REMARK  Name = BDB000992
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.420  -0.294  -0.061  0.00  0.00    +0.128 A 
ATOM      2  N   LIG    1        0.141  -1.541  -0.197  0.00  0.00    -0.340 N 
ATOM      3  H   LIG    1       -0.381  -2.406  -0.165  0.00  0.00    +0.167 HD
ATOM      4  C   LIG    1        1.488  -1.392  -0.400  0.00  0.00    +0.070 A 
ATOM      5  C   LIG    1        1.694  -0.011  -0.395  0.00  0.00    +0.101 A 
ATOM      6  C   LIG    1        3.002   0.474  -0.587  0.00  0.00    +0.067 A 
ATOM      7  C   LIG    1        4.054  -0.440  -0.772  0.00  0.00    +0.053 A 
ATOM      8  C   LIG    1        3.797  -1.806  -0.768  0.00  0.00    +0.126 A 
ATOM      9  F   LIG    1        4.816  -2.657  -0.951  0.00  0.00    -0.205 F 
ATOM     10  C   LIG    1        2.514  -2.322  -0.585  0.00  0.00    +0.066 A 
ATOM     11  N   LIG    1        0.503   0.641  -0.161  0.00  0.00    -0.230 NA
ENDROOT
BRANCH   1  13
ATOM     12  C   LIG    1       -2.197  -0.365   1.668  0.00  0.00    +0.036 C 
ATOM     13  C   LIG    1       -1.894  -0.114   0.180  0.00  0.00    +0.075 C 
ATOM     14  N   LIG    1       -2.678  -1.037  -0.683  0.00  0.00    -0.305 NA
ATOM     15  H   LIG    1       -2.288  -0.951  -1.627  0.00  0.00    +0.123 HD
ATOM     16  C   LIG    1       -4.030  -0.460  -0.749  0.00  0.00    +0.082 C 
ATOM     17  C   LIG    1       -3.868   1.045  -0.590  0.00  0.00    +0.017 C 
ATOM     18  C   LIG    1       -2.393   1.258  -0.278  0.00  0.00    +0.031 C 
ENDBRANCH   1  13
BRANCH   6  19
ATOM     19  C   LIG    1        3.267   1.924  -0.618  0.00  0.00    +0.244 C 
ATOM     20  O   LIG    1        2.568   2.716  -1.232  0.00  0.00    -0.270 OA
ATOM     21  N   LIG    1        4.372   2.348   0.074  0.00  0.00    -0.325 N 
ATOM     22  H   LIG    1        4.803   1.773   0.784  0.00  0.00    +0.145 HD
ATOM     23  H   LIG    1        4.471   3.351   0.160  0.00  0.00    +0.145 HD
ENDBRANCH   6  19
TORSDOF 2