#
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
FRD      FRD '1-METHYL-2-PHENYL-ETHYLAMINE GROUP  ' non-polymer        19  10 M
#
data_comp_FRD
#
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
 FRD           N      N    .         0.000
 FRD           CA     C    .         0.000
 FRD           C      C    .         0.000
 FRD           CB     C    .         0.000
 FRD           CG     C    .         0.000
 FRD           CD1    C    .         0.000
 FRD           CD2    C    .         0.000
 FRD           CE1    C    .         0.000
 FRD           CE2    C    .         0.000
 FRD           CZ     C    .         0.000
 FRD           H      H    .         0.000
 FRD           HA     H    .         0.000
 FRD           HB1    H    .         0.000
 FRD           HB2    H    .         0.000
 FRD           HD1    H    .         0.000
 FRD           HD2    H    .         0.000
 FRD           HE1    H    .         0.000
 FRD           HE2    H    .         0.000
 FRD           HZ     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
 FRD        N      CA        single
 FRD        N      H         single
 FRD        CA     C         single
 FRD        CA     CB        single
 FRD        CA     HA        single
 FRD        CB     CG        single
 FRD        CB     HB1       single
 FRD        CB     HB2       single
 FRD        CG     CD1       single
 FRD        CG     CD2       single
 FRD        CD1    CE1       single
 FRD        CD1    HD1       single
 FRD        CD2    CE2       single
 FRD        CD2    HD2       single
 FRD        CE1    CZ        single
 FRD        CE1    HE1       single
 FRD        CE2    CZ        single
 FRD        CE2    HE2       single
 FRD        CZ     HZ        single