@<TRIPOS>MOLECULE
BindingDB_5464
 37 38 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C         0.0187   28.5668    8.0611  C     
2    C         1.7868   29.2047    6.5675  C     
3    C        -0.3076   29.9283    8.1896  C     
4    C         0.4365   30.8788    7.4944  C     
5    C        -1.1030   31.8796    8.6352  C     
6    N        -1.2563   30.5648    8.8913  N     
7    N        -0.0750   32.0751    7.7920  N     
8    N         1.0743   28.2545    7.2497  N     
9    N         1.4772   30.5275    6.6979  N     
10   O        -0.6812   27.6516    8.8073  O     
11   C        -0.3290   26.2528    8.6595  C     
12   C        -1.2292   25.3949    9.5993  C     
13   N         2.8143   28.8332    5.7889  N     
14   C        -0.4876   24.8470   10.8591  C     
15   C         0.1665   23.4385   10.6631  C     
16   C         1.6842   23.3191   10.9926  C     
17   C         2.6542   24.0500   10.0175  C     
18   C         3.1136   25.4503   10.4912  C     
19   H        -1.6850   32.6255    9.0229  H     
20   H         0.2439   32.9276    7.4643  H     
21   H        -0.5196   25.9209    7.6262  H     
22   H         0.7335   26.0813    8.9067  H     
23   H        -2.0808   25.9994    9.9349  H     
24   H        -1.6492   24.5466    9.0451  H     
25   H         3.3707   29.5051    5.3575  H     
26   H         3.0389   27.8930    5.6957  H     
27   H         0.2550   25.5818   11.1911  H     
28   H        -1.2205   24.7723   11.6737  H     
29   H        -0.3610   22.7342   11.3106  H     
30   H         0.0145   23.0824    9.6412  H     
31   H         1.8671   23.6331   12.0238  H     
32   H         1.9277   22.2532   10.9435  H     
33   H         3.5516   23.4341    9.9026  H     
34   H         2.2003   24.1328    9.0243  H     
35   H         2.2550   26.1284   10.5764  H     
36   H         3.8211   25.8571    9.7603  H     
37   H         3.6229   25.3585   11.4598  H     
@<TRIPOS>BOND
     1    1    3 1
     2    1    8 2
     3    1   10 1
     4    2    8 1
     5    2    9 2
     6    2   13 1
     7    3    4 2
     8    3    6 1
     9    4    7 1
    10    4    9 1
    11    5    6 2
    12    5    7 1
    13   10   11 1
    14   11   12 1
    15   12   14 1
    16   14   15 1
    17   15   16 1
    18   16   17 1
    19   17   18 1
    20    5   19 1
    21    7   20 1
    22   11   21 1
    23   11   22 1
    24   12   23 1
    25   12   24 1
    26   13   25 1
    27   13   26 1
    28   14   27 1
    29   14   28 1
    30   15   29 1
    31   15   30 1
    32   16   31 1
    33   16   32 1
    34   17   33 1
    35   17   34 1
    36   18   35 1
    37   18   36 1
    38   18   37 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 8.5988
  Crash		| -0.5470
  Polar		| 4.8634
  FragIndex	| 1
  FragRMSD	| 0.472