STDPC000044
                    3D
 Structure written by MMmdl.
 11 11  0  0  1  0            999 V2000
   -2.1845   -0.3749   -0.0000 C   0  0  0  0  0  0
   -1.9384    0.9889   -0.0000 C   0  0  0  0  0  0
   -0.6005    1.2250    0.0000 O   0  0  0  0  0  0
    0.0140    0.0129   -0.0000 C   0  0  0  0  0  0
   -0.9359   -1.0003   -0.0000 C   0  0  0  0  0  0
    1.4634   -0.0087    0.0000 C   0  0  0  0  0  0
    2.1191   -1.0493   -0.0000 O   0  0  0  0  0  0
   -3.1507   -0.8579   -0.0000 H   0  0  0  0  0  0
   -2.5766    1.8602    0.0000 H   0  0  0  0  0  0
   -0.7464   -2.0640   -0.0000 H   0  0  0  0  0  0
    1.9346    0.9745    0.0000 H   0  0  0  0  0  0
  1  5  1  0  0  0
  1  2  2  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
  4  5  2  0  0  0
  4  6  1  0  0  0
  5 10  1  0  0  0
  6  7  2  0  0  0
  6 11  1  0  0  0
M  END
> <s_m_entry_id>
14037

> <s_m_entry_name>
structure generation_with STDDB ID and smile.10219

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

> <s_m_Source_File>
ligprep_1-out.maegz

> <i_m_Source_File_Index>
14037

> <i_lp_mmshare_version>
43012

> <i_f3d_flags>
0

> <s_epik_input>
W2NIXTFbY0hdW2NIXW9jMVtDSF09Tw==

> <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>
4.03429281662464

> <b_lp_Chiralities_Consistent>
1

> <s_lp_Variant>
STDPC000044-1

> <r_lp_tautomer_probability>
1

> <s_m_subgroup_title>
ligprep_1-out

> <s_m_subgroupid>
ligprep_1-out

> <b_m_subgroup_collapsed>
0

$$$$
