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#$Date: 2016-02-16 22:30:59 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176467 $
#$URL: svn://www.crystallography.net/cod/cif/4/30/00/4300094.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_4300094
loop_
_publ_author_name
'Laurie A. Tyler'
'Juan C. Noveron'
'Marilyn M. Olmstead'
'Pradip K. Mascharak'
_publ_contact_author
; Pradip K. Mascharak
  Department of Chemistry and Biochemistry
  University of California
  Santa Cruz, CA 95064
  USA
;
_publ_contact_author_email       mascharak@chemistry.ucsc.edu
_publ_contact_author_fax         831-459-2935
_publ_contact_author_phone       831-459-4251
_publ_section_title
;
Co(III) Complexes with Coordinated Carboxamido Nitrogens and Thiolato
Sulfurs as Models for Co-Containing Nitrile Hydratase and Their Conversion
to the Corresponding Sulfinato Species
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              357
_journal_page_last               362
_journal_paper_doi               10.1021/ic990794m
_journal_volume                  39
_journal_year                    2000
_chemical_formula_sum            'C28 H29 Co N5 O2.5 S2'
_chemical_formula_weight         598.61
_chemical_name_common            (Me4N)[Co(PyPePS)2].0.5H2O
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-I 2ya'
_symmetry_space_group_name_H-M   'I 1 2/a 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                 93.54(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   17.442(4)
_cell_length_b                   11.375(2)
_cell_length_c                   28.162(6)
_cell_measurement_reflns_used    50
_cell_measurement_temperature    140(2)
_cell_measurement_theta_max      18.2
_cell_measurement_theta_min      5.4
_cell_volume                     5577(2)
_computing_cell_refinement       'Siemens P3'
_computing_data_collection       'Siemens P3'
_computing_data_reduction        'Siemens XDISK'
_computing_molecular_graphics    'SHELXTL 5, XP (Sheldrick, 1994)'
_computing_publication_material  'SHELX-97-2, CIFTAB (Sheldrick, 1998)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      140(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Siemens R3m/V'
_diffrn_measurement_method       ω
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'normal-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0411
_diffrn_reflns_av_sigmaI/netI    0.0889
_diffrn_reflns_limit_h_max       22
_diffrn_reflns_limit_h_min       -22
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       36
_diffrn_reflns_limit_l_min       0
_diffrn_reflns_number            6825
_diffrn_reflns_theta_full        27.49
_diffrn_reflns_theta_max         27.49
_diffrn_reflns_theta_min         1.45
_diffrn_standards_decay_%        <1.0
_diffrn_standards_interval_count 198
_diffrn_standards_number         2
_exptl_absorpt_coefficient_mu    0.802
_exptl_absorpt_correction_T_max  0.8690
_exptl_absorpt_correction_T_min  0.8065
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details
;
XABS2: an empirical absorption correction program. Parkin, S.;
Moezzi, B.; Hope, H. J. Appl. Cryst. 1995, 28, 53-56.
;
_exptl_crystal_colour            black
_exptl_crystal_density_diffrn    1.426
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       parallelepiped
_exptl_crystal_F_000             2488
_exptl_crystal_size_max          0.28
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.18
_refine_diff_density_max         0.357
_refine_diff_density_min         -0.368
_refine_diff_density_rms         0.079
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.985
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     352
_refine_ls_number_reflns         6399
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.985
_refine_ls_R_factor_all          0.1150
_refine_ls_R_factor_gt           0.0588
_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)+(0.0444P)²+7.3576P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1139
_refine_ls_wR_factor_ref         0.1388
_reflns_number_gt                3873
_reflns_number_total             6399
_reflns_threshold_expression     >2sigma(I)
_cod_original_cell_volume        5576.8(19)
_cod_original_sg_symbol_H-M      'I 2/a'
_cod_original_formula_sum        'C28 H29 Co N5 O2.50 S2'
_cod_database_code               4300094
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y, -z'
'x+1/2, y+1/2, z+1/2'
'-x+1, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y, z'
'-x+1/2, -y+1/2, -z+1/2'
'x, -y+1/2, z+1/2'
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 0.63437(3) 0.61455(5) 0.373010(19) 0.02865(15) Uani 1 1 d . . .
