@<TRIPOS>MOLECULE
BindingDB_24055
 59 62 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    O        15.8510   13.8597  109.5744  O     
2    C        19.8294   14.7445  107.9595  C     
3    C        18.5966   15.5075  108.0623  C     
4    C        19.7493   13.7194  108.8090  C     
5    N        17.7236   14.7269  108.8955  N     
6    C        18.5292   13.5541  110.9140  C     
7    C        17.8559   12.5246  111.6176  C     
8    C        19.2555   14.5165  111.6626  C     
9    C        19.3239   14.4375  113.0661  C     
10   C        18.6461   13.4069  113.7453  C     
11   C        17.9069   12.4558  113.0216  C     
12   C        20.9416   15.0672  107.1417  C     
13   C        23.1161   14.5234  106.0785  C     
14   C        23.1956   15.8145  105.5349  C     
15   C        22.1440   16.7254  105.7454  C     
16   C        21.0372   16.3515  106.5329  C     
17   C        22.0034   14.1475  106.8628  C     
18   F        22.0004   12.8942  107.2379  F     
19   F        22.1986   17.9095  105.2038  F     
20   C        16.3733   14.8157  109.0068  C     
21   N        15.4900   15.7499  108.5685  N     
22   C        14.0969   15.3615  108.3430  C     
23   C        18.4654   13.6011  109.4194  C     
24   C        15.8255   17.1630  108.4090  C     
25   C        15.6267   19.5002  109.3995  C     
26   C        14.7115   19.1458  107.1095  C     
27   C        15.4363   17.7710  107.0143  C     
28   C        15.2731   18.0037  109.5999  C     
29   N        15.3570   20.0331  108.0692  N     
30   C        15.6805   21.3158  107.7907  C     
31   C        15.3309   22.0199  106.5613  C     
32   O        16.2728   21.9954  108.6243  O     
33   H        18.8219   16.4713  108.5449  H     
34   H        18.1655   15.6402  107.0699  H     
35   H        20.4707   13.0761  109.0090  H     
36   H        17.3164   11.8193  111.1125  H     
37   H        19.7473   15.2786  111.1890  H     
38   H        19.8665   15.1189  113.5973  H     
39   H        18.6914   13.3465  114.7654  H     
40   H        17.4200   11.7069  113.5141  H     
41   H        23.8825   13.8556  105.9061  H     
42   H        24.0033   16.0778  104.9666  H     
43   H        20.2940   17.0491  106.6638  H     
44   H        14.0635   14.5420  107.6202  H     
45   H        13.4731   16.1632  107.9389  H     
46   H        13.6315   15.0342  109.2741  H     
47   H        18.0351   12.6765  109.0172  H     
48   H        16.9017   17.3042  108.4941  H     
49   H        15.0757   20.0847  110.1453  H     
50   H        16.6932   19.6049  109.6080  H     
51   H        14.6540   19.5536  106.0940  H     
52   H        13.6810   18.9841  107.4425  H     
53   H        16.3434   17.9034  106.4229  H     
54   H        14.7925   17.0856  106.4543  H     
55   H        14.1903   17.9080  109.6740  H     
56   H        15.6967   17.6481  110.5400  H     
57   H        15.8414   21.5770  105.7070  H     
58   H        15.6106   23.0799  106.6000  H     
59   H        14.2530   21.9676  106.4049  H     
@<TRIPOS>BOND
     1    1   20 2
     2    2    3 1
     3    2    4 2
     4    2   12 1
     5    3    5 1
     6    4   23 1
     7    5   20 1
     8    5   23 1
     9    6    7 2
    10    6    8 1
    11   23    6 1
    12    7   11 1
    13    8    9 2
    14    9   10 1
    15   10   11 2
    16   12   16 2
    17   12   17 1
    18   13   14 1
    19   13   17 2
    20   14   15 2
    21   15   16 1
    22   15   19 1
    23   17   18 1
    24   20   21 am
    25   21   22 1
    26   21   24 1
    27   24   27 1
    28   24   28 1
    29   25   28 1
    30   25   29 1
    31   26   27 1
    32   26   29 1
    33   29   30 am
    34   30   31 1
    35   30   32 2
    36    3   33 1
    37    3   34 1
    38    4   35 1
    39    7   36 1
    40    8   37 1
    41    9   38 1
    42   10   39 1
    43   11   40 1
    44   13   41 1
    45   14   42 1
    46   16   43 1
    47   22   44 1
    48   22   45 1
    49   22   46 1
    50   23   47 1
    51   24   48 1
    52   25   49 1
    53   25   50 1
    54   26   51 1
    55   26   52 1
    56   27   53 1
    57   27   54 1
    58   28   55 1
    59   28   56 1
    60   31   57 1
    61   31   58 1
    62   31   59 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 6.7938
  Crash		| -1.5402
  Polar		| 0.0000
  FragIndex	| 1
  FragRMSD	| 1.299

@<TRIPOS>MOLECULE
BindingDB_24056
 51 53 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    O        16.8602   17.5121  109.0212  O     
2    C        20.0048   15.2401  107.8853  C     
3    C        18.9919   16.2650  108.0542  C     
4    C        19.5820   14.1560  108.5454  C     
5    N        17.9029   15.6406  108.7610  N     
6    C        18.3019   14.0324  110.5943  C     
7    C        17.5409   12.9698  111.1442  C     
8    C        19.1516   14.7609  111.4646  C     
9    C        19.2309   14.4450  112.8350  C     
10   C        18.4745   13.3862  113.3594  C     
11   C        17.6186   12.6543  112.5153  C     
12   C        21.1659   15.3775  107.0820  C     
13   C        23.3153   14.5572  106.1643  C     
14   C        23.3931   15.6618  105.3033  C     
15   C        22.4026   16.6462  105.3415  C     
16   C        21.3106   16.5100  106.2219  C     
17   C        22.2262   14.4240  107.0470  C     
18   F        22.2888   13.3871  107.8386  F     
19   F        22.4826   17.6863  104.5465  F     
20   C        16.7439   16.2876  109.0164  C     
21   N        15.4929   15.8004  109.2348  N     
22   C        14.4931   16.7013  109.7940  C     
