STDPC007435
                    3D
 Structure written by MMmdl.
 12 12  0  0  1  0            999 V2000
    4.1429    5.7719    0.3784 C   0  0  0  0  0  0
    4.2300    5.6909   -1.1423 C   0  0  0  0  0  0
    3.0686    4.8085   -1.5803 C   0  0  0  0  0  0
    2.7532    4.4722   -2.7197 O   0  0  0  0  0  0
    2.3633    4.4116   -0.3782 C   0  0  0  0  0  0
    2.9386    4.9319    0.7172 C   0  0  0  0  0  0
    4.0188    6.8027    0.7123 H   0  0  0  0  0  0
    5.0475    5.3822    0.8468 H   0  0  0  0  0  0
    4.1451    6.6762   -1.6014 H   0  0  0  0  0  0
    5.1748    5.2542   -1.4668 H   0  0  0  0  0  0
    1.4904    3.7762   -0.4115 H   0  0  0  0  0  0
    2.6089    4.7895    1.7360 H   0  0  0  0  0  0
  1  6  1  0  0  0
  1  2  1  0  0  0
  1  7  1  0  0  0
  1  8  1  0  0  0
  2  3  1  0  0  0
  2  9  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 12  1  0  0  0
M  END
> <s_m_entry_id>
4125

> <s_m_entry_name>
structure generation_with STDDB ID and smile.2896

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

> <s_m_Source_File>
ligprep_1-out.maegz

> <i_m_Source_File_Index>
4125

> <i_lp_mmshare_version>
43012

> <i_f3d_flags>
0

> <s_epik_input>
W0NIXTE9W0NIXVtDSDJdW0NIMl1DMT1P

> <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>
-5.1991733646447

> <b_lp_Chiralities_Consistent>
1

> <s_lp_Variant>
STDPC007435-1

> <r_lp_tautomer_probability>
1

> <s_m_subgroup_title>
ligprep_1-out

> <s_m_subgroupid>
ligprep_1-out

> <b_m_subgroup_collapsed>
0

$$$$