S1 S 0.64283(6) 0.72268(9) 0.30789(4) 0.0334(3) Uani 1 1 d . . .
S2 S 0.51009(7) 0.58197(10) 0.35570(4) 0.0405(3) Uani 1 1 d . . .
N1 N 0.6338(2) 0.5014(3) 0.42548(11) 0.0343(8) Uani 1 1 d . . .
N2 N 0.66481(19) 0.4810(3) 0.33736(11) 0.0295(8) Uani 1 1 d . . .
N3 N 0.73983(19) 0.6613(3) 0.39440(11) 0.0314(8) Uani 1 1 d . . .
N4 N 0.60670(19) 0.7492(3) 0.40942(11) 0.0300(7) Uani 1 1 d . . .
N5 N 0.5524(2) 0.0560(3) 0.30160(15) 0.0448(10) Uani 1 1 d . . .
O1 O 0.69428(19) 0.2818(2) 0.34660(11) 0.0444(8) Uani 1 1 d . . .
O2 O 0.66120(17) 0.9093(2) 0.45031(11) 0.0429(8) Uani 1 1 d . . .
O3 O 0.7500 1.0790(4) 0.5000 0.0595(14) Uani 1 2 d S . .
H3A H 0.7811 1.0340 0.5188 0.070 Uiso 1 1 d . . .
C1 C 0.6146(3) 0.5185(4) 0.47026(15) 0.0457(12) Uani 1 1 d . . .
H1 H 0.5993 0.5948 0.4796 0.055 Uiso 1 1 calc R . .
C2 C 0.6165(4) 0.4288(4) 0.50318(17) 0.0669(17) Uani 1 1 d . . .
H2 H 0.6009 0.4424 0.5344 0.080 Uiso 1 1 calc R . .
C3 C 0.6414(4) 0.3183(4) 0.49008(17) 0.0710(19) Uani 1 1 d . . .
H3 H 0.6448 0.2560 0.5126 0.085 Uiso 1 1 calc R . .
C4 C 0.6613(3) 0.2998(4) 0.44388(17) 0.0581(15) Uani 1 1 d . . .
H4 H 0.6781 0.2246 0.4341 0.070 Uiso 1 1 calc R . .
C5 C 0.6565(3) 0.3924(4) 0.41230(14) 0.0363(10) Uani 1 1 d . . .
C6 C 0.6744(2) 0.3793(4) 0.36137(14) 0.0340(9) Uani 1 1 d . . .
C7 C 0.6778(2) 0.4930(3) 0.28837(13) 0.0298(9) Uani 1 1 d . . .
C8 C 0.6957(2) 0.4020(4) 0.25775(14) 0.0327(9) Uani 1 1 d . . .
H8 H 0.7007 0.3238 0.2694 0.039 Uiso 1 1 calc R . .
C9 C 0.7064(2) 0.4258(4) 0.21011(15) 0.0378(10) Uani 1 1 d . . .
H9 H 0.7171 0.3633 0.1892 0.045 Uiso 1 1 calc R . .
C10 C 0.7013(2) 0.5399(4) 0.19306(15) 0.0377(10) Uani 1 1 d . . .
H10 H 0.7099 0.5555 0.1607 0.045 Uiso 1 1 calc R . .
C11 C 0.6840(2) 0.6309(4) 0.22285(14) 0.0348(10) Uani 1 1 d . . .
H11 H 0.6810 0.7090 0.2109 0.042 Uiso 1 1 calc R . .
C12 C 0.6706(2) 0.6095(3) 0.27062(13) 0.0277(8) Uani 1 1 d . . .
C13 C 0.8065(2) 0.6106(4) 0.38469(15) 0.0369(10) Uani 1 1 d . . .
H13 H 0.8055 0.5424 0.3652 0.044 Uiso 1 1 calc R . .
C14 C 0.8765(3) 0.6545(4) 0.40216(16) 0.0426(11) Uani 1 1 d . . .
H14 H 0.9229 0.6174 0.3945 0.051 Uiso 1 1 calc R . .
C15 C 0.8782(3) 0.7520(4) 0.43061(17) 0.0442(11) Uani 1 1 d . . .
H15 H 0.9258 0.7823 0.4436 0.053 Uiso 1 1 calc R . .