23   C        18.2761   14.3044  109.1186  C     
24   C        15.0102   14.5030  108.7640  C     
25   C        16.0278   14.2728  106.3133  C     
26   C        14.7723   14.4160  107.2227  C     
27   N        16.3181   12.8898  105.9015  N     
28   H        19.3994   17.1140  108.6144  H     
29   H        18.6157   16.6047  107.0794  H     
30   H        20.0441   13.2937  108.5619  H     
31   H        16.9236   12.4105  110.5497  H     
32   H        19.7241   15.5277  111.1045  H     
33   H        19.8653   14.9655  113.4428  H     
34   H        18.5378   13.1454  114.3532  H     
35   H        17.0721   11.8796  112.8930  H     
36   H        24.0558   13.8558  106.1363  H     
37   H        24.1842   15.7462  104.6577  H     
38   H        20.6185   17.2576  106.2088  H     
39   H        14.8505   17.1124  110.7455  H     
40   H        13.5259   16.2345  109.9948  H     
41   H        14.3037   17.5284  109.1015  H     
42   H        17.6745   13.5739  108.5792  H     
43   H        15.6389   13.6826  109.0862  H     
44   H        14.0496   14.2628  109.2303  H     
45   H        15.8690   14.8506  105.3985  H     
46   H        16.9087   14.6640  106.8160  H     
47   H        14.1087   13.5616  107.0227  H     
48   H        14.2229   15.3132  106.9143  H     
49   H        16.3613   12.2695  106.7138  H     
50   H        17.2200   12.8614  105.4033  H     
51   H        15.5811   12.5583  105.2658  H     
@<TRIPOS>BOND
     1    1   20 2
     2    2    3 1
     3    2    4 2
     4    2   12 1
     5    3    5 1
     6    4   23 1
     7    5   20 1
     8    5   23 1
     9    6    7 2
    10    6    8 1
    11   23    6 1
    12    7   11 1
    13    8    9 2
    14    9   10 1
    15   10   11 2
    16   12   16 2
    17   12   17 1
    18   13   14 1
    19   13   17 2
    20   14   15 2
    21   15   16 1
    22   15   19 1
    23   17   18 1
    24   20   21 am
    25   21   22 1
    26   21   24 1
    27   24   26 1
    28   25   26 1
    29   25   27 1
    30    3   28 1
    31    3   29 1
    32    4   30 1
    33    7   31 1
    34    8   32 1
    35    9   33 1
    36   10   34 1
    37   11   35 1
    38   13   36 1
    39   14   37 1
    40   16   38 1
    41   22   39 1
    42   22   40 1
    43   22   41 1
    44   23   42 1
    45   24   43 1
    46   24   44 1
    47   25   45 1
    48   25   46 1
    49   26   47 1
    50   26   48 1
    51   27   49 1
    52   27   50 1
    53   27   51 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 8.0927
  Crash		| -1.2108
  Polar		| 2.9821
  FragIndex	| 1
  FragRMSD	| 0.192

@<TRIPOS>MOLECULE
BindingDB_24057
 49 51 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    O        16.0015   15.1923  110.0999  O     
2    C        19.8476   15.0786  107.8900  C     
3    C        18.7614   16.0346  108.0220  C     
4    C        19.5103   13.9868  108.5831  C     
5    N        17.8453   15.4653  108.9785  N     
6    C        18.4565   13.8688  110.7655  C     
7    C        17.7737   12.7816  111.3663  C     
8    C        19.2349   14.7094  111.6035  C     
9    C        19.3436   14.4549  112.9892  C     
10   C        18.6651   13.3659  113.5632  C     
11   C        17.8806   12.5342  112.7524  C     
12   C        21.0011   15.2521  107.0754  C     
13   C        23.1981   14.5434  106.1689  C     
14   C        23.2643   15.6971  105.3682  C     
15   C        22.2498   16.6533  105.4424  C     
16   C        21.1359   16.4352  106.2839  C     
17   C        22.0956   14.3362  107.0294  C     
18   F        22.1879   13.2692  107.7822  F     
19   F        22.3057   17.7277  104.6890  F     
20   C        16.6814   15.9763  109.4303  C     
21   C        18.2840   14.1333  109.2982  C     
22   C        17.0735   18.4221  109.7475  C     
23   C        15.7265   17.5996  107.7296  C     
24   C        16.0810   17.3288  109.2304  C     
25   C        14.7556   17.5494  110.0784  C     
26   N        13.5520   16.8816  109.5460  N     
27   H        19.1465   17.0099  108.3398  H     
28   H        18.2629   16.1370  107.0473  H     
29   H        20.0188   13.1347  108.6121  H     
30   H        17.1995   12.1524  110.7996  H     
31   H        19.7400   15.5044  111.2078  H     
32   H        19.9305   15.0582  113.5683  H     
33   H        18.7461   13.1809  114.5610  H     
34   H        17.3877   11.7412  113.1715  H     
35   H        23.9612   13.8609  106.1241  H     
36   H        24.0553   15.8266  104.7386  H     
37   H        20.4093   17.1569  106.2732  H     
38   H        17.5851   13.4262  108.8475  H     
39   H        17.2554   18.3024  110.8128  H     
40   H        16.6476   19.4208  109.5981  H     
41   H        18.0462   18.3820  109.2461  H     
42   H        16.6099   17.6774  107.0828  H     
43   H        15.1901   18.5549  107.6216  H     
44   H        15.0887   16.8068  107.3237  H     
45   H        14.9013   17.1742  111.0960  H     
46   H        14.5225   18.6115  110.1719  H     
47   H        13.2539   17.3163  108.6735  H     
48   H        12.7818   16.9510  110.2297  H     
49   H        13.7579   15.8947  109.3819  H     
@<TRIPOS>BOND
     1    1   20 2
     2    2    3 1
     3    2    4 2
     4    2   12 1
     5    3    5 1
     6    4   21 1
     7    5   20 am
     8    5   21 1
     9    6    7 2
    10    6    8 1
    11   21    6 1
    12    7   11 1
    13    8    9 2
    14    9   10 1
    15   10   11 2
    16   12   16 2
    17   12   17 1
    18   13   14 1
    19   13   17 2
    20   14   15 2
