global_
_lib_name         ?
_lib_version      ?
_lib_update       ?
# ------------------------------------------------
#
# ---   LIST OF MONOMERS ---
#
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
ACM      ACM 'ACETAMIDE                           ' non-polymer         9   4 .
# ------------------------------------------------------
# ------------------------------------------------------
#
# --- DESCRIPTION OF MONOMERS ---
#
data_comp_ACM
#
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
_chem_comp_atom.x
_chem_comp_atom.y
_chem_comp_atom.z
 ACM           O      O    O         0.000      0.000    0.000    0.000
 ACM           C1     C    C         0.000     -1.209    0.000    0.103
 ACM           C2     C    CH3       0.000     -1.847    0.000    1.467
 ACM           H23    H    H         0.000     -2.449    0.865    1.576
 ACM           H22    H    H         0.000     -2.449   -0.865    1.576
 ACM           H21    H    H         0.000     -1.093    0.000    2.211
 ACM           N      N    NH2       0.000     -1.979    0.000   -1.002
 ACM           HN2    H    H         0.000     -2.988    0.000   -0.921
 ACM           HN1    H    H         0.000     -1.553    0.000   -1.922
loop_
_chem_comp_tree.comp_id
_chem_comp_tree.atom_id
_chem_comp_tree.atom_back
_chem_comp_tree.atom_forward
_chem_comp_tree.connect_type
 ACM      O      n/a    C1     START
 ACM      C1     O      N      .
 ACM      C2     C1     H21    .
 ACM      H23    C2     .      .
 ACM      H22    C2     .      .
 ACM      H21    C2     .      .
 ACM      N      C1     HN1    .
 ACM      HN2    N      .      .
 ACM      HN1    N      .      END
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
 ACM      C1     O         double      1.220    0.020
 ACM      N      C1        single      1.332    0.020
 ACM      C2     C1        single      1.500    0.020
 ACM      HN1    N         single      1.010    0.020
 ACM      HN2    N         single      1.010    0.020
 ACM      H21    C2        single      1.059    0.020
 ACM      H22    C2        single      1.059    0.020
 ACM      H23    C2        single      1.059    0.020
loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
 ACM      O      C1     C2      123.000    3.000
 ACM      O      C1     N       123.000    3.000
 ACM      C2     C1     N       120.000    3.000
 ACM      C1     C2     H23     109.470    3.000
 ACM      C1     C2     H22     109.470    3.000
 ACM      C1     C2     H21     109.470    3.000
 ACM      H23    C2     H22     109.470    3.000
 ACM      H23    C2     H21     109.470    3.000
 ACM      H22    C2     H21     109.470    3.000
 ACM      C1     N      HN2     120.000    3.000
 ACM      C1     N      HN1     120.000    3.000
 ACM      HN2    N      HN1     120.000    3.000
loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
 ACM      var_1    O      C1     C2     H21        0.000   20.000   1
 ACM      CONST_1  O      C1     N      HN1        0.000    0.000   0
loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
 ACM      plan-1    C1        0.020
 ACM      plan-1    O         0.020
 ACM      plan-1    N         0.020
 ACM      plan-1    C2        0.020
 ACM      plan-1    HN2       0.020
 ACM      plan-1    HN1       0.020
 ACM      plan-2    N         0.020
 ACM      plan-2    C1        0.020
 ACM      plan-2    HN1       0.020
 ACM      plan-2    HN2       0.020
# ------------------------------------------------------
