REMARK  Name = BDB014287
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.586   0.553  -0.894  0.00  0.00    +0.105 A 
ATOM      2  N   LIG    1        1.363  -0.381  -0.245  0.00  0.00    -0.349 N 
ATOM      3  H   LIG    1        1.016  -1.206   0.229  0.00  0.00    +0.166 HD
ATOM      4  C   LIG    1        2.696  -0.063  -0.349  0.00  0.00    +0.080 A 
ATOM      5  C   LIG    1        2.781   1.077  -1.135  0.00  0.00    +0.090 A 
ATOM      6  N   LIG    1        3.957   1.665  -1.458  0.00  0.00    -0.253 NA
ATOM      7  C   LIG    1        5.056   1.059  -0.960  0.00  0.00    +0.112 A 
ATOM      8  C   LIG    1        5.062  -0.080  -0.168  0.00  0.00    +0.037 A 
ATOM      9  C   LIG    1        3.845  -0.676   0.159  0.00  0.00    +0.086 A 
ATOM     10  C   LIG    1        1.465   1.445  -1.492  0.00  0.00    +0.060 A 
ENDROOT
BRANCH   1  14
ATOM     11  C   LIG    1       -3.537  -1.062  -0.821  0.00  0.00    +0.031 C 
ATOM     12  C   LIG    1       -3.058   0.045   0.127  0.00  0.00    +0.032 C 
ATOM     13  N   LIG    1       -1.586   0.188   0.135  0.00  0.00    -0.291 N 
ATOM     14  C   LIG    1       -0.859   0.523  -1.004  0.00  0.00    +0.263 C 
ATOM     15  O   LIG    1       -1.410   0.789  -2.069  0.00  0.00    -0.268 OA
ATOM     16  C   LIG    1       -1.067   0.181   1.500  0.00  0.00    +0.109 C 
ATOM     17  C   LIG    1       -2.288   0.341   2.391  0.00  0.00    +0.021 C 
ATOM     18  C   LIG    1       -3.374  -0.357   1.587  0.00  0.00    +0.027 C 
ATOM     19  C   LIG    1       -3.759   1.373  -0.212  0.00  0.00    +0.031 C 
ENDBRANCH   1  14
BRANCH   9  20
ATOM     20  C   LIG    1        3.725  -1.884   0.994  0.00  0.00    +0.339 C 
ATOM     21  O   LIG    1        2.675  -2.410   1.320  0.00  0.00    -0.245 OA
BRANCH  20  22
ATOM     22  O   LIG    1        4.916  -2.369   1.380  0.00  0.00    -0.477 OA
ATOM     23  H   LIG    1        4.699  -3.162   1.915  0.00  0.00    +0.295 HD
ENDBRANCH  20  22
ENDBRANCH   9  20
TORSDOF 3