@<TRIPOS>MOLECULE
BindingDB_11932
 34 36 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        -2.5112    5.5174    9.6621  C     
2    C        -2.4724    5.8341    8.2949  C     
3    C        -1.6018    5.0309    7.5378  C     
4    C        -0.8664    4.1152    8.2912  C     
5    S        -1.3478    4.2780    9.9469  S     
6    C        -3.4149    6.0603   10.6798  C     
7    C        -4.4949    2.5671   11.7889  C     
8    C        -4.5746    3.7963   10.8207  C     
9    N        -4.1130    5.0292   11.4224  N     
10   S        -5.0227    5.5336   12.7558  S     
11   O        -4.2147    6.4685   13.7530  O     
12   O        -6.4259    6.1493   12.3234  O     
13   O        -5.2254    1.4677   11.2220  O     
14   C        -5.0183    2.7976   13.1697  C     
15   C        -5.3265    4.0834   13.6431  C     
16   C        -5.2171    1.7842   14.1388  C     
17   C        -5.7061    2.2512   15.3671  C     
18   S        -5.8809    3.9583   15.2637  S     
19   O        -6.5797   -0.1083   16.4925  O     
20   O        -4.5392    1.1419   17.4528  O     
21   S        -5.9821    1.3355   16.8135  S     
22   N        -6.9073    2.1272   17.9746  N     
23   H        -3.0800    6.5377    7.8823  H     
24   H        -1.5083    5.1333    6.5293  H     
25   H        -0.1770    3.4601    7.9301  H     
26   H        -2.7872    6.6609   11.3488  H     
27   H        -4.1496    6.7413   10.2247  H     
28   H        -3.4289    2.2710   11.8776  H     
29   H        -4.0180    3.5552    9.9199  H     
30   H        -5.6196    3.9321   10.5037  H     
31   H        -5.6917    1.8379   10.4498  H     
32   H        -5.0113    0.7960   13.9680  H     
33   H        -6.7764    1.9295   18.9204  H     
34   H        -7.5074    2.8475   17.7102  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    5 1
     3    1    6 1
     4    2    3 1
     5    3    4 2
     6    4    5 1
     7    6    9 1
     8    7    8 1
     9    7   13 1
    10    7   14 1
    11    8    9 1
    12    9   10 1
    13   10   11 2
    14   10   12 2
    15   10   15 1
    16   14   15 2
    17   14   16 1
    18   15   18 1
    19   16   17 2
    20   17   18 1
    21   17   21 1
    22   19   21 2
    23   20   21 2
    24   21   22 am
    25    2   23 1
    26    3   24 1
    27    4   25 1
    28    6   26 1
    29    6   27 1
    30    7   28 1
    31    8   29 1
    32    8   30 1
    33   13   31 1
    34   16   32 1
    35   22   33 1
    36   22   34 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 5.4086
  Crash		| -1.0259
  Polar		| 4.5866
  FragIndex	| 1
  FragRMSD	| 1.391