    21   15   16 1
    22   15   19 1
    23   17   18 1
    24   20   24 1
    25   22   24 1
    26   23   24 1
    27   24   25 1
    28   25   26 1
    29    3   27 1
    30    3   28 1
    31    4   29 1
    32    7   30 1
    33    8   31 1
    34    9   32 1
    35   10   33 1
    36   11   34 1
    37   13   35 1
    38   14   36 1
    39   16   37 1
    40   21   38 1
    41   22   39 1
    42   22   40 1
    43   22   41 1
    44   23   42 1
    45   23   43 1
    46   23   44 1
    47   25   45 1
    48   25   46 1
    49   26   47 1
    50   26   48 1
    51   26   49 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 7.0576
  Crash		| -1.0559
  Polar		| 0.0000
  FragIndex	| 1
  FragRMSD	| 0.651

@<TRIPOS>MOLECULE
BindingDB_50181135
 56 59 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        23.0800   16.0206  105.7690  C     
2    C        21.9482   16.8183  105.9892  C     
3    C        20.8384   16.2877  106.6740  C     
4    C        20.8211   14.9558  107.1819  C     
5    C        22.0085   14.1869  106.9663  C     
6    C        23.1094   14.7090  106.2589  C     
7    C        19.6768   14.4824  107.8839  C     
8    C        18.3188   14.9951  107.7342  C     
9    N        17.5414   14.3039  108.7285  N     
10   C        18.3376   13.2835  109.3553  C     
11   C        19.6275   13.4771  108.7678  C     
12   C        18.3527   13.3414  110.8545  C     
13   C        19.0814   14.3284  111.5643  C     
14   C        19.0714   14.3572  112.9718  C     
15   C        18.2966   13.4308  113.6908  C     
16   C        17.5252   12.4754  113.0068  C     
17   C        17.5789   12.4169  111.5993  C     
18   C        16.2087   14.3898  108.9041  C     
19   O        15.6718   13.5627  109.6377  O     
20   F        22.1900   12.9794  107.4266  F     
21   F        21.9310   18.0488  105.5521  F     
22   O        16.7283   11.6337  113.7134  O     
23   N        15.3716   15.2668  108.3323  N     
24   C        14.1298   14.7387  107.7834  C     
25   C        15.3682   16.6771  108.7305  C     
26   C        16.3358   17.1228  109.8873  C     
27   C        16.2881   18.6553  110.1082  C     
28   N        16.4285   19.3995  108.8402  N     
29   C        15.3673   19.0964  107.8641  C     
30   C        15.4295   17.6018  107.4738  C     
31   H        23.8874   16.3940  105.2665  H     
32   H        20.0320   16.9035  106.7919  H     
33   H        23.9492   14.1424  106.1064  H     
34   H        18.3179   16.0739  107.8703  H     
35   H        17.9384   14.7528  106.7352  H     
36   H        17.9776   12.3059  109.0100  H     
37   H        20.3738   12.8716  108.9975  H     
38   H        19.6377   15.0226  111.0604  H     
39   H        19.6195   15.0589  113.4735  H     
40   H        18.2800   13.4652  114.7126  H     
41   H        17.0209   11.7056  111.1189  H     
42   H        15.9177   11.4976  113.1760  H     
43   H        14.2650   13.7414  107.3520  H     
44   H        13.7477   15.3765  106.9853  H     
45   H        13.3688   14.6725  108.5663  H     
46   H        14.3794   16.8749  109.1671  H     
47   H        16.0200   16.6355  110.8163  H     
48   H        17.3760   16.8389  109.7333  H     
49   H        15.3438   18.9342  110.5846  H     
50   H        17.1028   18.9399  110.7748  H     
51   H        16.4104   20.4019  109.0404  H     
52   H        17.3281   19.1601  108.4202  H     
53   H        14.3876   19.3450  108.2817  H     
54   H        15.5183   19.7167  106.9804  H     
55   H        16.3393   17.4219  106.9052  H     
56   H        14.5809   17.3987  106.8166  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    6 1
     3    2    3 1
     4    2   21 1
     5    3    4 2
     6    4    5 1
     7    4    7 1
     8    5    6 2
     9    5   20 1
    10    7    8 1
    11    7   11 2
    12    8    9 1
    13    9   10 1
    14    9   18 1
    15   10   11 1
    16   10   12 1
    17   12   13 2
    18   12   17 1
    19   13   14 1
    20   14   15 2
    21   15   16 1
    22   16   17 2
    23   16   22 1
    24   18   19 2
    25   18   23 am
    26   23   24 1
    27   23   25 1
    28   25   26 1
    29   25   30 1
    30   26   27 1
    31   27   28 1
    32   28   29 1
    33   29   30 1
    34    1   31 1
    35    3   32 1
    36    6   33 1
    37    8   34 1
    38    8   35 1
    39   10   36 1
    40   11   37 1
    41   13   38 1
    42   14   39 1
    43   15   40 1
    44   17   41 1
    45   22   42 1
    46   24   43 1
    47   24   44 1
    48   24   45 1
    49   25   46 1
    50   26   47 1
    51   26   48 1
    52   27   49 1
    53   27   50 1
    54   28   51 1
    55   28   52 1
    56   29   53 1
    57   29   54 1
    58   30   55 1
    59   30   56 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 6.9986
  Crash		| -1.9583
  Polar		| 0.6751
  FragIndex	| 1
  FragRMSD	| 1.322

@<TRIPOS>MOLECULE
BindingDB_50181136
 43 45 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        23.2373   15.8287  105.7555  C     
2    C        22.1864   16.7568  105.8117  C     
3    C        21.0358   16.4667  106.5668  C     
4    C        20.8899   15.2469  107.2982  C     
5    C        21.9670   14.3176  107.1923  C     
6    C        23.1217   14.6088  106.4326  C     
7    C        19.7270   15.0301  108.0893  C     
8    C        18.7229   16.0471  108.3754  C     
9    N        17.7353   15.4101  109.2086  N     
10   C        18.1357   14.0610  109.4725  C     
11   C        19.3445   13.9126  108.7129  C     
12   C        18.3741   13.7732  110.9203  C     
