STDPC005554
                    3D
 Structure written by MMmdl.
  7  6  0  0  1  0            999 V2000
    0.0090    0.0024    0.0000 C   0  0  0  0  0  0
    1.5359    0.0145    0.0000 C   0  0  0  0  0  0
    2.1114   -1.0956   -0.0000 O   0  0  0  0  0  0
    2.1039    1.1288    0.0000 O   0  5  0  0  0  0
   -0.4007    1.0134   -0.0000 H   0  0  0  0  0  0
   -0.3652   -0.5145    0.8841 H   0  0  0  0  0  0
   -0.3652   -0.5145   -0.8841 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  2  0  0  0
  2  4  1  0  0  0
M  CHG  1   4  -1
M  END
> <s_m_entry_id>
6664

> <s_m_entry_name>
structure generation_with STDDB ID and smile.4748

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

> <s_m_Source_File>
ligprep_1-out.maegz

> <i_m_Source_File_Index>
6664

> <i_lp_mmshare_version>
43012

> <i_f3d_flags>
0

> <s_epik_input>
W0NIM11DKD1PKVtPSF0=

> <s_epik_cmdline>
J2VwaWtfcHl0aG9uJywgJy1waCcsICc3LjAnLCAnLW50JywgJy1tYScsICcyMDAnLCAnLWltYWUnLCAnPGluZmlsZS5tYWU+JywgJy1vbWFlJywgJzxvdXRmaWxlLm1hZT4n

> <r_epik_Ionization_Penalty>
  0.0040

> <r_epik_Ionization_Penalty_Charging>
  0.0040

> <r_epik_Ionization_Penalty_Neutral>
  0.0000

> <r_epik_State_Penalty>
  0.0029

> <r_epik_Charging_Adjusted_Penalty>
0.00685023819436197

> <i_epik_Tot_Q>
-1

> <i_epik_Tot_abs_Q>
1

> <s_lp_Force_Field>
OPLS3e

> <r_lp_Energy>
-1.26348868515132

> <b_lp_Chiralities_Consistent>
1

> <s_lp_Variant>
STDPC005554-1

> <s_m_subgroup_title>
ligprep_1-out

> <s_m_subgroupid>
ligprep_1-out

> <b_m_subgroup_collapsed>
0

$$$$
