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
MTF      MTF 'N-METHYLTHIOFORMAMIDE               ' non-polymer         9   4 .
# ------------------------------------------------------
# ------------------------------------------------------
#
# --- DESCRIPTION OF MONOMERS ---
#
data_comp_MTF
#
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
 MTF           S      S    S1        0.000      0.000    0.000    0.000
 MTF           C      C    C1        0.000     -1.598    0.000   -0.039
 MTF           H      H    H         0.000     -2.114    0.000   -0.984
 MTF           N      N    NH1       0.000     -2.299    0.000    1.111
 MTF           HN     H    H         0.000     -3.309    0.000    1.086
 MTF           CM     C    CH3       0.000     -1.599    0.000    2.397
 MTF           HM3    H    H         0.000     -0.990   -0.865    2.471
 MTF           HM2    H    H         0.000     -0.990    0.865    2.471
 MTF           HM1    H    H         0.000     -2.306    0.000    3.187
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
 MTF      S      n/a    C      START
 MTF      C      S      N      .
 MTF      H      C      .      .
 MTF      N      C      CM     .
 MTF      HN     N      .      .
 MTF      CM     N      HM1    .
 MTF      HM3    CM     .      .
 MTF      HM2    CM     .      .
 MTF      HM1    CM     .      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
 MTF      C      S         double      1.565    0.020
 MTF      N      C         single      1.330    0.020
 MTF      H      C         single      1.077    0.020
 MTF      CM     N         single      1.450    0.020
 MTF      HN     N         single      1.010    0.020
 MTF      HM1    CM        single      1.059    0.020
 MTF      HM2    CM        single      1.059    0.020
 MTF      HM3    CM        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
 MTF      S      C      H       120.000    3.000
 MTF      S      C      N       120.000    3.000
 MTF      H      C      N       120.000    3.000
 MTF      C      N      HN      120.000    3.000
 MTF      C      N      CM      120.000    3.000
 MTF      HN     N      CM      118.500    3.000
 MTF      N      CM     HM3     109.470    3.000
 MTF      N      CM     HM2     109.470    3.000
 MTF      N      CM     HM1     109.470    3.000
 MTF      HM3    CM     HM2     109.470    3.000
 MTF      HM3    CM     HM1     109.470    3.000
 MTF      HM2    CM     HM1     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
 MTF      var_1    S      C      N      CM         0.000   20.000   1
 MTF      var_2    C      N      CM     HM1      180.000   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
 MTF      plan-1    C         0.020
 MTF      plan-1    S         0.020
 MTF      plan-1    N         0.020
 MTF      plan-1    H         0.020
 MTF      plan-1    HN        0.020
 MTF      plan-2    N         0.020
 MTF      plan-2    C         0.020
 MTF      plan-2    CM        0.020
 MTF      plan-2    HN        0.020
 MTF      plan-2    H         0.020
# ------------------------------------------------------
