#
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
AGF      AGF 'O-(((1R)-((N-(PHENYL-METHOXY-CARBONY' non-polymer        57  32 M
#
data_comp_AGF
#
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
 AGF           C1     C    .         0.000
 AGF           O1     O    .         0.000
 AGF           O1A    O    .         0.000
 AGF           CB1    C    .         0.000
 AGF           CG1    C    .         0.000
 AGF           CD11   C    .         0.000
 AGF           CD12   C    .         0.000
 AGF           CE11   C    .         0.000
 AGF           CE12   C    .         0.000
 AGF           CZ1    C    .         0.000
 AGF           C2     C    .         0.000
 AGF           O2     O    .         0.000
 AGF           CA2    C    .         0.000
 AGF           CB2    C    .         0.000
 AGF           N2     N    .         0.000
 AGF           CA3    C    .         0.000
 AGF           N3     N    .         0.000
 AGF           P3     P    .         0.000
 AGF           O1P    O    .         0.000
 AGF           O2P    O    .         0.000
 AGF           O3P    O    .         0.000
 AGF           CA4    C    .         0.000
 AGF           C4     C    .         0.000
 AGF           O41    O    .         0.000
 AGF           O42    O    .         0.000
 AGF           CB4    C    .         0.000
 AGF           CG4    C    .         0.000
 AGF           CD41   C    .         0.000
 AGF           CD42   C    .         0.000
 AGF           CE41   C    .         0.000
 AGF           CE42   C    .         0.000
 AGF           CZ4    C    .         0.000
 AGF           HB11   H    .         0.000
 AGF           HB12   H    .         0.000
 AGF           HD11   H    .         0.000
 AGF           HD12   H    .         0.000
 AGF           HE11   H    .         0.000
 AGF           HE12   H    .         0.000
 AGF           HZ1    H    .         0.000
 AGF           HA2    H    .         0.000
 AGF           HB21   H    .         0.000
 AGF           HB22   H    .         0.000
 AGF           HB23   H    .         0.000
 AGF           HN2    H    .         0.000
 AGF           HA31   H    .         0.000
 AGF           HA32   H    .         0.000
 AGF           HN3    H    .         0.000
 AGF           HOP2   H    .         0.000
 AGF           HA4    H    .         0.000
 AGF           HO4    H    .         0.000
 AGF           HB41   H    .         0.000
 AGF           HB42   H    .         0.000
 AGF           HD41   H    .         0.000
 AGF           HD42   H    .         0.000
 AGF           HE41   H    .         0.000
 AGF           HE42   H    .         0.000
 AGF           HZ4    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
 AGF        C1     O1        double
 AGF        C1     O1A       single
 AGF        C1     N2        single
 AGF        O1A    CB1       single
 AGF        CB1    CG1       single
 AGF        CB1    HB11      single
 AGF        CB1    HB12      single
 AGF        CG1    CD11      double
 AGF        CG1    CD12      single
 AGF        CD11   CE11      single
 AGF        CD11   HD11      single
 AGF        CD12   CE12      double
 AGF        CD12   HD12      single
 AGF        CE11   CZ1       double
 AGF        CE11   HE11      single
 AGF        CE12   CZ1       single
 AGF        CE12   HE12      single
 AGF        CZ1    HZ1       single
 AGF        C2     CA2       single
 AGF        C2     O2        double
 AGF        C2     N3        single
 AGF        CA2    CB2       single
 AGF        CA2    N2        single
 AGF        CA2    HA2       single
 AGF        CB2    HB21      single
 AGF        CB2    HB22      single
 AGF        CB2    HB23      single
 AGF        N2     HN2       single
 AGF        CA3    P3        single
 AGF        CA3    N3        single
 AGF        CA3    HA31      single
 AGF        CA3    HA32      single
 AGF        N3     HN3       single
 AGF        P3     O1P       double
 AGF        P3     O2P       single
 AGF        P3     O3P       single
 AGF        O2P    HOP2      single
 AGF        O3P    CA4       single
 AGF        CA4    C4        single
 AGF        CA4    CB4       single
 AGF        CA4    HA4       single
 AGF        C4     O41       double
 AGF        C4     O42       single
 AGF        O42    HO4       single
 AGF        CB4    CG4       single
 AGF        CB4    HB41      single
 AGF        CB4    HB42      single
 AGF        CG4    CD41      double
 AGF        CG4    CD42      single
 AGF        CD41   CE41      single
 AGF        CD41   HD41      single
 AGF        CD42   CE42      double
 AGF        CD42   HD42      single
 AGF        CE41   CZ4       double
 AGF        CE41   HE41      single
 AGF        CE42   CZ4       single
 AGF        CE42   HE42      single
 AGF        CZ4    HZ4       single