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
LOM      LOM 'THIAZOLE                            ' non-polymer         8   5 .
# ------------------------------------------------------
# ------------------------------------------------------
#
# --- DESCRIPTION OF MONOMERS ---
#
data_comp_LOM
#
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
 LOM           H3     H    H         0.000      0.003    0.000   -0.001
 LOM           C3     C    CR15      0.000     -1.064    0.000    0.187
 LOM           C2     C    CR15      0.000     -1.738    0.000    1.365
 LOM           H2     H    H         0.000     -1.206    0.000    2.308
 LOM           N1     N    NRD5      0.000     -3.053    0.000    1.333
 LOM           S1     S    S2        0.000     -2.426    0.000   -0.970
 LOM           C1     C    CR15      0.000     -3.710    0.000    0.198
 LOM           H1     H    H         0.000     -4.781    0.000    0.032
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
 LOM      H3     n/a    C3     START
 LOM      C3     H3     S1     .
 LOM      C2     C3     N1     .
 LOM      H2     C2     .      .
 LOM      N1     C2     .      .
 LOM      S1     C3     C1     .
 LOM      C1     S1     H1     .
 LOM      H1     C1     .      END
 LOM      C1     N1     .    ADD
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
 LOM      C1     N1        double      1.350    0.020
 LOM      C1     S1        single      1.745    0.020
 LOM      H1     C1        single      1.083    0.020
 LOM      N1     C2        single      1.350    0.020
 LOM      C2     C3        double      1.380    0.020
 LOM      H2     C2        single      1.083    0.020
 LOM      S1     C3        single      1.745    0.020
 LOM      C3     H3        single      1.083    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
 LOM      H3     C3     C2      126.000    3.000
 LOM      H3     C3     S1      108.000    3.000
 LOM      C2     C3     S1      108.000    3.000
 LOM      C3     C2     H2      126.000    3.000
 LOM      C3     C2     N1      108.000    3.000
 LOM      H2     C2     N1      126.000    3.000
 LOM      C2     N1     C1      108.000    3.000
 LOM      C3     S1     C1       97.389    3.000
 LOM      S1     C1     H1      108.000    3.000
 LOM      S1     C1     N1      108.000    3.000
 LOM      H1     C1     N1      126.000    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
 LOM      CONST_1  H3     C3     C2     N1       180.000    0.000   0
 LOM      CONST_2  C3     C2     N1     C1         0.000    0.000   0
 LOM      CONST_3  H3     C3     S1     C1       180.000    0.000   0
 LOM      CONST_4  C3     S1     C1     N1         0.000    0.000   0
 LOM      CONST_5  S1     C1     N1     C2         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
 LOM      plan-1    C1        0.020
 LOM      plan-1    N1        0.020
 LOM      plan-1    S1        0.020
 LOM      plan-1    H1        0.020
 LOM      plan-1    C2        0.020
 LOM      plan-1    C3        0.020
 LOM      plan-1    H2        0.020
 LOM      plan-1    H3        0.020
# ------------------------------------------------------
