STDPC005348
                    3D
 Structure written by MMmdl.
 12 11  0  0  1  0            999 V2000
   -0.6765    1.1459    0.0000 C   0  0  0  0  0  0
    0.0408    0.0114    0.0000 C   0  0  0  0  0  0
    1.4904   -0.0086    0.0000 C   0  0  0  0  0  0
    2.2004   -1.1518    0.0000 C   0  0  0  0  0  0
    3.6496   -1.1402    0.0000 C   0  0  0  0  0  0
    4.3139   -2.1745    0.0000 O   0  0  0  0  0  0
   -0.2016    2.1168   -0.0000 H   0  0  0  0  0  0
   -1.7564    1.1178    0.0000 H   0  0  0  0  0  0
   -0.4944   -0.9279    0.0000 H   0  0  0  0  0  0
    2.0105    0.9409    0.0000 H   0  0  0  0  0  0
    1.7178   -2.1193    0.0000 H   0  0  0  0  0  0
    4.1352   -0.1636    0.0000 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  2  0  0  0
  3 10  1  0  0  0
  4  5  1  0  0  0
  4 11  1  0  0  0
  5  6  2  0  0  0
  5 12  1  0  0  0
M  END
> <s_m_entry_id>
6909

> <s_m_entry_name>
structure generation_with STDDB ID and smile.4947

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

> <s_m_Source_File>
ligprep_1-out.maegz

> <i_m_Source_File_Index>
6909

> <i_lp_mmshare_version>
43012

> <i_f3d_flags>
0

> <s_epik_input>
W0NIMl09W0NIXS9bQ0hdPVtDSF0vW0NIXT1P

> <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>
-0.670614713257102

> <b_lp_Chiralities_Consistent>
1

> <s_lp_Variant>
STDPC005348-1

> <r_lp_tautomer_probability>
1

> <s_m_subgroup_title>
ligprep_1-out

> <s_m_subgroupid>
ligprep_1-out

> <b_m_subgroup_collapsed>
0

$$$$
