REMARK  Name = BDB051832
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.459   0.680  -0.642  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1        0.391  -0.445  -1.456  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1       -0.581  -0.580  -2.370  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1        1.327  -1.464  -1.320  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1        2.356  -1.348  -0.380  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1        2.473  -0.196   0.417  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1        1.503   0.814   0.282  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1  13
ATOM      8  C   LIG    1       -5.737   1.068  -0.500  0.00  0.00    +0.218 C 
ATOM      9  N   LIG    1       -4.614   1.373   0.251  0.00  0.00    -0.298 N 
ATOM     10  C   LIG    1       -4.010   2.698   0.061  0.00  0.00    +0.127 C 
ATOM     11  C   LIG    1       -2.812   2.609  -0.894  0.00  0.00    +0.127 C 
ATOM     12  N   LIG    1       -1.851   1.569  -0.484  0.00  0.00    -0.294 N 
ATOM     13  C   LIG    1       -0.507   1.783  -0.783  0.00  0.00    +0.249 C 
ATOM     14  O   LIG    1       -0.054   2.876  -1.116  0.00  0.00    -0.270 OA
ATOM     15  C   LIG    1       -2.437   0.266  -0.120  0.00  0.00    +0.127 C 
ATOM     16  C   LIG    1       -3.659   0.413   0.805  0.00  0.00    +0.127 C 
ATOM     17  O   LIG    1       -6.233   1.905  -1.263  0.00  0.00    -0.275 OA
BRANCH   8  19
ATOM     18  C   LIG    1       -5.650  -1.421  -1.089  0.00  0.00    +0.017 C 
ATOM     19  C   LIG    1       -6.417  -0.300  -0.398  0.00  0.00    +0.069 C 
ATOM     20  C   LIG    1       -6.870  -0.649   1.015  0.00  0.00    +0.017 C 
ENDBRANCH   8  19
ENDBRANCH   1  13
BRANCH   6  21
ATOM     21  C   LIG    1        3.566  -0.023   1.457  0.00  0.00    +0.090 C 
BRANCH  21  22
ATOM     22  C   LIG    1        4.860  -0.758   1.192  0.00  0.00    +0.046 A 
ATOM     23  N   LIG    1        5.805  -0.342   0.220  0.00  0.00    -0.296 N 
ATOM     24  C   LIG    1        6.962  -1.099   0.007  0.00  0.00    +0.114 A 
ATOM     25  C   LIG    1        7.708  -0.528  -1.004  0.00  0.00    +0.054 A 
ATOM     26  C   LIG    1        7.026   0.627  -1.420  0.00  0.00    +0.078 A 
ATOM     27 CL   LIG    1        7.579   1.675  -2.639  0.00  0.00    -0.080 Cl
ATOM     28  C   LIG    1        7.241  -2.284   0.780  0.00  0.00    +0.273 A 
ATOM     29  O   LIG    1        8.236  -2.988   0.643  0.00  0.00    -0.266 OA
ATOM     30  N   LIG    1        6.281  -2.587   1.720  0.00  0.00    -0.326 N 
ATOM     31  H   LIG    1        6.470  -3.416   2.273  0.00  0.00    +0.168 HD
ATOM     32  C   LIG    1        5.888   0.730  -0.656  0.00  0.00    +0.133 A 
ATOM     33 CL   LIG    1        4.733   1.987  -0.711  0.00  0.00    -0.062 Cl
ATOM     34  C   LIG    1        5.136  -1.862   1.922  0.00  0.00    +0.108 A 
ENDBRANCH  21  22
ENDBRANCH   6  21
TORSDOF 4