REMARK  Name = BDB027932
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -5.027  -0.264  -0.309  0.00  0.00    -0.275 OA
ATOM      2  C   LIG    1       -3.815  -0.116  -0.192  0.00  0.00    +0.219 C 
ATOM      3  N   LIG    1       -3.283   1.081   0.213  0.00  0.00    -0.255 N 
ATOM      4  H   LIG    1       -3.952   1.791   0.481  0.00  0.00    +0.158 HD
ATOM      5  C   LIG    1       -1.972   1.344   0.531  0.00  0.00    +0.239 C 
ATOM      6  O   LIG    1       -1.661   2.398   1.086  0.00  0.00    -0.273 OA
ATOM      7  C   LIG    1       -0.941   0.271   0.132  0.00  0.00    +0.158 C 
ATOM      8  C   LIG    1       -1.576  -1.105   0.318  0.00  0.00    +0.041 C 
ATOM      9  C   LIG    1       -2.831  -1.209  -0.533  0.00  0.00    +0.098 C 
ENDROOT
BRANCH   7  10
ATOM     10  N   LIG    1        0.243   0.386   0.994  0.00  0.00    -0.331 N 
ATOM     11  H   LIG    1        0.214   1.249   1.555  0.00  0.00    +0.147 HD
BRANCH  10  12
ATOM     12  C   LIG    1        1.528   0.232   0.448  0.00  0.00    +0.063 A 
ATOM     13  C   LIG    1        2.619   0.861   1.078  0.00  0.00    +0.144 A 
ATOM     14  F   LIG    1        2.394   1.664   2.131  0.00  0.00    -0.204 F 
ATOM     15  C   LIG    1        3.929   0.698   0.636  0.00  0.00    +0.040 A 
ATOM     16  C   LIG    1        4.187  -0.133  -0.450  0.00  0.00    +0.003 A 
ATOM     17  C   LIG    1        3.132  -0.798  -1.072  0.00  0.00    +0.002 A 
ATOM     18  C   LIG    1        1.817  -0.627  -0.618  0.00  0.00    +0.026 A 
ENDBRANCH  10  12
ENDBRANCH   7  10
TORSDOF 2