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
GM1      GM1 'AMINOMETHYLAMIDE                    ' non-polymer        11   5 .
# ------------------------------------------------------
# ------------------------------------------------------
#
# --- DESCRIPTION OF MONOMERS ---
#
data_comp_GM1
#
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
 GM1           O1     O    O         0.000      0.000    0.000    0.000
 GM1           C1     C    C         0.000     -0.533   -0.006    1.091
 GM1           N1     N    NH2       0.000      0.220    0.048    2.207
 GM1           HN12   H    H         0.000     -0.219    0.043    3.119
 GM1           HN11   H    H         0.000      1.230    0.094    2.140
 GM1           C2     C    CH2       0.000     -2.033   -0.075    1.195
 GM1           H21    H    H         0.000     -2.402    0.809    1.719
 GM1           H22    H    H         0.000     -2.317   -0.971    1.751
 GM1           N2     N    NH2       0.000     -2.617   -0.127   -0.152
 GM1           HN22   H    H         0.000     -2.019   -0.113   -0.970
 GM1           HN21   H    H         0.000     -3.622   -0.175   -0.273
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
 GM1      O1     n/a    C1     START
 GM1      C1     O1     C2     .
 GM1      N1     C1     HN11   .
 GM1      HN12   N1     .      .
 GM1      HN11   N1     .      .
 GM1      C2     C1     N2     .
 GM1      H21    C2     .      .
 GM1      H22    C2     .      .
 GM1      N2     C2     HN21   .
 GM1      HN22   N2     .      .
 GM1      HN21   N2     .      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
 GM1      N1     C1        single      1.332    0.020
 GM1      C1     O1        double      1.220    0.020
 GM1      C2     C1        single      1.510    0.020
 GM1      HN11   N1        single      1.010    0.020
 GM1      HN12   N1        single      1.010    0.020
 GM1      N2     C2        single      1.450    0.020
 GM1      H21    C2        single      1.092    0.020
 GM1      H22    C2        single      1.092    0.020
 GM1      HN21   N2        single      1.010    0.020
 GM1      HN22   N2        single      1.010    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
 GM1      O1     C1     N1      123.000    3.000
 GM1      O1     C1     C2      120.500    3.000
 GM1      N1     C1     C2      116.500    3.000
 GM1      C1     N1     HN12    120.000    3.000
 GM1      C1     N1     HN11    120.000    3.000
 GM1      HN12   N1     HN11    120.000    3.000
 GM1      C1     C2     H21     109.470    3.000
 GM1      C1     C2     H22     109.470    3.000
 GM1      C1     C2     N2      111.600    3.000
 GM1      H21    C2     H22     107.900    3.000
 GM1      H21    C2     N2      109.470    3.000
 GM1      H22    C2     N2      109.470    3.000
 GM1      C2     N2     HN22    120.000    3.000
 GM1      C2     N2     HN21    120.000    3.000
 GM1      HN22   N2     HN21    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
 GM1      CONST_1  O1     C1     N1     HN11       0.000    0.000   0
 GM1      var_1    O1     C1     C2     N2        -0.003   20.000   3
 GM1      var_2    C1     C2     N2     HN21    -179.952   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
 GM1      plan-1    C1        0.020
 GM1      plan-1    N1        0.020
 GM1      plan-1    O1        0.020
 GM1      plan-1    C2        0.020
 GM1      plan-1    HN12      0.020
 GM1      plan-1    HN11      0.020
 GM1      plan-2    N1        0.020
 GM1      plan-2    C1        0.020
 GM1      plan-2    HN11      0.020
 GM1      plan-2    HN12      0.020
 GM1      plan-3    N2        0.020
 GM1      plan-3    C2        0.020
 GM1      plan-3    HN21      0.020
 GM1      plan-3    HN22      0.020
# ------------------------------------------------------