13   C        17.7334   12.6841  111.5537  C     
14   C        17.9864   12.3874  112.9057  C     
15   C        18.8895   13.1736  113.6433  C     
16   C        19.5125   14.2776  113.0382  C     
17   C        19.2483   14.5822  111.6897  C     
18   C        16.5569   15.9448  109.6067  C     
19   O        15.7846   15.1347  110.1270  O     
20   F        21.9773   13.1643  107.8048  F     
21   F        22.2863   17.8806  105.1566  F     
22   O        20.3964   15.0295  113.7353  O     
23   N        16.0919   17.2096  109.5154  N     
24   C        16.9698   18.3303  109.2241  C     
25   C        14.6923   17.4971  109.7704  C     
26   H        24.0892   16.0437  105.2275  H     
27   H        20.2963   17.1703  106.5623  H     
28   H        23.8921   13.9395  106.3864  H     
29   H        19.1774   16.8948  108.8964  H     
30   H        18.2624   16.3593  107.4397  H     
31   H        17.3958   13.3714  109.0454  H     
32   H        19.8140   13.0401  108.6679  H     
33   H        17.0787   12.0905  111.0352  H     
34   H        17.5263   11.5907  113.3500  H     
35   H        19.0924   12.9363  114.6153  H     
36   H        19.7048   15.3948  111.2666  H     
37   H        21.1774   14.4488  113.8613  H     
38   H        17.8098   18.3392  109.9196  H     
39   H        16.4707   19.3041  109.3255  H     
40   H        17.3501   18.2682  108.2068  H     
41   H        14.0671   16.8750  109.1224  H     
42   H        14.4025   18.5352  109.5832  H     
43   H        14.4490   17.2720  110.8124  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    6 1
     3    2    3 1
     4    2   21 1
     5    3    4 2
     6    4    5 1
     7    4    7 1
     8    5    6 2
     9    5   20 1
    10    7    8 1
    11    7   11 2
    12    8    9 1
    13    9   10 1
    14    9   18 1
    15   10   11 1
    16   10   12 1
    17   12   13 2
    18   12   17 1
    19   13   14 1
    20   14   15 2
    21   15   16 1
    22   16   17 2
    23   16   22 1
    24   18   19 2
    25   18   23 am
    26   23   24 1
    27   23   25 1
    28    1   26 1
    29    3   27 1
    30    6   28 1
    31    8   29 1
    32    8   30 1
    33   10   31 1
    34   11   32 1
    35   13   33 1
    36   14   34 1
    37   15   35 1
    38   17   36 1
    39   22   37 1
    40   24   38 1
    41   24   39 1
    42   24   40 1
    43   25   41 1
    44   25   42 1
    45   25   43 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 6.8985
  Crash		| -0.7350
  Polar		| 0.0000
  FragIndex	| 1
  FragRMSD	| 1.138

@<TRIPOS>MOLECULE
BindingDB_50181142
 47 49 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        23.2914   15.8422  105.8383  C     
2    C        22.2259   16.7440  105.9221  C     
3    C        21.0394   16.3667  106.5750  C     
4    C        20.8706   15.0866  107.1799  C     
5    C        21.9768   14.1858  107.0638  C     
6    C        23.1603   14.5616  106.4048  C     
7    C        19.6673   14.7948  107.8810  C     
8    C        18.5919   15.7488  108.0615  C     
9    N        17.5985   15.1115  108.8821  N     
10   C        18.0651   13.8066  109.2540  C     
11   C        19.3191   13.6893  108.5439  C     
12   C        18.2498   13.6641  110.7346  C     
13   C        19.1823   14.4730  111.4351  C     
14   C        19.3894   14.3135  112.8174  C     
15   C        18.6479   13.3592  113.5328  C     
16   C        17.6832   12.5763  112.8722  C     
17   C        17.4898   12.7289  111.4815  C     
18   C        16.3659   15.5964  109.1508  C     
19   O        15.5549   14.7410  109.5114  O     
20   F        21.9679   12.9790  107.5645  F     
21   F        22.3390   17.9415  105.4085  F     
22   O        16.9561   11.6859  113.5947  O     
23   N        15.9006   16.8662  109.1048  N     
24   C        14.4607   17.1045  109.0692  C     
25   C        16.7707   18.0324  109.1721  C     
26   C        17.7480   18.0072  110.3797  C     
27   O        19.0020   18.5868  110.0372  O     
28   H        24.1620   16.1148  105.3823  H     
29   H        20.2954   17.0681  106.6026  H     
30   H        23.9476   13.9159  106.3303  H     
31   H        19.0015   16.6398  108.5497  H     
32   H        18.1541   16.0064  107.0901  H     
33   H        17.3968   13.0393  108.8520  H     
34   H        19.8651   12.8557  108.5945  H     
35   H        19.7430   15.1706  110.9375  H     
36   H        20.0891   14.8850  113.2993  H     
37   H        18.8049   13.2445  114.5345  H     
38   H        16.7937   12.1436  111.0103  H     
39   H        16.1202   11.5317  113.1050  H     
40   H        14.0209   16.5591  108.2297  H     
41   H        14.1777   18.1511  108.9414  H     
42   H        13.9934   16.7523  109.9932  H     
43   H        17.3131   18.1282  108.2241  H     
44   H        16.2187   18.9717  109.2558  H     
45   H        17.3200   18.5583  111.2177  H     
46   H        17.9427   16.9948  110.7163  H     
47   H        19.5007   18.6577  110.8810  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    6 1
     3    2    3 1
     4    2   21 1
     5    3    4 2
     6    4    5 1
     7    4    7 1
     8    5    6 2
     9    5   20 1
    10    7    8 1
    11    7   11 2
    12    8    9 1
    13    9   10 1
    14    9   18 1
    15   10   11 1
    16   10   12 1
    17   12   13 2
    18   12   17 1
    19   13   14 1
    20   14   15 2
    21   15   16 1
    22   16   17 2
    23   16   22 1
    24   18   19 2
    25   18   23 am
    26   23   24 1
    27   23   25 1
    28   25   26 1
