@<TRIPOS>MOLECULE
BindingDB_7167
 37 40 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C       -14.1783  204.2576  110.5669  C     
2    C       -14.4609  203.8279  111.8834  C     
3    C       -12.0090  205.1185  111.3380  C     
4    C       -12.9405  204.8961  110.3212  C     
5    C       -10.9353  205.7206  110.7018  C     
6    C       -13.5165  204.0660  112.9080  C     
7    C       -12.3065  204.7178  112.6503  C     
8    C       -13.5134  203.7546  114.2679  C     
9    N       -11.2291  205.8459  109.3928  N     
10   N       -12.4189  205.3732  109.1806  N     
11   N       -12.3424  204.2128  114.7491  N     
12   N       -11.6376  204.7863  113.8197  N     
13   C       -10.4518  205.3894  114.1180  C     
14   C        -9.0265  207.3788  114.1164  C     
15   C        -8.0289  206.6833  114.8293  C     
16   C        -8.2551  205.3371  115.1953  C     
17   C        -9.4549  204.6967  114.8431  C     
18   C       -10.2200  206.7335  113.7572  C     
19   O        -6.8533  208.9338  115.7089  O     
20   S        -6.5185  207.4608  115.2082  S     
21   O        -5.6737  206.6981  116.3226  O     
22   N        -5.6314  207.5784  113.7899  N     
23   C       -14.4660  203.1213  115.0366  C     
24   O       -15.5497  202.7847  114.5739  O     
25   N       -14.2492  202.8552  116.3063  N     
26   H       -14.8423  204.0997  109.8077  H     
27   H       -15.3418  203.3472  112.0689  H     
28   H       -10.0572  205.9984  111.1326  H     
29   H       -12.8566  205.3406  108.3111  H     
30   H        -8.8776  208.3544  113.8407  H     
31   H        -7.5518  204.8195  115.7250  H     
32   H        -9.6012  203.7220  115.1140  H     
33   H       -10.9404  207.2671  113.2642  H     
34   H        -5.0658  208.3561  113.6303  H     
35   H        -5.7741  206.9267  113.0813  H     
36   H       -14.9315  202.4072  116.8319  H     
37   H       -13.3999  203.0711  116.7121  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    4 1
     3    2    6 1
     4    3    4 2
     5    3    5 1
     6    3    7 1
     7    4   10 1
     8    5    9 2
     9    6    7 2
    10    6    8 1
    11    7   12 1
    12    8   11 2
    13    8   23 1
    14    9   10 1
    15   11   12 1
    16   12   13 1
    17   13   17 1
    18   13   18 2
    19   14   15 2
    20   14   18 1
    21   15   16 1
    22   15   20 1
    23   16   17 2
    24   19   20 2
    25   20   21 2
    26   20   22 am
    27   23   24 2
    28   23   25 am
    29    1   26 1
    30    2   27 1
    31    5   28 1
    32   10   29 1
    33   14   30 1
    34   16   31 1
    35   17   32 1
    36   18   33 1
    37   22   34 1
    38   22   35 1
    39   25   36 1
    40   25   37 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 8.1322
  Crash		| -0.6198
  Polar		| 4.6314
  FragIndex	| 1
  FragRMSD	| 0.156