@<TRIPOS>MOLECULE
BindingDB_30181
 35 38 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        29.6778   64.9230  191.5490  C     
2    C        30.4319   64.8671  192.7487  C     
3    N        31.2777   65.9061  193.0055  N     
4    C        31.4238   66.9847  192.1956  C     
5    C        30.6867   67.0675  191.0058  C     
6    C        29.8040   66.0217  190.6587  C     
7    C        29.0781   66.0456  189.4408  C     
8    C        27.6645   65.3895  187.8789  C     
9    N        28.1334   65.1458  189.1085  N     
10   C        29.1971   66.9302  188.3586  C     
11   C        26.4372   65.1803  185.6942  C     
12   C        26.6660   64.6118  187.1336  C     
13   C        28.3142   66.5065  187.3733  C     
14   C        28.0802   66.9635  186.1013  C     
15   N        27.2061   66.3408  185.3209  N     
16   O        28.7193   67.8980  185.6416  O     
17   C        30.3525   63.7806  193.6729  C     
18   N        29.1996   61.9144  194.6981  N     
19   C        30.2564   61.6617  195.5024  C     
20   N        31.3605   62.4416  195.4156  N     
21   C        31.4307   63.4749  194.5402  C     
22   C        29.2178   62.9354  193.8006  C     
23   H        29.0647   64.1406  191.3081  H     
24   H        32.0772   67.7346  192.4517  H     
25   H        30.8147   67.8836  190.4043  H     
26   H        27.8390   64.4122  189.6690  H     
27   H        29.8347   67.7240  188.2661  H     
28   H        26.6977   64.3960  184.9830  H     
29   H        25.3749   65.4191  185.5595  H     
30   H        27.0110   63.5743  187.0804  H     
31   H        25.7276   64.6314  187.6918  H     
32   H        27.1204   66.6569  184.4058  H     
33   H        30.2232   60.8905  196.1711  H     
34   H        32.3000   64.0120  194.5058  H     
35   H        28.3814   63.0728  193.2334  H     
@<TRIPOS>BOND
     1    1    2 1
     2    1    6 2
     3    2    3 2
     4    2   17 1
     5    3    4 1
     6    4    5 2
     7    5    6 1
     8    6    7 1
     9    7    9 1
    10    7   10 2
    11    8    9 1
    12    8   12 1
    13    8   13 2
    14   10   13 1
    15   11   12 1
    16   11   15 1
    17   13   14 1
    18   14   15 1
    19   14   16 2
    20   17   21 1
    21   17   22 2
    22   18   19 2
    23   18   22 1
    24   19   20 1
    25   20   21 2
    26    1   23 1
    27    4   24 1
    28    5   25 1
    29    9   26 1
    30   10   27 1
    31   11   28 1
    32   11   29 1
    33   12   30 1
    34   12   31 1
    35   15   32 1
    36   19   33 1
    37   21   34 1
    38   22   35 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 7.5001
  Crash		| -1.6262
  Polar		| 2.0883
  FragIndex	| 1
  FragRMSD	| 0.093