STDPC002141
                    3D
 Structure written by MMmdl.
 12 12  0  0  1  0            999 V2000
   -0.0175    1.4412    0.0086 C   0  0  0  0  0  0
    1.1484    2.1339    0.0010 C   0  0  0  0  0  0
    2.4800    1.5063   -0.0146 C   0  0  0  0  0  0
    3.5367    2.1341   -0.0214 O   0  0  0  0  0  0
    2.3942    0.0367   -0.0210 C   0  0  0  0  0  0
    1.2283   -0.6559   -0.0134 C   0  0  0  0  0  0
   -0.1032   -0.0284    0.0022 C   0  0  0  0  0  0
   -1.1599   -0.6562    0.0090 O   0  0  0  0  0  0
   -0.9343    2.0128    0.0200 H   0  0  0  0  0  0
    1.0850    3.2125    0.0069 H   0  0  0  0  0  0
    3.3111   -0.5348   -0.0324 H   0  0  0  0  0  0
    1.2918   -1.7345   -0.0193 H   0  0  0  0  0  0
  1  7  1  0  0  0
  1  2  2  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
  5  6  2  0  0  0
  5 11  1  0  0  0
  6  7  1  0  0  0
  6 12  1  0  0  0
  7  8  2  0  0  0
M  END
> <s_m_entry_id>
11202

> <s_m_entry_name>
structure generation_with STDDB ID and smile.8128

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

> <s_m_Source_File>
ligprep_1-out.maegz

> <i_m_Source_File_Index>
11202

> <i_lp_mmshare_version>
43012

> <i_f3d_flags>
0

> <s_epik_input>
W0NIXTE9W0NIXUMoPU8pW0NIXT1bQ0hdQzE9Tw==

> <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>
11.9503849343423

> <b_lp_Chiralities_Consistent>
1

> <s_lp_Variant>
STDPC002141-1

> <r_lp_tautomer_probability>
1

> <s_m_subgroup_title>
ligprep_1-out

> <s_m_subgroupid>
ligprep_1-out

> <b_m_subgroup_collapsed>
0

$$$$
