#
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
ADN      ADN 'ADENOSINE                           ' non-polymer        32  19 M
#
data_comp_ADN
#
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
 ADN           O5*    O    .         0.000
 ADN           C5*    C    .         0.000
 ADN           C4*    C    .         0.000
 ADN           O4*    O    .         0.000
 ADN           C3*    C    .         0.000
 ADN           O3*    O    .         0.000
 ADN           C2*    C    .         0.000
 ADN           O2*    O    .         0.000
 ADN           C1*    C    .         0.000
 ADN           N9     N    .         0.000
 ADN           C8     C    .         0.000
 ADN           N7     N    .         0.000
 ADN           C5     C    .         0.000
 ADN           C6     C    .         0.000
 ADN           N6     N    .         0.000
 ADN           N1     N    .         0.000
 ADN           C2     C    .         0.000
 ADN           N3     N    .         0.000
 ADN           C4     C    .         0.000
 ADN           HO5*   H    .         0.000
 ADN           H5*1   H    .         0.000
 ADN           H5*2   H    .         0.000
 ADN           H4*    H    .         0.000
 ADN           H3*    H    .         0.000
 ADN           HO3*   H    .         0.000
 ADN           H2*    H    .         0.000
 ADN           HO2*   H    .         0.000
 ADN           H1*    H    .         0.000
 ADN           H8     H    .         0.000
 ADN           H2     H    .         0.000
 ADN           HN61   H    .         0.000
 ADN           HN62   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
 ADN        O5*    C5*       single
 ADN        O5*    HO5*      single
 ADN        C5*    C4*       single
 ADN        C5*    H5*1      single
 ADN        C5*    H5*2      single
 ADN        C4*    O4*       single
 ADN        C4*    C3*       single
 ADN        C4*    H4*       single
 ADN        O4*    C1*       single
 ADN        C3*    O3*       single
 ADN        C3*    C2*       single
 ADN        C3*    H3*       single
 ADN        O3*    HO3*      single
 ADN        C2*    O2*       single
 ADN        C2*    C1*       single
 ADN        C2*    H2*       single
 ADN        O2*    HO2*      single
 ADN        C1*    N9        single
 ADN        C1*    H1*       single
 ADN        N9     C8        single
 ADN        N9     C4        single
 ADN        C8     N7        double
 ADN        C8     H8        single
 ADN        N7     C5        single
 ADN        C5     C6        single
 ADN        C5     C4        double
 ADN        C6     N6        single
 ADN        C6     N1        double
 ADN        N6     HN61      single
 ADN        N6     HN62      single
 ADN        N1     C2        single
 ADN        C2     N3        double
 ADN        C2     H2        single
 ADN        N3     C4        single