03:17 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179823 $
#$URL: svn://www.crystallography.net/cod/cif/7/01/19/7011934.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_7011934
loop_
_publ_author_name
'Otter, Carl A.'
'Hartshorn, Richard M.'
_publ_section_title
;
 Polydentate ligand construction: preparation of oxime???imine
 complexes via intramolecular condensation reactions
;
_journal_issue                   22
_journal_name_full
'Journal of the Chemical Society, Dalton Transactions'
_journal_page_first              4193
_journal_paper_doi               10.1039/b205956h
_journal_year                    2002
_chemical_formula_sum            'C16 H40 Cl5 Co N6 O5 Zn'
_chemical_formula_weight         698.09
_chemical_name_systematic
; 
? 
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                106.538(4)
_cell_angle_beta                 93.305(5)
_cell_angle_gamma                96.088(4)
_cell_formula_units_Z            2
_cell_length_a                   10.144(3)
_cell_length_b                   10.782(3)
_cell_length_c                   14.234(4)
_cell_measurement_temperature    168(2)
_cell_volume                     1477.7(7)
_computing_cell_refinement       'Bruker XSCANS'
_computing_data_collection       'Bruker XSCANS'
_computing_data_reduction        'Bruker SHELXTL'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      170(2)
_diffrn_measured_fraction_theta_full 0.979
_diffrn_measured_fraction_theta_max 0.979
_diffrn_measurement_device_type  'Bruker P4'
_diffrn_measurement_method       'ω 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  0.0367
_diffrn_reflns_av_sigmaI/netI    0.0444
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            19196
_diffrn_reflns_theta_full        26.39
_diffrn_reflns_theta_max         26.39
_diffrn_reflns_theta_min         1.99
_exptl_absorpt_coefficient_mu    1.861
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'BLESSING, ACTA. CRYST. 1995, A51, 33-38'
_exptl_crystal_colour            orange
_exptl_crystal_density_diffrn    1.569
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             720
_exptl_crystal_size_max          0.3
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.1
_refine_diff_density_max         0.428
_refine_diff_density_min         -0.412
_refine_diff_density_rms         0.082
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.034
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     317
_refine_ls_number_reflns         5939
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.034
_refine_ls_R_factor_all          0.0544
_refine_ls_R_factor_gt           0.0333
_refine_ls_shift/su_max          0.005
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0459P)²+0.1722P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0754
_refine_ls_wR_factor_ref         0.0895
_reflns_number_gt                4449
_reflns_number_total             5939
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b205956h.txt
_cod_data_source_block           dmeox
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from
2010-06-29.

'_exptl_absorpt_correction_type' value 'MULTISCAN' changed to
'multi-scan' 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 
;
_cod_original_cell_volume        1477.6(8)
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7011934
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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Zn1 Zn 0.28240(4) 0.30740(3) 0.14946(2) 0.02321(10) Uani 1 1 d . . .
Co1 Co 0.74837(4) 0.75786(4) 0.26177(3) 0.01741(11) Uani 1 1 d . . .
Cl3 Cl 0.10995(8) 0.23821(7) 0.02890(5) 0.02627(18) Uani 1 1 d . . .
Cl1 Cl 0.44040(8) 0.42467(8) 0.08934(6) 0.0345(2) Uani 1 1 d . . .
Cl4 Cl 0.37147(9) 0.13488(8) 0.17696(7) 0.0392(2) Uani 1 1 d . . .
Cl2 Cl 0.21963(11) 0.43116(9) 0.29267(6) 0.0451(3) Uani 1 1 d . . .
N2 N 0.7968(2) 0.6224(2) 0.31226(17) 0.0196(5) Uani 1 1 d . . .
N6 N 0.5594(2) 0.7058(2) 0.26717(17) 0.0220(5) Uani 1 1 d . . .
H6A H 0.5331 0.6263 0.2211 0.026 Uiso 1 1 calc R . .
H6B H 0.5459 0.6964 0.3283 0.026 Uiso 1 1 calc R . .
