1F6-Asn-(D)Lys-MMAF
     RDKit          2D

 83 85  0  0  1  0  0  0  0  0999 V2000
  -16.0127   -7.2642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.5462   -7.5795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.7932   -6.2822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.7942   -5.1652    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -16.1660   -5.7721    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.4633   -5.0190    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.3010   -6.1289    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -14.4789   -3.6987    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.0513   -3.2385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.7360   -1.7720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.3083   -1.3118    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9930    0.1547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5653    0.6148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2500    2.0813    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -13.8483   -0.7657    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8224    2.5415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5071    4.0080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7100    1.5352    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0794    4.4682    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9670    3.4619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5394    3.9221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4270    2.9158    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2823    1.9954    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3766   -2.3721    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.3802   -0.8721    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0829   -0.1191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7821   -0.8660    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.4848   -0.1130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1840   -0.8599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1805   -2.3599    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.8797   -3.1069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5824   -2.3539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5859   -0.8539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2887   -0.1008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6739   -3.1251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6809   -0.1252    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9782   -0.8782    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6845    1.3748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0864    1.3809    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4883    1.3870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7891    2.1340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1910    2.1401    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8867   -0.1069    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4778   -3.1130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8762   -4.6069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1735   -5.3599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5754   -5.3538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5719   -6.8538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2816   -3.1008    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2781   -4.6008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9879   -0.8478    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2922    1.3992    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.0807    2.2837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5476    3.7092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0476    3.7057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5078    2.2780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6531    1.8235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5407    2.8298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3378    0.3570    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9101   -0.1032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1130    2.3696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8560    4.2963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9993    3.3759    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2023    0.9031    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6299    0.4430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7423    1.4493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1700    0.9891    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9452   -1.0235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8329   -2.0298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1482   -3.4963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0358   -4.5026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3918   -4.0424    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7072   -2.5759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5948   -1.5696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2241    5.3885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3364    6.3949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0211    7.8613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1335    8.8676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8182   10.3341    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6194    5.0143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0471    4.5541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.1595    5.5604    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3624    3.0876    0.0000 O   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 80  1  0
 19 20  1  0
 20 21  1  0
 20 23  2  0
 21 22  1  0
 21 75  1  0
 22 66  1  0
 24 35  1  0
 24 25  1  0
 25 26  1  0
 25 36  1  0
 26 27  1  0
 26 39  2  0
 27 28  1  0
 28 29  1  0
 28 40  1  0
 29 30  1  0
 29 43  2  0
 30 31  1  0
 30 44  1  0
 31 32  1  0
 31 45  1  0
 32 33  1  0
 32 49  1  0
 33 34  1  0
 34 51  2  0
 34 52  1  0
 36 37  1  0
 36 38  1  0
 40 41  1  0
 40 42  1  0
 45 46  1  0
 45 47  1  0
 47 48  1  0
 49 50  1  0
 52 53  1  0
 52 56  1  0
 53 54  1  0
 53 57  1  0
 54 55  1  0
 55 56  1  0
 57 58  1  0
 57 59  1  0
 58 61  1  0
 58 62  1  0
 59 60  1  0
 61 63  2  0
 61 64  1  0
 64 65  1  0
 65 66  1  0
 65 68  1  0
 66 67  2  0
 68 69  1  0
 69 70  2  0
 69 74  1  0
 70 71  1  0
 71 72  2  0
 72 73  1  0
 73 74  2  0
 75 76  1  0
 76 77  1  0
 77 78  1  0
 78 79  1  0
 80 81  1  0
 81 82  1  0
 81 83  2  0
M  END
>  <s_m_entry_id>  (1) 
44

>  <s_m_entry_name>  (1) 
1F6-Asn-(D)Lys-MMAF.1

>  <s_m_Source_Path>  (1) 
D:\Schrodinger_2023-1\projects\ligprep_4

>  <s_m_Source_File>  (1) 
ligprep_4-out.maegz

>  <i_m_Source_File_Index>  (1) 
1

>  <s_m_source_file>  (1) 
ligprep_4.maegz

>  <i_m_source_file_index>  (1) 
11

>  <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) 
52.442665

>  <b_lp_Chiralities_Consistent>  (1) 
1

>  <s_lp_Variant>  (1) 
1F6-Asn-(D)Lys-MMAF.sdf-1

>  <s_m_job_name>  (1) 
ligprep_4

$$$$
