REMARK  Name = BDB035009
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.736  -0.292  -1.416  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1        4.809  -1.478  -0.671  0.00  0.00    +0.059 A 
ATOM      3 BR   LIG    1        6.406  -2.501  -0.574  0.00  0.00    -0.047 Br
ATOM      4  C   LIG    1        3.695  -1.934   0.037  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1        2.555  -1.140  -0.066  0.00  0.00    +0.068 A 
ATOM      6  C   LIG    1        2.550   0.024  -0.826  0.00  0.00    +0.092 A 
ATOM      7  C   LIG    1        1.259   0.595  -0.725  0.00  0.00    +0.071 A 
ATOM      8  C   LIG    1        0.497  -0.220   0.087  0.00  0.00    +0.105 A 
ATOM      9  N   LIG    1        1.298  -1.269   0.475  0.00  0.00    -0.341 N 
ATOM     10  H   LIG    1        1.012  -2.027   1.074  0.00  0.00    +0.167 HD
ATOM     11  N   LIG    1        3.629   0.466  -1.512  0.00  0.00    -0.230 NA
ENDROOT
BRANCH   8  12
ATOM     12  N   LIG    1       -0.815  -0.147   0.515  0.00  0.00    -0.268 N 
ATOM     13  H   LIG    1       -1.167  -0.868   1.131  0.00  0.00    +0.156 HD
ATOM     14  C   LIG    1       -1.646   0.921   0.211  0.00  0.00    +0.249 C 
ATOM     15  O   LIG    1       -1.340   1.940  -0.397  0.00  0.00    -0.270 OA
BRANCH  14  16
ATOM     16  C   LIG    1       -3.036   0.796   0.733  0.00  0.00    +0.037 A 
ATOM     17  C   LIG    1       -3.684   1.950   1.189  0.00  0.00    +0.013 A 
ATOM     18  C   LIG    1       -4.985   1.871   1.688  0.00  0.00    +0.001 A 
ATOM     19  C   LIG    1       -5.645   0.643   1.722  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1       -5.011  -0.506   1.249  0.00  0.00    +0.001 A 
ATOM     21  C   LIG    1       -3.709  -0.433   0.750  0.00  0.00    +0.013 A 
ENDBRANCH  14  16
ENDBRANCH   8  12
BRANCH   1  22
ATOM     22  N   LIG    1        5.825   0.172  -2.163  0.00  0.00    -0.342 N 
ATOM     23  H   LIG    1        6.667   0.221  -1.602  0.00  0.00    +0.144 HD
ATOM     24  H   LIG    1        5.559   1.073  -2.553  0.00  0.00    +0.144 HD
ENDBRANCH   1  22
TORSDOF 3