#
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
ACH      ACH 'ACETYLCHOLINE                       ' non-polymer        26  10 M
#
data_comp_ACH
#
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
 ACH           N1     N    .         1.000
 ACH           C2     C    .         0.000
 ACH           C3     C    .         0.000
 ACH           O4     O    .         0.000
 ACH           C5     C    .         0.000
 ACH           O7     O    .         0.000
 ACH           C6     C    .         0.000
 ACH           C8     C    .         0.000
 ACH           C9     C    .         0.000
 ACH           C10    C    .         0.000
 ACH           H21    H    .         0.000
 ACH           H22    H    .         0.000
 ACH           H31    H    .         0.000
 ACH           H32    H    .         0.000
 ACH           H61    H    .         0.000
 ACH           H62    H    .         0.000
 ACH           H63    H    .         0.000
 ACH           H81    H    .         0.000
 ACH           H82    H    .         0.000
 ACH           H83    H    .         0.000
 ACH           H91    H    .         0.000
 ACH           H92    H    .         0.000
 ACH           H93    H    .         0.000
 ACH           H101   H    .         0.000
 ACH           H102   H    .         0.000
 ACH           H103   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
 ACH        N1     C2        single
 ACH        N1     C8        single
 ACH        N1     C9        single
 ACH        N1     C10       single
 ACH        C2     C3        single
 ACH        C2     H21       single
 ACH        C2     H22       single
 ACH        C3     O4        single
 ACH        C3     H31       single
 ACH        C3     H32       single
 ACH        O4     C5        single
 ACH        C5     C6        single
 ACH        C5     O7        double
 ACH        C6     H61       single
 ACH        C6     H62       single
 ACH        C6     H63       single
 ACH        C8     H81       single
 ACH        C8     H82       single
 ACH        C8     H83       single
 ACH        C9     H91       single
 ACH        C9     H92       single
 ACH        C9     H93       single
 ACH        C10    H101      single
 ACH        C10    H102      single
 ACH        C10    H103      single