C16 C 0.8093(2) 0.8063(4) 0.44043(15) 0.0385(10) Uani 1 1 d . . .
H16 H 0.8093 0.8745 0.4599 0.046 Uiso 1 1 calc R . .
C17 C 0.7415(2) 0.7594(3) 0.42142(14) 0.0306(9) Uani 1 1 d . . .
C18 C 0.6647(2) 0.8138(3) 0.42865(14) 0.0320(9) Uani 1 1 d . . .
C19 C 0.5285(2) 0.7818(4) 0.40974(14) 0.0333(10) Uani 1 1 d . . .
C20 C 0.5002(3) 0.8786(4) 0.43478(16) 0.0405(10) Uani 1 1 d . . .
H20 H 0.5344 0.9260 0.4541 0.049 Uiso 1 1 calc R . .
C21 C 0.4223(3) 0.9042(5) 0.43101(17) 0.0511(13) Uani 1 1 d . . .
H21 H 0.4036 0.9701 0.4475 0.061 Uiso 1 1 calc R . .
C22 C 0.3714(3) 0.8352(5) 0.40358(17) 0.0526(14) Uani 1 1 d . . .
H22 H 0.3184 0.8549 0.4008 0.063 Uiso 1 1 calc R . .
C23 C 0.3978(3) 0.7371(5) 0.38001(16) 0.0456(12) Uani 1 1 d . . .
H23 H 0.3628 0.6894 0.3614 0.055 Uiso 1 1 calc R . .
C24 C 0.4756(2) 0.7088(4) 0.38368(14) 0.0364(10) Uani 1 1 d . . .
C25 C 0.6030(3) 0.0495(6) 0.26145(17) 0.0705(18) Uani 1 1 d . . .
H25A H 0.6413 0.1124 0.2645 0.106 Uiso 1 1 calc R . .
H25B H 0.5721 0.0587 0.2314 0.106 Uiso 1 1 calc R . .
H25C H 0.6290 -0.0269 0.2618 0.106 Uiso 1 1 calc R . .
C26 C 0.4926(3) -0.0389(4) 0.2957(2) 0.0587(15) Uani 1 1 d . . .
H26A H 0.4623 -0.0274 0.2655 0.088 Uiso 1 1 calc R . .
H26B H 0.4587 -0.0354 0.3221 0.088 Uiso 1 1 calc R . .
H26C H 0.5179 -0.1158 0.2955 0.088 Uiso 1 1 calc R . .
C27 C 0.5143(3) 0.1732(4) 0.3015(3) 0.088(2) Uani 1 1 d . . .
H27A H 0.4802 0.1773 0.3278 0.132 Uiso 1 1 calc R . .
H27B H 0.4843 0.1845 0.2713 0.132 Uiso 1 1 calc R . .
H27C H 0.5535 0.2349 0.3054 0.132 Uiso 1 1 calc R . .
C28 C 0.5993(3) 0.0362(4) 0.34667(16) 0.0481(12) Uani 1 1 d . . .
H28A H 0.5659 0.0366 0.3734 0.072 Uiso 1 1 calc R . .
H28B H 0.6377 0.0988 0.3511 0.072 Uiso 1 1 calc R . .
H28C H 0.6253 -0.0400 0.3453 0.072 Uiso 1 1 calc 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'
S S 0.1246 0.1234 '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
N2 Co1 N4 178.43(14) . . ?
N2 Co1 N1 83.60(14) . . ?
N4 Co1 N1 96.21(14) . . ?
N2 Co1 N3 95.20(14) . . ?
N4 Co1 N3 83.24(14) . . ?
N1 Co1 N3 89.71(14) . . ?
N2 Co1 S1 88.38(10) . . ?
N4 Co1 S1 91.77(10) . . ?
N1 Co1 S1 171.87(11) . . ?
N3 Co1 S1 89.69(10) . . ?
N2 Co1 S2 92.92(11) . . ?
N4 Co1 S2 88.64(11) . . ?
N1 Co1 S2 90.32(11) . . ?
N3 Co1 S2 171.83(10) . . ?
S1 Co1 S2 91.42(5) . . ?
C12 S1 Co1 97.06(13) . . ?
C24 S2 Co1 96.91(15) . . ?
C1 N1 C5 118.9(4) . . ?
