REMARK  Name = BDB032292
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.527  -0.410   2.844  0.00  0.00    +0.138 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.424  -0.438   1.820  0.00  0.00    -0.012 A 
ATOM      3  C   LIG    1       -0.929   0.733   1.264  0.00  0.00    +0.118 A 
ATOM      4  N   LIG    1        0.040   0.784   0.318  0.00  0.00    -0.240 NA
ATOM      5  C   LIG    1        0.552  -0.378  -0.129  0.00  0.00    +0.119 A 
ATOM      6  C   LIG    1        0.119  -1.600   0.381  0.00  0.00    +0.044 A 
ATOM      7  C   LIG    1       -0.878  -1.632   1.355  0.00  0.00    +0.010 A 
BRANCH   5   8
ATOM      8  N   LIG    1        1.581  -0.396  -1.083  0.00  0.00    -0.329 N 
ATOM      9  H   LIG    1        1.339  -1.065  -1.808  0.00  0.00    +0.147 HD
BRANCH   8  10
ATOM     10  C   LIG    1        1.996   0.887  -1.648  0.00  0.00    +0.106 C 
BRANCH  10  11
ATOM     11  C   LIG    1        3.407   1.287  -1.190  0.00  0.00    +0.008 C 
ATOM     12  C   LIG    1        4.466   0.224  -1.500  0.00  0.00    +0.020 C 
ATOM     13  C   LIG    1        5.878   0.728  -1.163  0.00  0.00    +0.084 C 
ATOM     14  N   LIG    1        5.911   1.725  -0.081  0.00  0.00    -0.305 NA
ATOM     15  C   LIG    1        7.234   1.784   0.533  0.00  0.00    +0.104 C 
ATOM     16  C   LIG    1        4.866   1.475   0.911  0.00  0.00    +0.084 C 
ATOM     17  C   LIG    1        3.476   1.686   0.296  0.00  0.00    +0.020 C 
ENDBRANCH  10  11
ENDBRANCH   8  10
ENDBRANCH   5   8
ENDBRANCH   1   2
BRANCH   1  18
ATOM     18  N   LIG    1       -3.849  -0.310   2.219  0.00  0.00    -0.339 N 
ATOM     19  H   LIG    1       -3.848   0.475   1.554  0.00  0.00    +0.146 HD
BRANCH  18  28
ATOM     20  C   LIG    1       -4.447  -0.669  -0.951  0.00  0.00    +0.087 A 
ATOM     21  C   LIG    1       -4.556  -1.555   0.180  0.00  0.00    +0.053 A 
ATOM     22  C   LIG    1       -4.987  -2.782  -0.320  0.00  0.00    +0.141 A 
ATOM     23  N   LIG    1       -5.215  -3.920   0.358  0.00  0.00    -0.237 NA
ATOM     24  C   LIG    1       -4.985  -3.795   1.681  0.00  0.00    +0.115 A 
ATOM     25  C   LIG    1       -4.543  -2.645   2.317  0.00  0.00    +0.043 A 
ATOM     26  N   LIG    1       -5.151  -2.667  -1.670  0.00  0.00    -0.345 N 
ATOM     27  H   LIG    1       -5.461  -3.425  -2.259  0.00  0.00    +0.167 HD
ATOM     28  C   LIG    1       -4.304  -1.479   1.574  0.00  0.00    +0.040 A 
ATOM     29  C   LIG    1       -4.821  -1.402  -2.071  0.00  0.00    +0.100 A 
BRANCH  20  30
ATOM     30  C   LIG    1       -4.019   0.726  -0.960  0.00  0.00    +0.341 C 
ATOM     31  O   LIG    1       -3.845   1.386   0.059  0.00  0.00    -0.245 OA
BRANCH  30  33
ATOM     32  C   LIG    1       -3.359   2.556  -2.264  0.00  0.00    +0.280 C 
ATOM     33  O   LIG    1       -3.836   1.212  -2.224  0.00  0.00    -0.464 OA
ENDBRANCH  30  33
ENDBRANCH  20  30
ENDBRANCH  18  28
ENDBRANCH   1  18
TORSDOF 8