REMARK  Name = BDB001065
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.050  -1.337   0.367  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -1.044  -2.579  -0.259  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1       -2.048  -3.448  -0.075  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1        0.004  -2.934  -1.101  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1        1.062  -2.044  -1.308  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1        1.078  -0.794  -0.667  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1        0.018  -0.450   0.186  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1  13
ATOM      8  C   LIG    1       -6.147   1.708  -1.064  0.00  0.00    +0.105 C 
ATOM      9  N   LIG    1       -5.944   0.527  -0.230  0.00  0.00    -0.302 NA
ATOM     10  C   LIG    1       -5.288   0.891   1.045  0.00  0.00    +0.103 C 
ATOM     11  C   LIG    1       -4.461  -0.248   1.665  0.00  0.00    +0.123 C 
ATOM     12  N   LIG    1       -3.393  -0.680   0.757  0.00  0.00    -0.295 N 
ATOM     13  C   LIG    1       -2.138  -0.962   1.283  0.00  0.00    +0.249 C 
ATOM     14  O   LIG    1       -1.859  -0.863   2.476  0.00  0.00    -0.270 OA
ATOM     15  C   LIG    1       -3.709  -0.613  -0.675  0.00  0.00    +0.123 C 
ATOM     16  C   LIG    1       -5.224  -0.543  -0.947  0.00  0.00    +0.103 C 
ENDBRANCH   1  13
BRANCH   6  17
ATOM     17  C   LIG    1        2.243   0.151  -0.861  0.00  0.00    +0.093 C 
BRANCH  17  18
ATOM     18  C   LIG    1        3.455  -0.114   0.028  0.00  0.00    +0.074 A 
ATOM     19  C   LIG    1        4.607   0.823  -0.057  0.00  0.00    +0.011 A 
ATOM     20  C   LIG    1        5.703   0.568   0.766  0.00  0.00    +0.050 A 
ATOM     21  C   LIG    1        6.823   1.407   0.742  0.00  0.00    +0.014 A 
ATOM     22  C   LIG    1        6.847   2.508  -0.113  0.00  0.00    +0.001 A 
ATOM     23  C   LIG    1        5.755   2.767  -0.941  0.00  0.00    +0.001 A 
ATOM     24  C   LIG    1        5.673  -0.599   1.661  0.00  0.00    +0.272 A 
ATOM     25  O   LIG    1        6.614  -0.860   2.402  0.00  0.00    -0.266 OA
ATOM     26  N   LIG    1        4.538  -1.369   1.607  0.00  0.00    -0.242 N 
ATOM     27  H   LIG    1        4.490  -2.175   2.224  0.00  0.00    +0.192 HD
ATOM     28  C   LIG    1        4.636   1.929  -0.917  0.00  0.00    +0.010 A 
ATOM     29  N   LIG    1        3.453  -1.145   0.820  0.00  0.00    -0.175 NA
ENDBRANCH  17  18
ENDBRANCH   6  17
TORSDOF 3