N3 N 0.7512(2) 0.6283(2) 0.13322(16) 0.0194(5) Uani 1 1 d . . .
H3A H 0.6652 0.5948 0.1073 0.023 Uiso 1 1 calc R . .
H3B H 0.7901 0.6683 0.0908 0.023 Uiso 1 1 calc R . .
N1 N 0.7741(2) 0.8525(2) 0.40251(17) 0.0211(5) Uani 1 1 d . . .
O2 O 1.0430(2) 0.8562(2) 0.29494(16) 0.0287(5) Uani 1 1 d . . .
H2OX H 1.0382 0.8078 0.3319 0.043 Uiso 1 1 calc R . .
O1 O 0.7697(3) 0.9822(2) 0.45086(15) 0.0338(6) Uani 1 1 d . . .
H1OX H 0.7848 1.0270 0.4121 0.051 Uiso 1 1 calc R . .
C10 C 0.7719(3) 0.9506(3) 0.1703(2) 0.0222(7) Uani 1 1 d . . .
N5 N 0.6861(2) 0.8768(2) 0.19899(17) 0.0206(5) Uani 1 1 d . . .
C1 C 0.8003(3) 0.7830(3) 0.4606(2) 0.0217(7) Uani 1 1 d . . .
N4 N 0.9177(2) 0.8571(2) 0.25244(17) 0.0207(5) Uani 1 1 d . . .
C14 C 0.4746(3) 0.8067(3) 0.2473(2) 0.0255(7) Uani 1 1 d . . .
C2 C 0.8110(3) 0.6454(3) 0.4063(2) 0.0213(6) Uani 1 1 d . . .
C8 C 0.9758(3) 0.5604(3) 0.1434(2) 0.0276(7) Uani 1 1 d . . .
H8A H 0.9916 0.5921 0.0865 0.041 Uiso 1 1 calc R . .
H8B H 1.0253 0.4863 0.1405 0.041 Uiso 1 1 calc R . .
H8C H 1.0059 0.6306 0.2041 0.041 Uiso 1 1 calc R . .
C6 C 0.8281(3) 0.5175(3) 0.1421(2) 0.0222(7) Uani 1 1 d . . .
C13 C 0.5424(3) 0.8575(3) 0.1707(2) 0.0258(7) Uani 1 1 d . . .
H13A H 0.5213 0.7938 0.1046 0.031 Uiso 1 1 calc R . .
H13B H 0.5115 0.9410 0.1690 0.031 Uiso 1 1 calc R . .
C11 C 1.0265(3) 1.0271(3) 0.1871(2) 0.0312(8) Uani 1 1 d . . .
H11A H 1.1092 1.0014 0.2104 0.047 Uiso 1 1 calc R . .
H11B H 1.0207 1.1184 0.2227 0.047 Uiso 1 1 calc R . .
H11C H 1.0258 1.0173 0.1165 0.047 Uiso 1 1 calc R . .
C9 C 0.9112(3) 0.9430(3) 0.2049(2) 0.0238(7) Uani 1 1 d . . .
C12 C 0.7412(3) 1.0382(3) 0.1091(2) 0.0323(8) Uani 1 1 d . . .
H12A H 0.7331 0.9885 0.0393 0.049 Uiso 1 1 calc R . .
H12B H 0.8131 1.1108 0.1220 0.049 Uiso 1 1 calc R . .
H12C H 0.6572 1.0725 0.1261 0.049 Uiso 1 1 calc R . .
C7 C 0.7831(3) 0.3952(3) 0.0551(2) 0.0283(7) Uani 1 1 d . . .
H7A H 0.7995 0.4147 -0.0067 0.043 Uiso 1 1 calc R . .
H7B H 0.6878 0.3681 0.0553 0.043 Uiso 1 1 calc R . .
H7C H 0.8333 0.3246 0.0612 0.043 Uiso 1 1 calc R . .
C3 C 0.8225(4) 0.8345(3) 0.5701(2) 0.0318(8) Uani 1 1 d . . .
H3C H 0.7950 0.9219 0.5917 0.048 Uiso 1 1 calc R . .
