#
data_comp_list
loop_
_chem_comp.id
_chem_comp.three_letter_code
_chem_comp.name
_chem_comp.group
_chem_comp.number_atoms_all
_chem_comp.number_atoms_nh
_chem_comp.desc_level
R56      R56 '5-OXO-6-PHENYLMETHANESULFONYLAMINO-H' non-polymer        59  31 M
#
data_comp_R56
#
loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.partial_charge
 R56           C1     C    .         0.000
 R56           C3     C    .         0.000
 R56           C5     C    .         0.000
 R56           C7     C    .         0.000
 R56           C8     C    .         0.000
 R56           C10    C    .         0.000
 R56           C12    C    .         0.000
 R56           S15    S    .         0.000
 R56           O16    O    .         0.000
 R56           O17    O    .         0.000
 R56           N18    N    .         0.000
 R56           C20    C    .         0.000
 R56           C22    C    .         0.000
 R56           O23    O    .         0.000
 R56           N24    N    .         0.000
 R56           C25    C    .         0.000
 R56           C27    C    .         0.000
 R56           C30    C    .         0.000
 R56           S33    S    .         0.000
 R56           C34    C    .         0.000
 R56           C37    C    .         0.000
 R56           C39    C    .         0.000
 R56           O40    O    .         0.000
 R56           N41    N    .         0.000
 R56           C43    C    .         0.000
 R56           C46    C    .         0.000
 R56           C49    C    .         0.000
 R56           N52    N    .         0.000
 R56           C54    C    .         0.000
 R56           N55    N    .         0.000
 R56           N58    N    .         0.000
 R56           H1     H    .         0.000
 R56           H3     H    .         0.000
 R56           H5     H    .         0.000
 R56           H8     H    .         0.000
 R56           H10    H    .         0.000
 R56           H121   H    .         0.000
 R56           H122   H    .         0.000
 R56           HNI    H    .         0.000
 R56           H20    H    .         0.000
 R56           H25    H    .         0.000
 R56           H271   H    .         0.000
 R56           H272   H    .         0.000
 R56           H301   H    .         0.000
 R56           H302   H    .         0.000
 R56           H341   H    .         0.000
 R56           H342   H    .         0.000
 R56           H37    H    .         0.000
 R56           HN     H    .         0.000
 R56           H431   H    .         0.000
 R56           H432   H    .         0.000
 R56           H461   H    .         0.000
 R56           H462   H    .         0.000
 R56           H491   H    .         0.000
 R56           H492   H    .         0.000
 R56           HN2    H    .         0.000
 R56           HN51   H    .         0.000
 R56           HN52   H    .         0.000
 R56           HN8    H    .         0.000
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
 R56        C1     C3        double
 R56        C1     C10       single
 R56        C1     H1        single
 R56        C3     C5        single
 R56        C3     H3        single
 R56        C5     C7        double
 R56        C5     H5        single
 R56        C7     C8        single
 R56        C7     C12       single
 R56        C8     C10       double
 R56        C8     H8        single
 R56        C10    H10       single
 R56        C12    S15       single
 R56        C12    H121      single
 R56        C12    H122      single
 R56        S15    O16       double
 R56        S15    O17       double
 R56        S15    N18       single
 R56        N18    C20       single
 R56        N18    HNI       single
 R56        C20    C22       single
 R56        C20    C30       single
 R56        C20    H20       single
 R56        C22    O23       double
 R56        C22    N24       single
 R56        N24    C25       single
 R56        N24    C37       single
 R56        C25    C27       single
 R56        C25    S33       single
 R56        C25    H25       single
 R56        C27    C30       single
 R56        C27    H271      single
 R56        C27    H272      single
 R56        C30    H301      single
 R56        C30    H302      single
 R56        S33    C34       single
 R56        C34    C37       single
 R56        C34    H341      single
 R56        C34    H342      single
 R56        C37    C39       single
 R56        C37    H37       single
 R56        C39    O40       double
 R56        C39    N41       single
 R56        N41    C43       single
 R56        N41    HN        single
 R56        C43    C46       single
 R56        C43    H431      single
 R56        C43    H432      single
 R56        C46    C49       single
 R56        C46    H461      single
 R56        C46    H462      single
 R56        C49    N52       single
 R56        C49    H491      single
 R56        C49    H492      single
 R56        N52    C54       single
 R56        N52    HN2       single
 R56        C54    N55       single
 R56        C54    N58       double
 R56        N55    HN51      single
 R56        N55    HN52      single
 R56        N58    HN8       single