#
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
ALM      ALM '3-AMINO-BUTAN-2-ONE                 ' non-polymer        15   6 M
#
data_comp_ALM
#
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
 ALM           N      N    .         0.000
 ALM           CA     C    .         0.000
 ALM           C      C    .         0.000
 ALM           O      O    .         0.000
 ALM           CB     C    .         0.000
 ALM           CM     C    .         0.000
 ALM           HN1    H    .         0.000
 ALM           HN2    H    .         0.000
 ALM           HA     H    .         0.000
 ALM           HB1    H    .         0.000
 ALM           HB2    H    .         0.000
 ALM           HB3    H    .         0.000
 ALM           HM1    H    .         0.000
 ALM           HM2    H    .         0.000
 ALM           HM3    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
 ALM        N      CA        single
 ALM        N      HN1       single
 ALM        N      HN2       single
 ALM        CA     C         single
 ALM        CA     CB        single
 ALM        CA     HA        single
 ALM        C      O         double
 ALM        C      CM        single
 ALM        CB     HB1       single
 ALM        CB     HB2       single
 ALM        CB     HB3       single
 ALM        CM     HM1       single
 ALM        CM     HM2       single
 ALM        CM     HM3       single