REMARK  Name = BDB065048
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.632  -0.843   1.847  0.00  0.00    +0.046 C 
ATOM      2  C   LIG    1       -3.629  -0.061   0.566  0.00  0.00    -0.027 A 
ATOM      3  C   LIG    1       -2.469   0.389  -0.094  0.00  0.00    +0.050 A 
ATOM      4  C   LIG    1       -2.504   1.125  -1.278  0.00  0.00    +0.001 A 
ATOM      5  C   LIG    1       -1.159   1.407  -1.638  0.00  0.00    +0.040 A 
ATOM      6  C   LIG    1       -0.320   0.824  -0.705  0.00  0.00    +0.103 A 
ATOM      7  C   LIG    1       -3.749   1.439  -1.852  0.00  0.00    +0.010 A 
ATOM      8  C   LIG    1       -4.918   1.006  -1.223  0.00  0.00    +0.001 A 
ATOM      9  N   LIG    1       -1.139   0.247   0.239  0.00  0.00    -0.350 N 
ATOM     10  H   LIG    1       -0.816  -0.188   1.091  0.00  0.00    +0.166 HD
ATOM     11  C   LIG    1       -4.856   0.273  -0.039  0.00  0.00    +0.005 A 
ENDROOT
BRANCH   6  12
ATOM     12  C   LIG    1        1.132   0.858  -0.671  0.00  0.00    +0.265 C 
ATOM     13  N   LIG    1        1.690  -0.237  -0.034  0.00  0.00    -0.280 N 
ATOM     14  H   LIG    1        1.073  -1.014   0.149  0.00  0.00    +0.155 HD
ATOM     15  O   LIG    1        1.763   1.767  -1.197  0.00  0.00    -0.268 OA
BRANCH  13  16
ATOM     16  C   LIG    1        3.054  -0.467   0.244  0.00  0.00    +0.034 A 
ATOM     17  C   LIG    1        3.397  -1.722   0.767  0.00  0.00    +0.023 A 
ATOM     18  C   LIG    1        4.725  -2.026   1.080  0.00  0.00    +0.002 A 
ATOM     19  C   LIG    1        5.723  -1.077   0.877  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1        5.391   0.174   0.363  0.00  0.00    +0.002 A 
ATOM     21  C   LIG    1        4.062   0.479   0.050  0.00  0.00    +0.023 A 
ENDBRANCH  13  16
ENDBRANCH   6  12
TORSDOF 2