#
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
W56      W56 '5-(5-(4-(5-HYDRO-4-METHYL-2-OXAZOLYL' non-polymer        48  24 M
#
data_comp_W56
#
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
 W56           O1     O    .         0.000
 W56           N2     N    .         0.000
 W56           C3     C    .         0.000
 W56           C31    C    .         0.000
 W56           C4     C    .         0.000
 W56           C5     C    .         0.000
 W56           C1C    C    .         0.000
 W56           C2C    C    .         0.000
 W56           C3C    C    .         0.000
 W56           C4C    C    .         0.000
 W56           C5C    C    .         0.000
 W56           O1B    O    .         0.000
 W56           C1B    C    .         0.000
 W56           C2B    C    .         0.000
 W56           C3B    C    .         0.000
 W56           C4B    C    .         0.000
 W56           C5B    C    .         0.000
 W56           C6B    C    .         0.000
 W56           C2A    C    .         0.000
 W56           N3A    N    .         0.000
 W56           C4A    C    .         0.000
 W56           CM1    C    .         0.000
 W56           C5A    C    .         0.000
 W56           O1A    O    .         0.000
 W56           H4     H    .         0.000
 W56           H311   H    .         0.000
 W56           H312   H    .         0.000
 W56           H313   H    .         0.000
 W56           H1C1   H    .         0.000
 W56           H1C2   H    .         0.000
 W56           H2C1   H    .         0.000
 W56           H2C2   H    .         0.000
 W56           H3C1   H    .         0.000
 W56           H3C2   H    .         0.000
 W56           H4C1   H    .         0.000
 W56           H4C2   H    .         0.000
 W56           H5C1   H    .         0.000
 W56           H5C2   H    .         0.000
 W56           H2B    H    .         0.000
 W56           H3B    H    .         0.000
 W56           H5B    H    .         0.000
 W56           H6B    H    .         0.000
 W56           H4A    H    .         0.000
 W56           H5A1   H    .         0.000
 W56           H5A2   H    .         0.000
 W56           HM11   H    .         0.000
 W56           HM12   H    .         0.000
 W56           HM13   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
 W56        O1     N2        single
 W56        O1     C5        single
 W56        N2     C3        double
 W56        C3     C31       single
 W56        C3     C4        single
 W56        C31    H311      single
 W56        C31    H312      single
 W56        C31    H313      single
 W56        C4     C5        double
 W56        C4     H4        single
 W56        C5     C1C       single
 W56        C1C    C2C       single
 W56        C1C    H1C1      single
 W56        C1C    H1C2      single
 W56        C2C    C3C       single
 W56        C2C    H2C1      single
 W56        C2C    H2C2      single
 W56        C3C    C4C       single
 W56        C3C    H3C1      single
 W56        C3C    H3C2      single
 W56        C4C    C5C       single
 W56        C4C    H4C1      single
 W56        C4C    H4C2      single
 W56        C5C    O1B       single
 W56        C5C    H5C1      single
 W56        C5C    H5C2      single
 W56        O1B    C1B       single
 W56        C1B    C2B       double
 W56        C1B    C6B       single
 W56        C2B    C3B       single
 W56        C2B    H2B       single
 W56        C3B    C4B       double
 W56        C3B    H3B       single
 W56        C4B    C5B       single
 W56        C4B    C2A       single
 W56        C5B    C6B       double
 W56        C5B    H5B       single
 W56        C6B    H6B       single
 W56        C2A    N3A       double
 W56        C2A    O1A       single
 W56        N3A    C4A       single
 W56        C4A    CM1       single
 W56        C4A    C5A       single
 W56        C4A    H4A       single
 W56        CM1    HM11      single
 W56        CM1    HM12      single
 W56        CM1    HM13      single
 W56        C5A    O1A       single
 W56        C5A    H5A1      single
 W56        C5A    H5A2      single