H3D H 0.9171 0.8391 0.5909 0.048 Uiso 1 1 calc R . .
H3E H 0.7698 0.7763 0.5997 0.048 Uiso 1 1 calc R . .
C5 C 0.7947(3) 0.4931(3) 0.2394(2) 0.0246(7) Uani 1 1 d . . .
H5A H 0.7057 0.4420 0.2314 0.030 Uiso 1 1 calc R . .
H5B H 0.8613 0.4439 0.2613 0.030 Uiso 1 1 calc R . .
C16 C 0.4710(4) 0.9160(3) 0.3427(2) 0.0382(9) Uani 1 1 d . . .
H16A H 0.5597 0.9662 0.3621 0.057 Uiso 1 1 calc R . .
H16B H 0.4443 0.8783 0.3947 0.057 Uiso 1 1 calc R . .
H16C H 0.4069 0.9737 0.3322 0.057 Uiso 1 1 calc R . .
C15 C 0.3345(3) 0.7403(3) 0.2081(3) 0.0376(8) Uani 1 1 d . . .
H15A H 0.2814 0.8033 0.1916 0.056 Uiso 1 1 calc R . .
H15B H 0.2933 0.7074 0.2584 0.056 Uiso 1 1 calc R . .
H15C H 0.3383 0.6674 0.1490 0.056 Uiso 1 1 calc R . .
C4 C 0.8382(4) 0.5499(3) 0.4609(2) 0.0334(8) Uani 1 1 d . . .
H4A H 0.7626 0.5365 0.4984 0.050 Uiso 1 1 calc R . .
H4B H 0.9188 0.5840 0.5062 0.050 Uiso 1 1 calc R . .
H4C H 0.8509 0.4667 0.4140 0.050 Uiso 1 1 calc R . .
Cl5 Cl 0.18476(9) 0.80146(7) 0.63352(6) 0.0347(2) Uani 1 1 d . . .
O3 O 0.1003(2) 0.7011(2) 0.40085(16) 0.0363(6) Uani 1 1 d . . .
H3WA H 0.1372 0.7274 0.4612 0.054 Uiso 1 1 d R . .
H3WB H 0.1425 0.6366 0.3810 0.054 Uiso 1 1 d R . .
O4 O 0.4740(3) 0.3794(2) 0.56341(18) 0.0526(7) Uani 1 1 d . . .
H4WA H 0.4869 0.3516 0.5025 0.079 Uiso 1 1 d R . .
H4WB H 0.4800 0.4700 0.5834 0.079 Uiso 1 1 d R . .
O5 O 0.5460(3) 0.3254(3) 0.37240(19) 0.0573(8) Uani 1 1 d . . .
H5WA H 0.6249 0.2847 0.3646 0.086 Uiso 1 1 d R . .
H5WB H 0.4935 0.2772 0.3231 0.086 Uiso 1 1 d R . .
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'
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'
Zn Zn 0.2839 1.4301 '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
Cl2 Zn1 Cl4 109.00(4) . . ?
Cl2 Zn1 Cl3 112.24(4) . . ?
Cl4 Zn1 Cl3 110.73(4) . . ?
Cl2 Zn1 Cl1 110.89(4) . . ?
Cl4 Zn1 Cl1 108.25(4) . . ?
Cl3 Zn1 Cl1 105.64(4) . . ?
N2 Co1 N5 172.83(10) . . ?
N2 Co1 N6 91.69(10) . . ?
N5 Co1 N6 84.13(10) . . ?
N2 Co1 N4 104.76(10) . . ?
N5 Co1 N4 79.96(10) . . ?
N6 Co1 N4 162.91(10) . . ?
N2 Co1 N1 80.37(10) . . ?
N5 Co1 N1 105.58(10) . . ?
N6 Co1 N1 92.68(10) . . ?
N4 Co1 N1 85.65(10) . . ?
N2 Co1 N3 83.97(10) . . ?
N5 Co1 N3 90.37(10) . . ?
N6 Co1 N3 92.35(10) . . ?
