REMARK  Name = BDB014634
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        1.180  -3.753   1.508  0.00  0.00    -0.276 OA
ATOM      2  C   LIG    1        1.558  -2.930   2.335  0.00  0.00    +0.213 C 
ATOM      3  N   LIG    1        0.696  -2.285   3.195  0.00  0.00    -0.313 N 
ATOM      4  H   LIG    1        1.059  -1.567   3.811  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   3   5
ATOM      5  C   LIG    1       -0.741  -2.456   3.106  0.00  0.00    +0.136 C 
BRANCH   5   6
ATOM      6  C   LIG    1       -1.455  -1.363   2.281  0.00  0.00    +0.145 C 
BRANCH   6   7
ATOM      7  O   LIG    1       -2.868  -1.542   2.447  0.00  0.00    -0.389 OA
ATOM      8  H   LIG    1       -3.123  -2.326   1.930  0.00  0.00    +0.210 HD
ENDBRANCH   6   7
BRANCH   6   9
ATOM      9  C   LIG    1       -1.062  -1.400   0.781  0.00  0.00    +0.117 C 
BRANCH   9  10
ATOM     10  N   LIG    1       -1.587  -0.359  -0.122  0.00  0.00    -0.295 NA
ATOM     11  C   LIG    1       -1.188   0.999   0.279  0.00  0.00    +0.120 C 
ATOM     12  C   LIG    1       -1.685   2.064  -0.678  0.00  0.00    -0.030 A 
ATOM     13  C   LIG    1       -2.780   1.814  -1.525  0.00  0.00    -0.042 A 
ATOM     14  C   LIG    1       -3.240   2.821  -2.383  0.00  0.00    +0.004 A 
ATOM     15  C   LIG    1       -2.635   4.078  -2.381  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1       -1.566   4.337  -1.526  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1       -3.415   0.445  -1.550  0.00  0.00    +0.051 C 
ATOM     18  C   LIG    1       -1.096   3.337  -0.674  0.00  0.00    +0.005 A 
ATOM     19  C   LIG    1       -3.036  -0.409  -0.329  0.00  0.00    +0.089 C 
ENDBRANCH   9  10
ENDBRANCH   6   9
ENDBRANCH   5   6
ENDBRANCH   3   5
BRANCH   2  20
ATOM     20  C   LIG    1        3.014  -2.558   2.531  0.00  0.00    +0.102 C 
BRANCH  20  21
ATOM     21  C   LIG    1        3.772  -2.564   1.207  0.00  0.00    +0.066 C 
BRANCH  21  22
ATOM     22  C   LIG    1        3.333  -1.459   0.308  0.00  0.00    +0.061 A 
ATOM     23  N   LIG    1        3.677  -0.154   0.582  0.00  0.00    -0.233 NA
ATOM     24  C   LIG    1        3.120   0.563  -0.373  0.00  0.00    +0.138 A 
ATOM     25  N   LIG    1        2.397  -0.236  -1.253  0.00  0.00    -0.306 N 
ATOM     26  C   LIG    1        1.673   0.265  -2.331  0.00  0.00    +0.092 A 
ATOM     27  C   LIG    1        1.673   1.589  -2.560  0.00  0.00    +0.018 A 
ATOM     28  C   LIG    1        2.439   2.457  -1.677  0.00  0.00    +0.005 A 
ATOM     29  C   LIG    1        3.128   1.964  -0.628  0.00  0.00    +0.047 A 
ATOM     30  C   LIG    1        2.549  -1.528  -0.824  0.00  0.00    +0.116 A 
ENDBRANCH  21  22
ENDBRANCH  20  21
ENDBRANCH   2  20
TORSDOF 8