@<TRIPOS>MOLECULE
BindingDB_50294098
 38 38 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C       131.2323   61.9940   -7.1966  C     
2    N       131.6756   61.1639   -6.0659  N     
3    C       131.9983   63.3450   -7.2976  C     
4    C       131.3449   64.5682   -6.5785  C     
5    C       131.1934   65.8044   -7.5016  C     
6    C       131.6561   67.1805   -6.9352  C     
7    N       131.0214   68.3584   -7.4795  N     
8    C       131.0905   68.8472   -8.7512  C     
9    N       131.7554   68.1999   -9.7292  N     
10   N       130.4535   70.0236   -9.0131  N     
11   C       130.2569   70.5740  -10.3206  C     
12   C       129.8798   72.0754  -10.2801  C     
13   C       128.9736   72.6163  -11.3979  C     
14   C       128.4388   72.5171   -9.9639  C     
15   H       131.4044   61.4307   -8.1141  H     
16   H       130.1547   62.1615   -7.1095  H     
17   H       132.6861   61.0227   -6.1269  H     
18   H       131.2003   60.2567   -6.1069  H     
19   H       131.4338   61.6169   -5.1849  H     
20   H       133.0169   63.1968   -6.9124  H     
21   H       132.0997   63.5450   -8.3712  H     
22   H       130.3447   64.2996   -6.2110  H     
23   H       131.9576   64.8269   -5.7052  H     
24   H       131.7754   65.5822   -8.3988  H     
25   H       130.1385   65.8849   -7.8012  H     
26   H       131.4624   67.1925   -5.8607  H     
27   H       132.7401   67.2770   -7.0602  H     
28   H       130.4744   68.8594   -6.8587  H     
29   H       131.7566   68.5398  -10.6424  H     
30   H       130.1123   70.5347   -8.2687  H     
31   H       131.1720   70.5110  -10.9179  H     
32   H       129.4785   69.9878  -10.8228  H     
33   H       130.6528   72.7854   -9.9743  H     
34   H       129.1877   73.6248  -11.7433  H     
35   H       128.5558   71.8922  -12.0979  H     
36   H       127.7312   71.7134   -9.7569  H     
37   H       128.3578   73.4613   -9.4133  H     
38   H       132.2419   67.3846   -9.5160  H     
@<TRIPOS>BOND
     1    1    2 1
     2    1    3 1
     3    3    4 1
     4    4    5 1
     5    5    6 1
     6    6    7 1
     7    7    8 1
     8    8    9 2
     9    8   10 1
    10   10   11 1
    11   11   12 1
    12   12   13 1
    13   12   14 1
    14   13   14 1
    15    1   15 1
    16    1   16 1
    17    2   17 1
    18    2   18 1
    19    2   19 1
    20    3   20 1
    21    3   21 1
    22    4   22 1
    23    4   23 1
    24    5   24 1
    25    5   25 1
    26    6   26 1
    27    6   27 1
    28    7   28 1
    29    9   29 1
    30   10   30 1
    31   11   31 1
    32   11   32 1
    33   12   33 1
    34   13   34 1
    35   13   35 1
    36   14   36 1
    37   14   37 1
    38    9   38 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 6.8040
  Crash		| -1.5084
  Polar		| 3.1187
  FragIndex	| 1
  FragRMSD	| 1.352