N4 Co1 N3 93.96(10) . . ?
N1 Co1 N3 163.68(10) . . ?
C2 N2 C5 125.3(2) . . ?
C2 N2 Co1 117.9(2) . . ?
C5 N2 Co1 116.09(18) . . ?
C14 N6 Co1 111.36(18) . . ?
C14 N6 H6A 109.4 . . ?
Co1 N6 H6A 109.4 . . ?
C14 N6 H6B 109.4 . . ?
Co1 N6 H6B 109.4 . . ?
H6A N6 H6B 108.0 . . ?
C6 N3 Co1 111.31(17) . . ?
C6 N3 H3A 109.4 . . ?
Co1 N3 H3A 109.4 . . ?
C6 N3 H3B 109.4 . . ?
Co1 N3 H3B 109.4 . . ?
H3A N3 H3B 108.0 . . ?
C1 N1 O1 113.9(2) . . ?
C1 N1 Co1 115.54(19) . . ?
O1 N1 Co1 130.57(18) . . ?
N4 O2 H2OX 109.5 . . ?
N1 O1 H1OX 109.5 . . ?
N5 C10 C9 112.9(3) . . ?
N5 C10 C12 125.6(3) . . ?
C9 C10 C12 121.5(3) . . ?
C10 N5 C13 125.0(3) . . ?
C10 N5 Co1 118.3(2) . . ?
C13 N5 Co1 115.60(19) . . ?
N1 C1 C2 112.7(2) . . ?
N1 C1 C3 124.6(3) . . ?
C2 C1 C3 122.7(3) . . ?
C9 N4 O2 114.3(2) . . ?
C9 N4 Co1 116.0(2) . . ?
O2 N4 Co1 129.51(18) . . ?
C13 C14 C15 111.0(3) . . ?
C13 C14 C16 111.3(3) . . ?
C15 C14 C16 110.2(3) . . ?
C13 C14 N6 105.5(2) . . ?
C15 C14 N6 109.2(3) . . ?
C16 C14 N6 109.5(2) . . ?
N2 C2 C1 113.2(3) . . ?
N2 C2 C4 126.5(3) . . ?
C1 C2 C4 120.3(2) . . ?
C6 C8 H8A 109.5 . . ?
C6 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
C6 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
C8 C6 N3 108.8(2) . . ?
C8 C6 C5 111.3(3) . . ?
N3 C6 C5 105.5(2) . . ?
C8 C6 C7 110.3(2) . . ?
N3 C6 C7 110.0(2) . . ?
C5 C6 C7 110.8(2) . . ?
N5 C13 C14 107.1(2) . . ?
N5 C13 H13A 110.3 . . ?
C14 C13 H13A 110.3 . . ?
N5 C13 H13B 110.3 . . ?
C14 C13 H13B 110.3 . . ?
H13A C13 H13B 108.6 . . ?
C9 C11 H11A 109.5 . . ?
C9 C11 H11B 109.5 . . ?
H11A C11 H11B 109.5 . . ?
C9 C11 H11C 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
N4 C9 C11 125.4(3) . . ?
N4 C9 C10 112.2(3) . . ?
C11 C9 C10 122.4(3) . . ?
C10 C12 H12A 109.5 . . ?
C10 C12 H12B 109.5 . . ?
H12A C12 H12B 109.5 . . ?
C10 C12 H12C 109.5 . . ?
H12A C12 H12C 109.5 . . ?
H12B C12 H12C 109.5 . . ?
C6 C7 H7A 109.5 . . ?
C6 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
C6 C7 H7C 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
C1 C3 H3C 109.5 . . ?
C1 C3 H3D 109.5 . . ?
H3C C3 H3D 109.5 . . ?
C1 C3 H3E 109.5 . . ?
H3C C3 H3E 109.5 . . ?
H3D C3 H3E 109.5 . . ?
N2 C5 C6 107.0(2) . . ?
N2 C5 H5A 110.3 . . ?
C6 C5 H5A 110.3 . . ?
N2 C5 H5B 110.3 . . ?
