STDPC001045
                    3D
 Structure written by MMmdl.
 12 11  0  0  1  0            999 V2000
   -0.5400    1.4402    0.0000 C   0  0  0  0  0  0
    0.0071    0.0061   -0.0000 C   0  0  0  0  0  0
    1.5432   -0.0470   -0.0000 C   0  0  0  0  0  0
    2.0006   -1.3826    0.0000 O   0  0  0  0  0  0
   -1.6304    1.4405   -0.0000 H   0  0  0  0  0  0
   -0.2094    1.9902   -0.8818 H   0  0  0  0  0  0
   -0.2094    1.9902    0.8818 H   0  0  0  0  0  0
   -0.3788   -0.5203    0.8743 H   0  0  0  0  0  0
   -0.3788   -0.5203   -0.8743 H   0  0  0  0  0  0
    1.9436    0.4829   -0.8651 H   0  0  0  0  0  0
    1.9436    0.4829    0.8651 H   0  0  0  0  0  0
    2.9607   -1.3769    0.0000 H   0  0  0  0  0  0
  1  2  1  0  0  0
  1  5  1  0  0  0
  1  6  1  0  0  0
  1  7  1  0  0  0
  2  3  1  0  0  0
  2  8  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 12  1  0  0  0
M  END
> <s_m_entry_id>
12686

> <s_m_entry_name>
structure generation_with STDDB ID and smile.9220

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

> <s_m_Source_File>
ligprep_1-out.maegz

> <i_m_Source_File_Index>
12686

> <i_lp_mmshare_version>
43012

> <i_f3d_flags>
0

> <s_epik_input>
W0NIM11bQ0gyXVtDSDJdW09IXQ==

> <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>
1.53881921339584

> <b_lp_Chiralities_Consistent>
1

> <s_lp_Variant>
STDPC001045-1

> <r_lp_tautomer_probability>
1

> <s_m_subgroup_title>
ligprep_1-out

> <s_m_subgroupid>
ligprep_1-out

> <b_m_subgroup_collapsed>
0

$$$$
