#
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
A23      A23 'ADENOSINE-5"-PHOSPHATE-2",3"-CYCLIC ' non-polymer        39  26 M
#
data_comp_A23
#
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
 A23           PC     P    .         0.000
 A23           O1C    O    .         0.000
 A23           O2C    O    .         0.000
 A23           P      P    .         0.000
 A23           O1P    O    .         0.000
 A23           O2P    O    .         0.000
 A23           O3P    O    .         0.000
 A23           O5*    O    .         0.000
 A23           C5*    C    .         0.000
 A23           C4*    C    .         0.000
 A23           O4*    O    .         0.000
 A23           C3*    C    .         0.000
 A23           O3*    O    .         0.000
 A23           C2*    C    .         0.000
 A23           O2*    O    .         0.000
 A23           C1*    C    .         0.000
 A23           N9     N    .         0.000
 A23           C8     C    .         0.000
 A23           N7     N    .         0.000
 A23           C5     C    .         0.000
 A23           C6     C    .         0.000
 A23           N6     N    .         0.000
 A23           N1     N    .         0.000
 A23           C2     C    .         0.000
 A23           N3     N    .         0.000
 A23           C4     C    .         0.000
 A23           H5*1   H    .         0.000
 A23           H5*2   H    .         0.000
 A23           H4*    H    .         0.000
 A23           H3*    H    .         0.000
 A23           H2*    H    .         0.000
 A23           H1*    H    .         0.000
 A23           H8     H    .         0.000
 A23           HN61   H    .         0.000
 A23           HN62   H    .         0.000
 A23           H2     H    .         0.000
 A23           HOC2   H    .         0.000
 A23           HOP2   H    .         0.000
 A23           HOP3   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
 A23        PC     O1C       double
 A23        PC     O2C       single
 A23        PC     O3*       single
 A23        PC     O2*       single
 A23        O2C    HOC2      single
 A23        P      O1P       double
 A23        P      O2P       single
 A23        P      O3P       single
 A23        P      O5*       single
 A23        O2P    HOP2      single
 A23        O3P    HOP3      single
 A23        O5*    C5*       single
 A23        C5*    C4*       single
 A23        C5*    H5*1      single
 A23        C5*    H5*2      single
 A23        C4*    O4*       single
 A23        C4*    C3*       single
 A23        C4*    H4*       single
 A23        O4*    C1*       single
 A23        C3*    O3*       single
 A23        C3*    C2*       single
 A23        C3*    H3*       single
 A23        C2*    O2*       single
 A23        C2*    C1*       single
 A23        C2*    H2*       single
 A23        C1*    N9        single
 A23        C1*    H1*       single
 A23        N9     C8        single
 A23        N9     C4        single
 A23        C8     N7        double
 A23        C8     H8        single
 A23        N7     C5        single
 A23        C5     C6        single
 A23        C5     C4        double
 A23        C6     N6        single
 A23        C6     N1        double
 A23        N6     HN61      single
 A23        N6     HN62      single
 A23        N1     C2        single
 A23        C2     N3        double
 A23        C2     H2        single
 A23        N3     C4        single