C1 N1 Co1 128.9(3) . . ?
C5 N1 Co1 112.2(3) . . ?
C6 N2 C7 123.4(3) . . ?
C6 N2 Co1 116.6(3) . . ?
C7 N2 Co1 120.0(3) . . ?
C13 N3 C17 118.8(4) . . ?
C13 N3 Co1 128.7(3) . . ?
C17 N3 Co1 112.5(3) . . ?
C18 N4 C19 124.0(4) . . ?
C18 N4 Co1 116.5(3) . . ?
C19 N4 Co1 119.1(3) . . ?
C25 N5 C28 108.9(4) . . ?
C25 N5 C27 109.3(4) . . ?
C28 N5 C27 111.1(4) . . ?
C25 N5 C26 108.7(4) . . ?
C28 N5 C26 109.1(4) . . ?
C27 N5 C26 109.7(3) . . ?
N1 C1 C2 121.9(4) . . ?
N1 C1 H1 119.0 . . ?
C2 C1 H1 119.0 . . ?
C1 C2 C3 119.1(5) . . ?
C1 C2 H2 120.4 . . ?
C3 C2 H2 120.4 . . ?
C4 C3 C2 119.3(5) . . ?
C4 C3 H3 120.4 . . ?
C2 C3 H3 120.4 . . ?
C5 C4 C3 118.8(5) . . ?
C5 C4 H4 120.6 . . ?
C3 C4 H4 120.6 . . ?
N1 C5 C4 121.9(4) . . ?
N1 C5 C6 115.8(3) . . ?
C4 C5 C6 122.3(4) . . ?
O1 C6 N2 128.9(4) . . ?
O1 C6 C5 119.4(4) . . ?
N2 C6 C5 111.7(3) . . ?
C8 C7 N2 125.8(4) . . ?
C8 C7 C12 119.6(4) . . ?
N2 C7 C12 114.7(3) . . ?
C9 C8 C7 120.0(4) . . ?
C9 C8 H8 120.0 . . ?
C7 C8 H8 120.0 . . ?
C10 C9 C8 120.4(4) . . ?
C10 C9 H9 119.8 . . ?
C8 C9 H9 119.8 . . ?
C11 C10 C9 120.3(4) . . ?
C11 C10 H10 119.8 . . ?
C9 C10 H10 119.8 . . ?
C10 C11 C12 120.6(4) . . ?
C10 C11 H11 119.7 . . ?
C12 C11 H11 119.7 . . ?
C11 C12 C7 119.0(4) . . ?
C11 C12 S1 121.1(3) . . ?
C7 C12 S1 119.8(3) . . ?
N3 C13 C14 122.0(4) . . ?
N3 C13 H13 119.0 . . ?
C14 C13 H13 119.0 . . ?
C15 C14 C13 119.3(4) . . ?
C15 C14 H14 120.4 . . ?
C13 C14 H14 120.4 . . ?
C14 C15 C16 119.2(4) . . ?
C14 C15 H15 120.4 . . ?
C16 C15 H15 120.4 . . ?
C17 C16 C15 118.8(4) . . ?
C17 C16 H16 120.6 . . ?
C15 C16 H16 120.6 . . ?
N3 C17 C16 121.8(4) . . ?
N3 C17 C18 115.4(4) . . ?
C16 C17 C18 122.8(4) . . ?
O2 C18 N4 128.1(4) . . ?
O2 C18 C17 119.6(4) . . ?
N4 C18 C17 112.2(3) . . ?
C24 C19 C20 118.7(4) . . ?
C24 C19 N4 116.2(4) . . ?
C20 C19 N4 125.0(4) . . ?
C21 C20 C19 119.7(5) . . ?
C21 C20 H20 120.1 . . ?
C19 C20 H20 120.1 . . ?
C22 C21 C20 121.0(5) . . ?
C22 C21 H21 119.5 . . ?
C20 C21 H21 119.5 . . ?
C21 C22 C23 120.1(5) . . ?
C21 C22 H22 119.9 . . ?
C23 C22 H22 119.9 . . ?
C22 C23 C24 120.0(5) . . ?
C22 C23 H23 120.0 . . ?
C24 C23 H23 120.0 . . ?
C23 C24 C19 120.4(4) . . ?
