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
DMF      DMF 'DIMETHYLFORMAMIDE                   ' non-polymer        12   5 .
# ------------------------------------------------------
# ------------------------------------------------------
#
# --- DESCRIPTION OF MONOMERS ---
#
data_comp_DMF
#
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
 DMF           O      O    O         0.000      0.000    0.000    0.000
 DMF           C      C    C1        0.000     -1.212    0.000   -0.056
 DMF           HC     H    H         0.000     -1.707    0.000   -1.012
 DMF           N      N    N         0.000     -1.938    0.000    1.079
 DMF           C2     C    CH3       0.000     -1.265    0.000    2.379
 DMF           H23    H    H         0.000     -1.546    0.865    2.924
 DMF           H22    H    H         0.000     -1.546   -0.865    2.924
 DMF           H21    H    H         0.000     -0.215    0.000    2.236
 DMF           C1     C    CH3       0.000     -3.401    0.000    1.011
 DMF           H13    H    H         0.000     -3.803    0.000    1.992
 DMF           H12    H    H         0.000     -3.733    0.865    0.496
 DMF           H11    H    H         0.000     -3.733   -0.865    0.496
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
 DMF      O      n/a    C      START
 DMF      C      O      N      .
 DMF      HC     C      .      .
 DMF      N      C      C1     .
 DMF      C2     N      H21    .
 DMF      H23    C2     .      .
 DMF      H22    C2     .      .
 DMF      H21    C2     .      .
 DMF      C1     N      H11    .
 DMF      H13    C1     .      .
 DMF      H12    C1     .      .
 DMF      H11    C1     .      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
 DMF      C1     N         single      1.455    0.020
 DMF      H11    C1        single      1.059    0.020
 DMF      H12    C1        single      1.059    0.020
 DMF      H13    C1        single      1.059    0.020
 DMF      C2     N         single      1.455    0.020
 DMF      H21    C2        single      1.059    0.020
 DMF      H22    C2        single      1.059    0.020
 DMF      H23    C2        single      1.059    0.020
 DMF      C      O         double      1.220    0.020
 DMF      N      C         single      1.260    0.020
 DMF      HC     C         single      1.077    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
 DMF      O      C      HC      123.000    3.000
 DMF      O      C      N       120.000    3.000
 DMF      HC     C      N       120.000    3.000
 DMF      C      N      C2      120.000    3.000
 DMF      C      N      C1      120.000    3.000
 DMF      C2     N      C1      120.000    3.000
 DMF      N      C2     H23     109.470    3.000
 DMF      N      C2     H22     109.470    3.000
 DMF      N      C2     H21     109.470    3.000
 DMF      H23    C2     H22     109.470    3.000
 DMF      H23    C2     H21     109.470    3.000
 DMF      H22    C2     H21     109.470    3.000
 DMF      N      C1     H13     109.470    3.000
 DMF      N      C1     H12     109.470    3.000
 DMF      N      C1     H11     109.470    3.000
 DMF      H13    C1     H12     109.470    3.000
 DMF      H13    C1     H11     109.470    3.000
 DMF      H12    C1     H11     109.470    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
 DMF      var_1    O      C      N      C1       180.000   20.000   1
 DMF      var_2    C      N      C2     H21        0.000   20.000   1
 DMF      var_3    C      N      C1     H11       60.002   20.000   1
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
 DMF      plan-1    C         0.020
 DMF      plan-1    O         0.020
 DMF      plan-1    N         0.020
 DMF      plan-1    HC        0.020
 DMF      plan-2    N         0.020
 DMF      plan-2    C1        0.020
 DMF      plan-2    C2        0.020
 DMF      plan-2    C         0.020
 DMF      plan-2    HC        0.020
# ------------------------------------------------------
