#
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
THM      THM 'THYMIDINE                           ' non-polymer        31  17 M
#
data_comp_THM
#
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
 THM           O5*    O    .         0.000
 THM           C5*    C    .         0.000
 THM           C4*    C    .         0.000
 THM           O4*    O    .         0.000
 THM           C3*    C    .         0.000
 THM           O3*    O    .         0.000
 THM           C2*    C    .         0.000
 THM           C1*    C    .         0.000
 THM           N1     N    .         0.000
 THM           C2     C    .         0.000
 THM           O2     O    .         0.000
 THM           N3     N    .         0.000
 THM           C4     C    .         0.000
 THM           O4     O    .         0.000
 THM           C5     C    .         0.000
 THM           C5M    C    .         0.000
 THM           C6     C    .         0.000
 THM           HO5*   H    .         0.000
 THM           H5*1   H    .         0.000
 THM           H5*2   H    .         0.000
 THM           H4*    H    .         0.000
 THM           H3*    H    .         0.000
 THM           HO3*   H    .         0.000
 THM           H2*1   H    .         0.000
 THM           H2*2   H    .         0.000
 THM           H1*    H    .         0.000
 THM           HN3    H    .         0.000
 THM           HM51   H    .         0.000
 THM           HM52   H    .         0.000
 THM           HM53   H    .         0.000
 THM           H6     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
 THM        O5*    C5*       single
 THM        O5*    HO5*      single
 THM        C5*    C4*       single
 THM        C5*    H5*1      single
 THM        C5*    H5*2      single
 THM        C4*    C3*       single
 THM        C4*    O4*       single
 THM        C4*    H4*       single
 THM        O4*    C1*       single
 THM        C3*    C2*       single
 THM        C3*    O3*       single
 THM        C3*    H3*       single
 THM        O3*    HO3*      single
 THM        C2*    C1*       single
 THM        C2*    H2*1      single
 THM        C2*    H2*2      single
 THM        C1*    N1        single
 THM        C1*    H1*       single
 THM        N1     C2        single
 THM        N1     C6        single
 THM        C2     O2        double
 THM        C2     N3        single
 THM        N3     C4        single
 THM        N3     HN3       single
 THM        C4     O4        double
 THM        C4     C5        single
 THM        C5     C6        double
 THM        C5     C5M       single
 THM        C5M    HM51      single
 THM        C5M    HM52      single
 THM        C5M    HM53      single
 THM        C6     H6        single