@<TRIPOS>MOLECULE
BindingDB_10849
 24 25 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        93.0234   74.0002   -6.5622  C     
2    C        92.7231   75.2201   -5.9728  C     
3    N        92.6581   72.8060   -5.9819  N     
4    N        91.6535   74.0275   -4.2048  N     
5    C        91.9785   72.8530   -4.8109  C     
6    C        92.0228   75.2012   -4.7712  C     
7    N        93.7133   74.2349   -7.6906  N     
8    N        93.2383   76.1910   -6.7601  N     
9    C        93.8385   75.5688   -7.7984  C     
10   O        91.6580   71.7949   -4.2807  O     
11   O        91.7833   76.2869   -4.2548  O     
12   C        93.0734   71.5879   -6.6430  C     
13   C        90.9179   73.9994   -2.9485  C     
14   C        93.1870   77.6075   -6.5664  C     
15   H        94.3363   76.0309   -8.5590  H     
16   H        92.6599   71.5543   -7.6531  H     
17   H        92.7575   70.6764   -6.1311  H     
18   H        94.1654   71.5613   -6.7098  H     
19   H        89.9653   73.4840   -3.0912  H     
20   H        90.6884   74.9830   -2.5386  H     
21   H        91.4972   73.4628   -2.1942  H     
22   H        92.1452   77.9354   -6.5628  H     
23   H        93.7144   78.1431   -7.3592  H     
24   H        93.6500   77.8680   -5.6130  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    3 1
     3    1    7 1
     4    2    6 1
     5    2    8 1
     6    3    5 1
     7    3   12 1
     8    4    5 1
     9    4    6 1
    10    4   13 1
    11    5   10 2
    12    6   11 2
    13    7    9 2
    14    8    9 1
    15    8   14 1
    16    9   15 1
    17   12   16 1
    18   12   17 1
    19   12   18 1
    20   13   19 1
    21   13   20 1
    22   13   21 1
    23   14   22 1
    24   14   23 1
    25   14   24 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 2.8115
  Crash		| -0.0736
  Polar		| 0.0000
  FragIndex	| 1
  FragRMSD	| 0.179