    29   26   27 1
    30    1   28 1
    31    3   29 1
    32    6   30 1
    33    8   31 1
    34    8   32 1
    35   10   33 1
    36   11   34 1
    37   13   35 1
    38   14   36 1
    39   15   37 1
    40   17   38 1
    41   22   39 1
    42   24   40 1
    43   24   41 1
    44   24   42 1
    45   25   43 1
    46   25   44 1
    47   26   45 1
    48   26   46 1
    49   27   47 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 6.7373
  Crash		| -1.5427
  Polar		| 0.7107
  FragIndex	| 1
  FragRMSD	| 1.112

@<TRIPOS>MOLECULE
BindingDB_50209227
 60 62 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        21.1343   16.5183  106.4596  C     
2    C        21.0332   15.3356  107.2419  C     
3    C        22.1253   14.4225  107.1592  C     
4    C        23.2188   14.6603  106.3089  C     
5    C        23.2808   15.8347  105.5396  C     
6    C        22.2386   16.7739  105.6273  C     
7    F        22.3092   17.8748  104.9389  F     
8    F        22.2219   13.3270  107.8712  F     
9    C        19.8632   15.1129  108.0227  C     
10   C        18.8086   16.0808  108.2754  C     
11   N        17.7973   15.4233  109.0648  N     
12   C        18.1944   14.0264  109.2465  C     
13   C        19.4794   13.9657  108.5912  C     
14   C        16.6583   15.9633  109.5661  C     
15   C        18.4132   13.7256  110.7279  C     
16   C        19.2493   14.5843  111.5004  C     
17   C        19.4471   14.3820  112.8738  C     
18   C        18.8229   13.3038  113.5242  C     
19   C        17.9921   12.4424  112.7943  C     
20   C        17.8014   12.6390  111.4130  C     
21   C        17.2475   13.0275  108.4769  C     
22   C        16.9834   13.3037  106.9503  C     
23   C        15.6846   14.0681  106.6302  C     
24   N        14.5077   13.1763  106.7856  N     
25   O        15.9388   15.1463  110.1443  O     
26   N        16.2029   17.2406  109.5993  N     
27   C        14.8993   17.5461  110.1907  C     
28   C        16.9540   18.3698  109.0968  C     
29   C        13.2620   13.7943  107.2999  C     
30   C        13.4897   14.6055  108.6018  C     
31   H        20.3969   17.2303  106.4680  H     
32   H        23.9877   13.9937  106.2505  H     
33   H        24.0870   16.0035  104.9440  H     
34   H        19.2433   16.9154  108.8205  H     
35   H        18.3755   16.4046  107.3262  H     
36   H        19.9885   13.1200  108.5228  H     
37   H        19.7125   15.3822  111.0655  H     
38   H        20.0547   15.0091  113.4059  H     
39   H        18.9500   13.1650  114.5307  H     
40   H        17.5223   11.6655  113.2684  H     
41   H        17.1944   11.9808  110.9307  H     
42   H        17.6738   12.0214  108.5480  H     
43   H        16.2816   12.9763  108.9854  H     
44   H        17.8125   13.8543  106.5129  H     
45   H        16.9327   12.3458  106.4172  H     
46   H        15.6161   14.9663  107.2617  H     
47   H        15.6961   14.4132  105.5857  H     
48   H        14.2860   12.7717  105.8625  H     
49   H        14.7547   12.3936  107.3985  H     
50   H        14.1072   17.0726  109.6134  H     
51   H        14.6501   18.6050  110.2412  H     
52   H        14.8488   17.1737  111.2152  H     
53   H        17.8834   18.4691  109.6563  H     
54   H        16.4508   19.3339  109.1873  H     
55   H        17.1664   18.2457  108.0356  H     
56   H        12.8150   14.4388  106.5295  H     
57   H        12.5569   12.9957  107.5361  H     
58   H        13.9023   13.9528  109.3744  H     
59   H        12.5400   15.0214  108.9656  H     
60   H        14.1899   15.4236  108.4157  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    6 1
     3    2    3 1
     4    2    9 1
     5    3    4 2
     6    3    8 1
     7    4    5 1
     8    5    6 2
     9    6    7 1
    10    9   10 1
    11    9   13 2
    12   10   11 1
    13   11   12 1
    14   11   14 1
    15   12   13 1
    16   12   15 1
    17   12   21 1
    18   14   25 2
    19   14   26 am
    20   15   16 2
    21   15   20 1
    22   16   17 1
    23   17   18 2
    24   18   19 1
    25   19   20 2
    26   21   22 1
    27   22   23 1
    28   23   24 1
    29   24   29 1
    30   26   27 1
    31   26   28 1
    32   29   30 1
    33    1   31 1
    34    4   32 1
    35    5   33 1
    36   10   34 1
    37   10   35 1
    38   13   36 1
    39   16   37 1
    40   17   38 1
    41   18   39 1
    42   19   40 1
    43   20   41 1
    44   21   42 1
    45   21   43 1
    46   22   44 1
    47   22   45 1
    48   23   46 1
    49   23   47 1
    50   24   48 1
    51   24   49 1
    52   27   50 1
    53   27   51 1
    54   27   52 1
    55   28   53 1
    56   28   54 1
    57   28   55 1
    58   29   56 1
    59   29   57 1
    60   30   58 1
    61   30   59 1
    62   30   60 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 9.1993
  Crash		| -1.7527
  Polar		| 1.4306
  FragIndex	| 1
  FragRMSD	| 1.123

@<TRIPOS>MOLECULE
BindingDB_50209228
 54 56 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        20.9940   16.4765  106.4299  C     
2    C        20.8089   15.2917  107.2047  C     
3    C        21.8796   14.3432  107.1680  C     
4    C        23.0415   14.5689  106.4019  C     
5    C        23.1871   15.7516  105.6587  C     
6    C        22.1591   16.7042  105.6692  C     
7    F        22.2974   17.8049  104.9736  F     
8    F        21.8764   13.2375  107.8615  F     
9    C        19.6207   15.1205  107.9772  C     
10   C        18.6278   16.1506  108.1871  C     
