Mal-Me3Lys-Pro
     RDKit          2D

 34 35  0  0  1  0  0  0  0  0999 V2000
   11.4332    0.3096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8376    1.6863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3443    1.5453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0169    0.0815    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.3079   -0.6822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4489   -2.1756    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3524    2.6706    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6402   -0.5141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4361    0.3804    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0594   -0.2152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8553    0.6793    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4786    0.0837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2744    0.9782    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1023    0.3826    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8868   -1.7052    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3064    1.2771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6831    0.6815    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1338    2.7671    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8557   -0.8085    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2324   -1.4041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3009   -3.9096    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8872    1.5760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2639    0.9804    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4680    1.8749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4365   -0.5096    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4049   -2.8942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9255   -5.2734    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4155   -5.1008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7118   -3.6304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8447    1.2793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0489    2.1738    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9433    0.9696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1544    3.3779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.2530    3.0682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  1  5  1  0
  2  3  1  0
  3  4  1  0
  3  7  2  0
  4  5  1  0
  4  8  1  0
  5  6  2  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 10 15  2  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 16  1  0
 16 17  1  0
 16 18  2  0
 17 19  1  0
 17 22  1  0
 19 20  1  0
 20 25  2  0
 20 26  1  0
 21 26  1  0
 21 27  1  0
 22 23  1  0
 23 24  1  0
 24 30  1  0
 26 29  1  0
 27 28  1  0
 28 29  1  0
 30 31  1  0
 31 32  1  0
 31 33  1  0
 31 34  1  0
M  CHG  1  31   1
M  END
>  <s_m_entry_id>  (1) 
68

>  <s_m_entry_name>  (1) 
Mal-Me3Lys-Pro.1

>  <s_m_Source_Path>  (1) 
D:\Schrodinger_2023-1\projects\ligprep_5

>  <s_m_Source_File>  (1) 
ligprep_5-out.maegz

>  <i_m_Source_File_Index>  (1) 
1

>  <s_m_source_file>  (1) 
ligprep_5.maegz

>  <i_m_source_file_index>  (1) 
13

>  <i_lp_mmshare_version>  (1) 
61128

>  <i_f3d_flags>  (1) 
0

>  <r_lp_tautomer_probability>  (1) 
1

>  <s_lp_Force_Field>  (1) 
S-OPLS

>  <r_lp_Energy>  (1) 
23.817371

>  <b_lp_Chiralities_Consistent>  (1) 
1

>  <s_lp_Variant>  (1) 
Mal-Me3Lys-Pro.sdf-1

>  <s_m_job_name>  (1) 
ligprep_5

$$$$
