STDPC000820
                    3D
 Structure written by MMmdl.
 10  9  0  0  1  0            999 V2000
    0.0347    0.0151    0.0000 C   0  0  0  0  0  0
   -0.7268    1.1330    0.0000 C   0  0  0  0  0  0
   -2.2680    1.1304    0.0000 C   0  0  0  0  0  0
   -2.7739    2.2743    0.0000 O   0  0  0  0  0  0
   -2.8212    0.0069    0.0000 O   0  5  0  0  0  0
    1.5759    0.0177   -0.0000 C   0  0  0  0  0  0
    2.0817   -1.1262   -0.0000 O   0  0  0  0  0  0
    2.1290    1.1413    0.0000 O   0  5  0  0  0  0
   -0.4544   -0.9489    0.0000 H   0  0  0  0  0  0
   -0.2377    2.0971    0.0000 H   0  0  0  0  0  0
  1  2  2  0  0  0
  1  6  1  0  0  0
  1  9  1  0  0  0
  2  3  1  0  0  0
  2 10  1  0  0  0
  3  4  2  0  0  0
  3  5  1  0  0  0
  6  7  2  0  0  0
  6  8  1  0  0  0
M  CHG  2   5  -1   8  -1
M  END
> <s_m_entry_id>
12978

> <s_m_entry_name>
structure generation_with STDDB ID and smile.9445

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

> <s_m_Source_File>
ligprep_1-out.maegz

> <i_m_Source_File_Index>
12978

> <i_lp_mmshare_version>
43012

> <i_f3d_flags>
0

> <s_epik_input>
Tz1DKFtPSF0pL1tDSF09W0NIXS9DKD1PKVtPSF0=

> <s_epik_cmdline>
J2VwaWtfcHl0aG9uJywgJy1waCcsICc3LjAnLCAnLW50JywgJy1tYScsICcyMDAnLCAnLWltYWUnLCAnPGluZmlsZS5tYWU+JywgJy1vbWFlJywgJzxvdXRmaWxlLm1hZT4n

> <r_epik_Ionization_Penalty>
  0.0020

> <r_epik_Ionization_Penalty_Charging>
  0.0020

> <r_epik_Ionization_Penalty_Neutral>
  0.0000

> <r_epik_State_Penalty>
  0.0000

> <r_epik_Charging_Adjusted_Penalty>
0.00200434793497982

> <i_epik_Tot_Q>
-2

> <i_epik_Tot_abs_Q>
2

> <s_lp_Force_Field>
OPLS3e

> <r_lp_Energy>
10.7647525476762

> <b_lp_Chiralities_Consistent>
1

> <s_lp_Variant>
STDPC000820-1

> <r_lp_tautomer_probability>
1

> <s_m_subgroup_title>
ligprep_1-out

> <s_m_subgroupid>
ligprep_1-out

> <b_m_subgroup_collapsed>
0

$$$$
