STDPC005753
                    3D
 Structure written by MMmdl.
 11 10  0  0  1  0            999 V2000
   -0.8584    2.1253   -1.1419 C   0  0  0  0  0  0
   -0.4342    1.4504   -0.0620 C   0  0  0  0  0  0
    0.0358    0.0105   -0.0719 C   0  0  0  0  0  0
    1.8172   -0.1686    0.2064 S   0  0  0  0  0  0
    1.9437   -1.8640    0.1391 C   0  0  0  0  0  0
    1.9661   -3.0196    0.0863 N   0  0  0  0  0  0
   -0.8863    1.6647   -2.1188 H   0  0  0  0  0  0
   -1.1841    3.1522   -1.0621 H   0  0  0  0  0  0
   -0.4247    1.9466    0.8979 H   0  0  0  0  0  0
   -0.4981   -0.5331    0.7083 H   0  0  0  0  0  0
   -0.2139   -0.4572   -1.0255 H   0  0  0  0  0  0
  1  2  2  0  0  0
  1  7  1  0  0  0
  1  8  1  0  0  0
  2  3  1  0  0  0
  2  9  1  0  0  0
  3  4  1  0  0  0
  3 10  1  0  0  0
  3 11  1  0  0  0
  4  5  1  0  0  0
  5  6  3  0  0  0
M  END
> <s_m_entry_id>
6342

> <s_m_entry_name>
structure generation_with STDDB ID and smile.4551

> <s_m_Source_Path>
/home/mayank/ket/ligprep_1

> <s_m_Source_File>
ligprep_1-out.maegz

> <i_m_Source_File_Index>
6342

> <i_lp_mmshare_version>
43012

> <i_f3d_flags>
0

> <s_epik_input>
W0NIMl09W0NIXVtDSDJdU0MjTg==

> <s_epik_cmdline>
J2VwaWtfcHl0aG9uJywgJy1waCcsICc3LjAnLCAnLW50JywgJy1tYScsICcyMDAnLCAnLWltYWUnLCAnPGluZmlsZS5tYWU+JywgJy1vbWFlJywgJzxvdXRmaWxlLm1hZT4n

> <r_epik_Ionization_Penalty>
  0.0000

> <r_epik_Ionization_Penalty_Charging>
  0.0000

> <r_epik_Ionization_Penalty_Neutral>
  0.0000

> <r_epik_State_Penalty>
  0.0000

> <r_epik_Charging_Adjusted_Penalty>
0

> <i_epik_Tot_Q>
0

> <i_epik_Tot_abs_Q>
0

> <s_lp_Force_Field>
OPLS3e

> <r_lp_Energy>
2.2360067154197

> <b_lp_Chiralities_Consistent>
1

> <s_lp_Variant>
STDPC005753-1

> <r_lp_tautomer_probability>
1

> <s_m_subgroup_title>
ligprep_1-out

> <s_m_subgroupid>
ligprep_1-out

> <b_m_subgroup_collapsed>
0

$$$$