C23 C24 S2 120.8(4) . . ?
C19 C24 S2 118.8(3) . . ?
N5 C25 H25A 109.5 . . ?
N5 C25 H25B 109.5 . . ?
H25A C25 H25B 109.5 . . ?
N5 C25 H25C 109.5 . . ?
H25A C25 H25C 109.5 . . ?
H25B C25 H25C 109.5 . . ?
N5 C26 H26A 109.5 . . ?
N5 C26 H26B 109.5 . . ?
H26A C26 H26B 109.5 . . ?
N5 C26 H26C 109.5 . . ?
H26A C26 H26C 109.5 . . ?
H26B C26 H26C 109.5 . . ?
N5 C27 H27A 109.5 . . ?
N5 C27 H27B 109.5 . . ?
H27A C27 H27B 109.5 . . ?
N5 C27 H27C 109.5 . . ?
H27A C27 H27C 109.5 . . ?
H27B C27 H27C 109.5 . . ?
N5 C28 H28A 109.5 . . ?
N5 C28 H28B 109.5 . . ?
H28A C28 H28B 109.5 . . ?
N5 C28 H28C 109.5 . . ?
H28A C28 H28C 109.5 . . ?
H28B C28 H28C 109.5 . . ?
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
Co1 N2 1.914(3) . ?
Co1 N4 1.921(3) . ?
Co1 N1 1.960(3) . ?
Co1 N3 1.973(3) . ?
Co1 S1 2.2207(12) . ?
Co1 S2 2.2233(13) . ?
S1 C12 1.749(4) . ?
S2 C24 1.767(5) . ?
N1 C1 1.339(5) . ?
N1 C5 1.359(5) . ?
N2 C6 1.345(5) . ?
N2 C7 1.418(5) . ?
N3 C13 1.341(5) . ?
N3 C17 1.350(5) . ?
N4 C18 1.337(5) . ?
N4 C19 1.414(5) . ?
N5 C25 1.478(6) . ?
N5 C28 1.484(5) . ?
N5 C27 1.489(6) . ?
N5 C26 1.503(5) . ?
O1 C6 1.241(5) . ?
O2 C18 1.250(5) . ?
O3 H3A 0.8948 . ?
C1 C2 1.378(6) . ?
C1 H1 0.9500 . ?
C2 C3 1.387(7) . ?
C2 H2 0.9500 . ?
C3 C4 1.383(6) . ?
C3 H3 0.9500 . ?
C4 C5 1.378(6) . ?
C4 H4 0.9500 . ?
C5 C6 1.494(6) . ?
C7 C8 1.396(5) . ?
C7 C12 1.418(5) . ?
C8 C9 1.392(5) . ?
C8 H8 0.9500 . ?
C9 C10 1.385(6) . ?
C9 H9 0.9500 . ?
C10 C11 1.378(6) . ?
C10 H10 0.9500 . ?
C11 C12 1.401(5) . ?
C11 H11 0.9500 . ?
C13 C14 1.381(6) . ?
C13 H13 0.9500 . ?
C14 C15 1.367(6) . ?
C14 H14 0.9500 . ?
C15 C16 1.393(6) . ?
C15 H15 0.9500 . ?
C16 C17 1.376(6) . ?
C16 H16 0.9500 . ?
C17 C18 1.501(6) . ?
C19 C24 1.413(6) . ?
C19 C20 1.413(6) . ?
C20 C21 1.388(6) . ?
C20 H20 0.9500 . ?
C21 C22 1.384(7) . ?
C21 H21 0.9500 . ?
C22 C23 1.392(7) . ?
C22 H22 0.9500 . ?
C23 C24 1.392(6) . ?
C23 H23 0.9500 . ?
C25 H25A 0.9800 . ?
C25 H25B 0.9800 . ?
C25 H25C 0.9800 . ?
C26 H26A 0.9800 . ?
C26 H26B 0.9800 . ?
C26 H26C 0.9800 . ?
C27 H27A 0.9800 . ?
C27 H27B 0.9800 . ?
C27 H27C 0.9800 . ?
C28 H28A 0.9800 . ?
C28 H28B 0.9800 . ?
C28 H28C 0.9800 . ?
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
O3 H3A O2 0.89 1.92 2.795(4) 166.8 2_656
