REMARK  Name = BDB063165
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.070   0.242   0.355  0.00  0.00    -0.281 N 
ATOM      2  H   LIG    1        0.580   0.693   1.130  0.00  0.00    +0.155 HD
ATOM      3  C   LIG    1        0.278  -0.390  -0.579  0.00  0.00    +0.254 C 
ATOM      4  O   LIG    1        0.690  -0.983  -1.574  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   3   5
ATOM      5  C   LIG    1       -1.203  -0.313  -0.308  0.00  0.00    +0.102 A 
ATOM      6  C   LIG    1       -1.793   0.386   0.874  0.00  0.00    +0.264 A 
ATOM      7  O   LIG    1       -1.041   0.936   1.683  0.00  0.00    -0.267 OA
ATOM      8  N   LIG    1       -3.179   0.386   1.014  0.00  0.00    -0.311 N 
ATOM      9  C   LIG    1       -3.760   1.065   2.163  0.00  0.00    +0.152 C 
ATOM     10  C   LIG    1       -4.035  -0.256   0.069  0.00  0.00    +0.052 A 
ATOM     11  C   LIG    1       -3.460  -0.905  -1.033  0.00  0.00    -0.001 A 
ATOM     12  C   LIG    1       -4.272  -1.546  -1.980  0.00  0.00    +0.010 A 
ATOM     13  C   LIG    1       -5.658  -1.542  -1.836  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1       -6.237  -0.900  -0.746  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1       -5.431  -0.261   0.201  0.00  0.00    +0.026 A 
ATOM     16  C   LIG    1       -2.011  -0.916  -1.195  0.00  0.00    +0.028 A 
ENDBRANCH   3   5
BRANCH   1  20
ATOM     17  C   LIG    1        5.271   0.651   0.591  0.00  0.00    +0.120 A 
ATOM     18  C   LIG    1        4.714  -0.049  -0.478  0.00  0.00    +0.047 A 
ATOM     19  C   LIG    1        3.323  -0.200  -0.580  0.00  0.00    +0.027 A 
ATOM     20  C   LIG    1        2.475   0.347   0.383  0.00  0.00    +0.034 A 
ATOM     21  C   LIG    1        3.039   1.048   1.454  0.00  0.00    +0.027 A 
ATOM     22  C   LIG    1        4.425   1.198   1.555  0.00  0.00    +0.047 A 
BRANCH  17  24
ATOM     23  C   LIG    1        7.504   0.328  -0.152  0.00  0.00    +0.277 C 
ATOM     24  O   LIG    1        6.604   0.868   0.806  0.00  0.00    -0.495 OA
ENDBRANCH  17  24
ENDBRANCH   1  20
TORSDOF 3