11   N        17.6410   15.6038  109.0938  N     
12   C        17.9683   14.2102  109.3761  C     
13   C        19.1892   14.0284  108.6159  C     
14   C        16.5774   16.2680  109.6041  C     
15   C        18.3437   13.9788  110.8318  C     
16   C        17.8744   12.8687  111.5869  C     
17   C        18.2523   12.6653  112.9271  C     
18   C        19.1258   13.5664  113.5551  C     
19   C        19.6358   14.6523  112.8312  C     
20   C        19.2504   14.8551  111.4898  C     
21   C        16.8316   13.2596  108.8130  C     
22   C        16.0467   13.6657  107.5282  C     
23   C        16.8372   13.5318  106.2003  C     
24   N        16.4253   12.3625  105.4242  N     
25   O        15.9724   15.6390  110.4833  O     
26   N        15.9992   17.4444  109.2658  N     
27   C        14.8729   18.0246  109.9806  C     
28   C        16.3986   18.1874  108.0873  C     
29   H        20.2767   17.2053  106.4031  H     
30   H        23.8002   13.8827  106.3928  H     
31   H        24.0414   15.9129  105.1136  H     
32   H        19.1022   17.0286  108.6364  H     
33   H        18.1793   16.3905  107.2196  H     
34   H        19.6411   13.1437  108.5788  H     
35   H        17.2639   12.1681  111.1710  H     
36   H        17.9089   11.8490  113.4397  H     
37   H        19.4140   13.4085  114.5220  H     
38   H        20.3074   15.2849  113.2744  H     
39   H        19.6608   15.6466  110.9910  H     
40   H        17.2407   12.2588  108.6587  H     
41   H        16.0664   13.1641  109.5952  H     
42   H        15.1510   13.0401  107.4715  H     
43   H        15.6867   14.6926  107.6272  H     
44   H        16.6885   14.4201  105.5821  H     
45   H        17.9059   13.4194  106.3723  H     
46   H        16.3749   11.5456  106.0355  H     
47   H        17.1276   12.2161  104.6971  H     
48   H        15.5147   12.5297  104.9924  H     
49   H        14.0069   18.0806  109.3205  H     
50   H        15.1237   19.0351  110.3022  H     
51   H        14.5589   17.4834  110.8732  H     
52   H        17.4237   18.5463  108.1849  H     
53   H        15.7874   19.0752  107.9069  H     
54   H        16.2912   17.5605  107.1988  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    6 1
     3    2    3 1
     4    2    9 1
     5    3    4 2
     6    3    8 1
     7    4    5 1
     8    5    6 2
     9    6    7 1
    10    9   10 1
    11    9   13 2
    12   10   11 1
    13   11   12 1
    14   11   14 1
    15   12   13 1
    16   12   15 1
    17   12   21 1
    18   14   25 2
    19   14   26 am
    20   15   16 2
    21   15   20 1
    22   16   17 1
    23   17   18 2
    24   18   19 1
    25   19   20 2
    26   21   22 1
    27   22   23 1
    28   23   24 1
    29   26   27 1
    30   26   28 1
    31    1   29 1
    32    4   30 1
    33    5   31 1
    34   10   32 1
    35   10   33 1
    36   13   34 1
    37   16   35 1
    38   17   36 1
    39   18   37 1
    40   19   38 1
    41   20   39 1
    42   21   40 1
    43   21   41 1
    44   22   42 1
    45   22   43 1
    46   23   44 1
    47   23   45 1
    48   24   46 1
    49   24   47 1
    50   24   48 1
    51   27   49 1
    52   27   50 1
    53   27   51 1
    54   28   52 1
    55   28   53 1
    56   28   54 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 9.4796
  Crash		| -1.2860
  Polar		| 2.5806
  FragIndex	| 1
  FragRMSD	| 1.093

@<TRIPOS>MOLECULE
BindingDB_50209229
 60 62 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        21.2611   16.5618  106.1733  C     
2    C        21.0540   15.3968  106.9742  C     
3    C        22.1144   14.4404  106.9918  C     
4    C        23.2832   14.6325  106.2271  C     
5    C        23.4394   15.7790  105.4355  C     
6    C        22.4326   16.7497  105.4116  C     
7    F        22.5864   17.8202  104.6802  F     
8    F        22.0960   13.3675  107.7270  F     
9    C        19.8223   15.2455  107.6632  C     
10   C        18.8059   16.2610  107.7592  C     
11   N        17.6732   15.6983  108.4628  N     
12   C        17.9515   14.2893  108.7479  C     
13   C        19.3373   14.1735  108.2974  C     
14   C        16.6403   16.5101  108.8267  C     
15   C        18.0144   14.0003  110.2409  C     
16   C        18.9258   14.7064  111.0772  C     
17   C        19.1194   14.3498  112.4220  C     
18   C        18.3913   13.2875  112.9811  C     
19   C        17.4637   12.5908  112.1901  C     
20   C        17.2785   12.9425  110.8399  C     
21   C        17.1540   13.2586  107.8294  C     
22   C        16.9132   13.7352  106.3629  C     
23   C        16.3350   12.6741  105.4023  C     
24   N        14.9377   12.2845  105.7162  N     
25   O        16.8460   17.7148  108.6394  O     
26   N        15.4194   16.2362  109.3568  N     
27   C        14.7890   14.9523  109.2043  C     
28   C        14.6293   17.2864  109.9867  C     
29   C        14.2389   11.4418  104.7069  C     
30   C        14.3432    9.9097  104.9335  C     
31   F        14.5608    9.2521  103.7455  F     
32   F        15.3602    9.5586  105.7929  F     
33   H        20.5692   17.3130  106.1200  H     
34   H        24.0222   13.9336  106.2447  H     
35   H        24.2859   15.8984  104.8834  H     
36   H        19.2330   17.1118  108.3032  H     
37   H        18.4740   16.5727  106.7623  H     
38   H        19.8305   13.3164  108.3970  H     
39   H        19.4875   15.4683  110.6979  H     
40   H        19.8068   14.8471  112.9883  H     
41   H        18.5539   13.0099  113.9512  H     