C6 C5 H5B 110.3 . . ?
H5A C5 H5B 108.6 . . ?
C14 C16 H16A 109.5 . . ?
C14 C16 H16B 109.5 . . ?
H16A C16 H16B 109.5 . . ?
C14 C16 H16C 109.5 . . ?
H16A C16 H16C 109.5 . . ?
H16B C16 H16C 109.5 . . ?
C14 C15 H15A 109.5 . . ?
C14 C15 H15B 109.5 . . ?
H15A C15 H15B 109.5 . . ?
C14 C15 H15C 109.5 . . ?
H15A C15 H15C 109.5 . . ?
H15B C15 H15C 109.5 . . ?
C2 C4 H4A 109.5 . . ?
C2 C4 H4B 109.5 . . ?
H4A C4 H4B 109.5 . . ?
C2 C4 H4C 109.5 . . ?
H4A C4 H4C 109.5 . . ?
H4B C4 H4C 109.5 . . ?
H3WA O3 H3WB 96.8 . . ?
H4WA O4 H4WB 110.4 . . ?
H5WA O5 H5WB 102.5 . . ?
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
Zn1 Cl2 2.2632(10) . ?
Zn1 Cl4 2.2715(10) . ?
Zn1 Cl3 2.2825(10) . ?
Zn1 Cl1 2.2899(10) . ?
Co1 N2 1.897(2) . ?
Co1 N5 1.898(2) . ?
Co1 N6 1.952(3) . ?
Co1 N4 1.957(2) . ?
Co1 N1 1.960(2) . ?
Co1 N3 1.964(2) . ?
N2 C2 1.286(4) . ?
N2 C5 1.479(4) . ?
N6 C14 1.532(4) . ?
N6 H6A 0.9200 . ?
N6 H6B 0.9200 . ?
N3 C6 1.525(4) . ?
N3 H3A 0.9200 . ?
N3 H3B 0.9200 . ?
N1 C1 1.298(4) . ?
N1 O1 1.378(3) . ?
O2 N4 1.378(3) . ?
O2 H2OX 0.8400 . ?
O1 H1OX 0.8400 . ?
C10 N5 1.280(4) . ?
C10 C9 1.488(4) . ?
C10 C12 1.498(4) . ?
N5 C13 1.466(4) . ?
C1 C2 1.483(4) . ?
C1 C3 1.493(4) . ?
N4 C9 1.298(4) . ?
C14 C13 1.520(4) . ?
C14 C15 1.520(4) . ?
C14 C16 1.529(4) . ?
C2 C4 1.494(4) . ?
C8 C6 1.518(4) . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C8 H8C 0.9800 . ?
C6 C5 1.531(4) . ?
C6 C7 1.536(4) . ?
C13 H13A 0.9900 . ?
C13 H13B 0.9900 . ?
C11 C9 1.481(4) . ?
C11 H11A 0.9800 . ?
C11 H11B 0.9800 . ?
C11 H11C 0.9800 . ?
C12 H12A 0.9800 . ?
C12 H12B 0.9800 . ?
C12 H12C 0.9800 . ?
C7 H7A 0.9800 . ?
C7 H7B 0.9800 . ?
C7 H7C 0.9800 . ?
C3 H3C 0.9800 . ?
C3 H3D 0.9800 . ?
C3 H3E 0.9800 . ?
C5 H5A 0.9900 . ?
C5 H5B 0.9900 . ?
C16 H16A 0.9800 . ?
C16 H16B 0.9800 . ?
C16 H16C 0.9800 . ?
C15 H15A 0.9800 . ?
C15 H15B 0.9800 . ?
C15 H15C 0.9800 . ?
C4 H4A 0.9800 . ?
C4 H4B 0.9800 . ?
C4 H4C 0.9800 . ?
O3 H3WA 0.8718 . ?
O3 H3WB 0.8445 . ?
O4 H4WA 0.8554 . ?
O4 H4WB 0.9306 . ?
O5 H5WA 0.9491 . ?
O5 H5WB 0.8585 . ?
