REMARK  Name = BDB061608
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.103  -2.221   1.452  0.00  0.00    +0.184 C 
ENDROOT
BRANCH   1   8
ATOM      2  C   LIG    1       -3.589  -1.594  -1.897  0.00  0.00    +0.047 C 
ATOM      3  C   LIG    1       -2.836  -1.064  -0.711  0.00  0.00    -0.007 A 
ATOM      4  C   LIG    1       -3.166   0.155  -0.094  0.00  0.00    +0.143 A 
ATOM      5  C   LIG    1       -2.373   0.637   0.959  0.00  0.00    +0.083 A 
ATOM      6 CL   LIG    1       -2.627   2.195   1.659  0.00  0.00    -0.080 Cl
ATOM      7  C   LIG    1       -1.323  -0.134   1.464  0.00  0.00    +0.029 A 
ATOM      8  C   LIG    1       -1.035  -1.388   0.914  0.00  0.00    -0.024 A 
ATOM      9  C   LIG    1       -1.787  -1.835  -0.181  0.00  0.00    +0.012 A 
BRANCH   4  10
ATOM     10  O   LIG    1       -4.184   0.898  -0.627  0.00  0.00    -0.473 OA
BRANCH  10  11
ATOM     11  C   LIG    1       -5.435   0.917   0.081  0.00  0.00    +0.200 C 
ATOM     12  C   LIG    1       -5.861   2.398   0.091  0.00  0.00    +0.067 C 
ATOM     13  C   LIG    1       -6.439   0.156  -0.806  0.00  0.00    +0.067 C 
BRANCH  11  14
ATOM     14  C   LIG    1       -5.596   0.294   1.501  0.00  0.00    +0.348 C 
ATOM     15  O   LIG    1       -5.014  -0.677   1.960  0.00  0.00    -0.247 OA
BRANCH  14  16
ATOM     16  O   LIG    1       -6.559   0.878   2.249  0.00  0.00    -0.478 OA
ATOM     17  H   LIG    1       -6.539   0.370   3.088  0.00  0.00    +0.295 HD
ENDBRANCH  14  16
ENDBRANCH  11  14
ENDBRANCH  10  11
ENDBRANCH   4  10
ENDBRANCH   1   8
BRANCH   1  18
ATOM     18  N   LIG    1        1.342  -1.948   0.764  0.00  0.00    -0.208 N 
ATOM     19  C   LIG    1        2.263  -0.950   1.108  0.00  0.00    +0.351 A 
ATOM     20  O   LIG    1        2.186  -0.237   2.099  0.00  0.00    -0.244 OA
ATOM     21  N   LIG    1        3.215  -0.972   0.101  0.00  0.00    -0.250 N 
ATOM     22  C   LIG    1        2.785  -1.931  -0.751  0.00  0.00    +0.230 A 
ATOM     23  N   LIG    1        1.688  -2.539  -0.423  0.00  0.00    -0.157 NA
BRANCH  21  24
ATOM     24  C   LIG    1        4.369  -0.160  -0.025  0.00  0.00    +0.053 A 
ATOM     25  C   LIG    1        4.692   0.812   0.930  0.00  0.00    +0.030 A 
ATOM     26  C   LIG    1        5.836   1.610   0.798  0.00  0.00    +0.048 A 
ATOM     27  C   LIG    1        6.694   1.462  -0.290  0.00  0.00    +0.130 A 
ATOM     28  C   LIG    1        6.390   0.502  -1.249  0.00  0.00    +0.048 A 
ATOM     29  C   LIG    1        5.242  -0.298  -1.116  0.00  0.00    +0.030 A 
BRANCH  27  30
ATOM     30  O   LIG    1        7.766   2.305  -0.288  0.00  0.00    -0.406 OA
BRANCH  30  31
ATOM     31  C   LIG    1        8.683   2.212  -1.365  0.00  0.00    +0.575 C 
ATOM     32  F   LIG    1        9.665   3.121  -1.180  0.00  0.00    -0.133 F 
ATOM     33  F   LIG    1        8.079   2.479  -2.543  0.00  0.00    -0.133 F 
ATOM     34  F   LIG    1        9.248   0.987  -1.418  0.00  0.00    -0.133 F 
ENDBRANCH  30  31
ENDBRANCH  27  30
ENDBRANCH  21  24
ENDBRANCH   1  18
TORSDOF 9