42   H        16.9353   11.8135  112.5933  H     
43   H        16.6297   12.3733  110.2974  H     
44   H        17.6916   12.3076  107.7821  H     
45   H        16.1906   13.0140  108.2830  H     
46   H        16.2526   14.6047  106.3584  H     
47   H        17.8682   14.0565  105.9475  H     
48   H        16.3764   13.0874  104.3941  H     
49   H        16.9677   11.7932  105.4273  H     
50   H        14.9383   11.7843  106.6066  H     
51   H        14.3918   13.1456  105.8405  H     
52   H        14.8979   14.6057  108.1579  H     
53   H        13.7135   14.9751  109.4080  H     
54   H        15.2401   14.2555  109.9146  H     
55   H        15.2360   17.7708  110.7585  H     
56   H        13.7163   16.9323  110.4816  H     
57   H        14.3374   18.0247  109.2338  H     
58   H        13.1803   11.7056  104.7495  H     
59   H        14.5853   11.7053  103.7099  H     
60   H        13.4125    9.5201  105.3383  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    6 1
     3    2    3 1
     4    2    9 1
     5    3    4 2
     6    3    8 1
     7    4    5 1
     8    5    6 2
     9    6    7 1
    10    9   10 1
    11    9   13 2
    12   10   11 1
    13   11   12 1
    14   11   14 1
    15   12   13 1
    16   12   15 1
    17   12   21 1
    18   14   25 2
    19   14   26 am
    20   15   16 2
    21   15   20 1
    22   16   17 1
    23   17   18 2
    24   18   19 1
    25   19   20 2
    26   21   22 1
    27   22   23 1
    28   23   24 1
    29   24   29 1
    30   26   27 1
    31   26   28 1
    32   29   30 1
    33   30   31 1
    34   30   32 1
    35    1   33 1
    36    4   34 1
    37    5   35 1
    38   10   36 1
    39   10   37 1
    40   13   38 1
    41   16   39 1
    42   17   40 1
    43   18   41 1
    44   19   42 1
    45   20   43 1
    46   21   44 1
    47   21   45 1
    48   22   46 1
    49   22   47 1
    50   23   48 1
    51   23   49 1
    52   24   50 1
    53   24   51 1
    54   27   52 1
    55   27   53 1
    56   27   54 1
    57   28   55 1
    58   28   56 1
    59   28   57 1
    60   29   58 1
    61   29   59 1
    62   30   60 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 9.7236
  Crash		| -2.3678
  Polar		| 2.6605
  FragIndex	| 1
  FragRMSD	| 0.324

@<TRIPOS>MOLECULE
BindingDB_50209231
 60 62 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        21.1591   16.5176  106.5038  C     
2    C        21.0425   15.3136  107.2598  C     
3    C        22.1560   14.4143  107.1772  C     
4    C        23.2599   14.6782  106.3350  C     
5    C        23.3154   15.8623  105.5907  C     
6    C        22.2722   16.7914  105.6836  C     
7    F        22.3344   17.9060  105.0067  F     
8    F        22.2965   13.3096  107.8620  F     
9    C        19.8638   15.0740  108.0253  C     
10   C        18.8005   16.0390  108.2677  C     
11   N        17.8053   15.3809  109.0587  N     
12   C        18.2056   13.9909  109.2469  C     
13   C        19.4907   13.9327  108.6059  C     
14   C        16.6567   15.8968  109.5649  C     
15   C        18.4130   13.6932  110.7258  C     
16   C        17.8226   12.5934  111.4041  C     
17   C        17.9686   12.4229  112.7979  C     
18   C        18.7371   13.3263  113.5460  C     
19   C        19.3767   14.3897  112.8955  C     
20   C        19.2246   14.5618  111.5052  C     
21   C        17.2619   12.9936  108.4588  C     
22   C        16.9978   13.2638  106.9351  C     
23   C        15.7275   14.1028  106.6348  C     
24   N        14.4989   13.3010  106.8791  N     
25   O        15.9921   15.0996  110.2315  O     
26   N        16.0997   17.1297  109.4675  N     
27   C        16.7707   18.2665  108.8707  C     
28   C        14.7531   17.3832  109.9886  C     
29   C        13.4176   13.8892  107.7051  C     
30   C        12.6598   15.0715  107.0523  C     
31   F        11.6147   15.4493  107.8581  F     
32   F        13.4624   16.1704  106.8703  F     
33   F        12.1441   14.6985  105.8353  F     
34   H        20.4230   17.2220  106.5216  H     
35   H        24.0338   14.0093  106.2610  H     
36   H        24.1223   16.0576  104.9923  H     
37   H        19.2321   16.8843  108.8020  H     
38   H        18.3779   16.3394  107.3070  H     
39   H        19.9808   13.0763  108.6095  H     
40   H        17.2627   11.9020  110.9083  H     
41   H        17.5020   11.6392  113.2675  H     
42   H        18.8448   13.1956  114.5581  H     
43   H        19.9523   15.0402  113.4343  H     
44   H        19.7140   15.3462  111.0741  H     
45   H        17.7017   11.9877  108.5301  H     
46   H        16.2996   12.9394  108.9726  H     
47   H        17.8592   13.7535  106.4824  H     
48   H        16.8756   12.3065  106.4190  H     
49   H        15.7640   15.0231  107.2143  H     
50   H        15.7375   14.3912  105.5790  H     
51   H        14.1055   13.0378  105.9734  H     
52   H        14.7889   12.4382  107.3400  H     
53   H        17.7017   18.4575  109.4035  H     
54   H        16.2070   19.1984  108.9136  H     
55   H        16.9721   18.0833  107.8156  H     
56   H        14.0316   16.7183  109.5042  H     
57   H        14.3825   18.4020  109.8412  H     
58   H        14.7345   17.1936  111.0665  H     
59   H        12.7004   13.0858  107.8799  H     
60   H        13.8079   14.1774  108.6829  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    6 1
     3    2    3 1
     4    2    9 1
     5    3    4 2
     6    3    8 1
     7    4    5 1
     8    5    6 2
     9    6    7 1
