REMARK  Name = BDB051835
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.754  -0.225   2.392  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -0.621  -1.555   2.772  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        0.581  -2.148   2.798  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -1.744  -2.293   3.126  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -3.007  -1.692   3.096  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -3.161  -0.349   2.703  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -2.012   0.390   2.381  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1  12
ATOM      8  N   LIG    1        2.426   0.118  -1.793  0.00  0.00    -0.298 NA
ATOM      9  C   LIG    1        2.627   1.279  -0.899  0.00  0.00    +0.103 C 
ATOM     10  C   LIG    1        2.336   1.017   0.591  0.00  0.00    +0.123 C 
ATOM     11  N   LIG    1        1.036   0.379   0.809  0.00  0.00    -0.295 N 
ATOM     12  C   LIG    1        0.428   0.575   2.047  0.00  0.00    +0.249 C 
ATOM     13  O   LIG    1        0.784   1.422   2.863  0.00  0.00    -0.270 OA
ATOM     14  C   LIG    1        0.704  -0.720  -0.107  0.00  0.00    +0.123 C 
ATOM     15  C   LIG    1        1.056  -0.398  -1.574  0.00  0.00    +0.103 C 
BRANCH   8  16
ATOM     16  C   LIG    1        3.431  -0.951  -1.607  0.00  0.00    +0.100 C 
BRANCH  16  17
ATOM     17  C   LIG    1        4.857  -0.552  -2.062  0.00  0.00    +0.099 C 
BRANCH  17  19
ATOM     18  C   LIG    1        7.202  -1.112  -2.064  0.00  0.00    +0.104 C 
ATOM     19  N   LIG    1        5.843  -1.650  -1.942  0.00  0.00    -0.307 NA
ATOM     20  C   LIG    1        5.634  -2.679  -2.966  0.00  0.00    +0.104 C 
ENDBRANCH  17  19
ENDBRANCH  16  17
ENDBRANCH   8  16
ENDBRANCH   1  12
BRANCH   6  21
ATOM     21  C   LIG    1       -4.548   0.269   2.708  0.00  0.00    +0.090 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -4.775   1.371   1.697  0.00  0.00    +0.046 A 
ATOM     23  N   LIG    1       -4.890   1.135   0.303  0.00  0.00    -0.296 N 
ATOM     24  C   LIG    1       -5.023   2.215  -0.575  0.00  0.00    +0.114 A 
ATOM     25  C   LIG    1       -5.049   1.753  -1.876  0.00  0.00    +0.054 A 
ATOM     26  C   LIG    1       -4.981   0.351  -1.817  0.00  0.00    +0.078 A 
ATOM     27 CL   LIG    1       -5.017  -0.666  -3.178  0.00  0.00    -0.080 Cl
ATOM     28  C   LIG    1       -5.102   3.574  -0.096  0.00  0.00    +0.273 A 
ATOM     29  O   LIG    1       -5.228   4.560  -0.814  0.00  0.00    -0.266 OA
ATOM     30  N   LIG    1       -5.028   3.696   1.274  0.00  0.00    -0.326 N 
ATOM     31  H   LIG    1       -5.077   4.646   1.624  0.00  0.00    +0.168 HD
ATOM     32  C   LIG    1       -4.908  -0.001  -0.491  0.00  0.00    +0.133 A 
ATOM     33 CL   LIG    1       -4.889  -1.588   0.142  0.00  0.00    -0.062 Cl
ATOM     34  C   LIG    1       -4.861   2.645   2.140  0.00  0.00    +0.108 A 
ENDBRANCH  21  22
ENDBRANCH   6  21
TORSDOF 6