REMARK  Name = BDB003270
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.519   1.155  -0.329  0.00  0.00    +0.074 C 
ATOM      2  C   LIG    1       -2.640  -0.067  -0.263  0.00  0.00    +0.039 C 
ATOM      3  C   LIG    1       -2.684  -0.739   1.135  0.00  0.00    +0.051 C 
ATOM      4  C   LIG    1       -1.433  -1.608   1.391  0.00  0.00    +0.092 C 
ATOM      5  N   LIG    1       -0.934  -2.179   0.141  0.00  0.00    -0.293 NA
ATOM      6  C   LIG    1       -0.407  -1.128  -0.779  0.00  0.00    +0.104 C 
ATOM      7  C   LIG    1        1.067  -0.912  -0.580  0.00  0.00    +0.038 A 
ATOM      8  N   LIG    1        1.818   0.061  -1.182  0.00  0.00    -0.356 N 
ATOM      9  H   LIG    1        1.470   0.757  -1.827  0.00  0.00    +0.166 HD
ATOM     10  C   LIG    1        3.132  -0.039  -0.774  0.00  0.00    +0.050 A 
ATOM     11  C   LIG    1        3.219  -1.132   0.091  0.00  0.00    +0.003 A 
ATOM     12  C   LIG    1        4.469  -1.457   0.645  0.00  0.00    +0.014 A 
ATOM     13  C   LIG    1        5.585  -0.676   0.317  0.00  0.00    +0.046 A 
ATOM     14  C   LIG    1        5.479   0.413  -0.549  0.00  0.00    +0.122 A 
ATOM     15  C   LIG    1        4.243   0.750  -1.113  0.00  0.00    +0.071 A 
ATOM     16  C   LIG    1        1.914  -1.682   0.191  0.00  0.00    -0.016 A 
ATOM     17  C   LIG    1        1.403  -2.859   0.942  0.00  0.00    +0.053 C 
ATOM     18  C   LIG    1        0.032  -3.281   0.362  0.00  0.00    +0.090 C 
ATOM     19  C   LIG    1       -2.850   0.315   2.251  0.00  0.00    +0.174 C 
ATOM     20  C   LIG    1       -3.043  -0.315   3.629  0.00  0.00    +0.052 C 
ATOM     21  O   LIG    1       -3.985   1.168   2.037  0.00  0.00    -0.496 OA
ATOM     22  C   LIG    1       -1.180   0.204  -0.647  0.00  0.00    +0.034 C 
ATOM     23  C   LIG    1       -4.126   1.642   0.763  0.00  0.00    +0.198 C 
ENDROOT
BRANCH   1  24
ATOM     24  C   LIG    1       -3.791   1.726  -1.677  0.00  0.00    +0.338 C 
ATOM     25  O   LIG    1       -3.381   1.219  -2.712  0.00  0.00    -0.245 OA
BRANCH  24  27
ATOM     26  C   LIG    1       -4.807   3.462  -2.868  0.00  0.00    +0.280 C 
ATOM     27  O   LIG    1       -4.518   2.870  -1.601  0.00  0.00    -0.465 OA
ENDBRANCH  24  27
ENDBRANCH   1  24
BRANCH  14  28
ATOM     28  O   LIG    1        6.661   1.073  -0.769  0.00  0.00    -0.495 OA
ATOM     29  C   LIG    1        6.621   2.187  -1.652  0.00  0.00    +0.277 C 
ENDBRANCH  14  28
TORSDOF 3