    10    9   10 1
    11    9   13 2
    12   10   11 1
    13   11   12 1
    14   11   14 1
    15   12   13 1
    16   12   15 1
    17   12   21 1
    18   14   25 2
    19   14   26 am
    20   15   16 2
    21   15   20 1
    22   16   17 1
    23   17   18 2
    24   18   19 1
    25   19   20 2
    26   21   22 1
    27   22   23 1
    28   23   24 1
    29   24   29 1
    30   26   27 1
    31   26   28 1
    32   29   30 1
    33   30   31 1
    34   30   32 1
    35   30   33 1
    36    1   34 1
    37    4   35 1
    38    5   36 1
    39   10   37 1
    40   10   38 1
    41   13   39 1
    42   16   40 1
    43   17   41 1
    44   18   42 1
    45   19   43 1
    46   20   44 1
    47   21   45 1
    48   21   46 1
    49   22   47 1
    50   22   48 1
    51   23   49 1
    52   23   50 1
    53   24   51 1
    54   24   52 1
    55   27   53 1
    56   27   54 1
    57   27   55 1
    58   28   56 1
    59   28   57 1
    60   28   58 1
    61   29   59 1
    62   29   60 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 9.0892
  Crash		| -1.2692
  Polar		| 1.4647
  FragIndex	| 1
  FragRMSD	| 1.094

@<TRIPOS>MOLECULE
BindingDB_50209232
 60 62 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        21.8397   14.5651  107.1861  C     
2    C        20.7482   15.4799  107.1828  C     
3    C        20.9293   16.6852  106.4354  C     
4    C        22.1240   16.9510  105.7366  C     
5    C        23.1767   16.0281  105.7600  C     
6    C        23.0321   14.8333  106.4827  C     
7    F        24.0198   13.9816  106.5094  F     
8    F        20.0161   17.6154  106.3151  F     
9    C        19.5667   15.2030  107.9242  C     
10   C        18.4736   16.1212  108.1148  C     
11   N        17.5515   15.4793  109.0163  N     
12   C        17.9926   14.1223  109.2790  C     
13   C        19.2328   14.0634  108.5362  C     
14   C        16.4246   16.0336  109.5196  C     
15   C        18.3599   13.8875  110.7379  C     
16   C        17.8949   12.7653  111.4754  C     
17   C        18.2455   12.5645  112.8196  C     
18   C        19.0809   13.4829  113.4719  C     
19   C        19.5772   14.5924  112.7693  C     
20   C        19.2140   14.7935  111.4193  C     
21   C        16.9195   13.1150  108.6853  C     
22   C        15.9308   13.5549  107.5552  C     
23   C        16.5085   13.6145  106.1120  C     
24   N        16.2267   12.4022  105.3064  N     
25   O        15.9534   15.4335  110.4946  O     
26   N        15.7080   17.0993  109.1036  N     
27   C        15.8759   17.6742  107.7876  C     
28   C        14.5947   17.5951  109.9019  C     
29   C        15.0246   12.4306  104.4367  C     
30   C        15.1875   13.3383  103.1821  C     
31   F        14.5693   14.5540  103.3545  F     
32   H        21.7978   13.6924  107.7139  H     
33   H        22.2316   17.8210  105.2045  H     
34   H        24.0441   16.2259  105.2570  H     
35   H        18.8351   17.0506  108.5553  H     
36   H        18.0132   16.2833  107.1450  H     
37   H        19.7809   13.2353  108.5171  H     
38   H        17.3090   12.0449  111.0375  H     
39   H        17.9013   11.7457  113.3257  H     
40   H        19.3586   13.3213  114.4437  H     
41   H        20.2042   15.2488  113.2388  H     
42   H        19.6180   15.5971  110.9336  H     
43   H        17.4318   12.2064  108.3481  H     
44   H        16.2698   12.8089  109.5121  H     
45   H        15.0918   12.8604  107.5676  H     
46   H        15.5093   14.5280  107.8053  H     
47   H        16.1364   14.5098  105.5987  H     
48   H        17.5929   13.7075  106.1423  H     
49   H        17.0396   12.2540  104.7057  H     
50   H        16.1562   11.6071  105.9495  H     
51   H        16.8187   18.2133  107.7261  H     
52   H        15.0877   18.3835  107.5105  H     
53   H        15.8426   16.8925  107.0304  H     
54   H        13.7972   16.8477  109.9264  H     
55   H        14.1627   18.5301  109.5321  H     
56   H        14.9301   17.7877  110.9197  H     
57   H        14.8534   11.4049  104.0997  H     
58   H        14.1443   12.7226  105.0198  H     
59   H        16.2420   13.5221  102.9608  H     
60   H        14.7433   12.8579  102.3041  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    6 1
     3    2    3 1
     4    2    9 1
     5    3    4 2
     6    3    8 1
     7    4    5 1
     8    5    6 2
     9    6    7 1
    10    9   10 1
    11    9   13 2
    12   10   11 1
    13   11   12 1
    14   11   14 1
    15   12   13 1
    16   12   15 1
    17   12   21 1
    18   14   25 2
    19   14   26 am
    20   15   16 2
    21   15   20 1
    22   16   17 1
    23   17   18 2
    24   18   19 1
    25   19   20 2
    26   21   22 1
    27   22   23 1
    28   23   24 1
    29   24   29 1
    30   26   27 1
    31   26   28 1
    32   29   30 1
    33   30   31 1
    34    1   32 1
    35    4   33 1
    36    5   34 1
    37   10   35 1
    38   10   36 1
    39   13   37 1
    40   16   38 1
    41   17   39 1
    42   18   40 1
    43   19   41 1
    44   20   42 1
    45   21   43 1
    46   21   44 1
    47   22   45 1
    48   22   46 1
    49   23   47 1
    50   23   48 1
    51   24   49 1
    52   24   50 1
    53   27   51 1
    54   27   52 1
    55   27   53 1
    56   28   54 1
    57   28   55 1
    58   28   56 1
    59   29   57 1
    60   29   58 1
    61   30   59 1
    62   30   60 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 7.4391
  Crash		| -2.4869
  Polar		| 2.9721
  FragIndex	| 1
  FragRMSD	| 1.169