#
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
AXP      AXP '4-ACETAMIDO-2,4-DIDEXOY-D-GLYCERO-BE' non-polymer        41  21 M
#
data_comp_AXP
#
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
 AXP           P1     P    .         0.000
 AXP           C2     C    .         0.000
 AXP           C3     C    .         0.000
 AXP           C4     C    .         0.000
 AXP           C5     C    .         0.000
 AXP           C6     C    .         0.000
 AXP           C7     C    .         0.000
 AXP           C8     C    .         0.000
 AXP           C9     C    .         0.000
 AXP           C10    C    .         0.000
 AXP           C11    C    .         0.000
 AXP           N5     N    .         0.000
 AXP           O1P    O    .         0.000
 AXP           O2P    O    .         0.000
 AXP           O3P    O    .         0.000
 AXP           O4     O    .         0.000
 AXP           O6     O    .         0.000
 AXP           O7     O    .         0.000
 AXP           O8     O    .         0.000
 AXP           O9     O    .         0.000
 AXP           O10    O    .         0.000
 AXP           H2     H    .         0.000
 AXP           H31    H    .         0.000
 AXP           H32    H    .         0.000
 AXP           H4     H    .         0.000
 AXP           H5     H    .         0.000
 AXP           H6     H    .         0.000
 AXP           H7     H    .         0.000
 AXP           H8     H    .         0.000
 AXP           H91    H    .         0.000
 AXP           H92    H    .         0.000
 AXP           H111   H    .         0.000
 AXP           H112   H    .         0.000
 AXP           H113   H    .         0.000
 AXP           HN5    H    .         0.000
 AXP           HO4    H    .         0.000
 AXP           HO7    H    .         0.000
 AXP           HO8    H    .         0.000
 AXP           HO9    H    .         0.000
 AXP           HOP2   H    .         0.000
 AXP           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
 AXP        P1     C2        single
 AXP        P1     O1P       double
 AXP        P1     O2P       single
 AXP        P1     O3P       single
 AXP        C2     C3        single
 AXP        C2     O6        single
 AXP        C2     H2        single
 AXP        C3     C4        single
 AXP        C3     H31       single
 AXP        C3     H32       single
 AXP        C4     C5        single
 AXP        C4     O4        single
 AXP        C4     H4        single
 AXP        C5     C6        single
 AXP        C5     N5        single
 AXP        C5     H5        single
 AXP        C6     C7        single
 AXP        C6     O6        single
 AXP        C6     H6        single
 AXP        C7     C8        single
 AXP        C7     O7        single
 AXP        C7     H7        single
 AXP        C8     C9        single
 AXP        C8     O8        single
 AXP        C8     H8        single
 AXP        C9     O9        single
 AXP        C9     H91       single
 AXP        C9     H92       single
 AXP        C10    C11       single
 AXP        C10    N5        single
 AXP        C10    O10       double
 AXP        C11    H111      single
 AXP        C11    H112      single
 AXP        C11    H113      single
 AXP        N5     HN5       single
 AXP        O2P    HOP2      single
 AXP        O3P    HOP3      single
 AXP        O4     HO4       single
 AXP        O7     HO7       single
 AXP        O8     HO8       single
 AXP        O9     HO9       single