REMARK  Name = BDB000912
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.104  -0.672   0.683  0.00  0.00    +0.082 A 
ATOM      2  C   LIG    1        0.849  -1.306   0.946  0.00  0.00    +0.149 A 
ATOM      3  N   LIG    1        1.003  -2.399   1.707  0.00  0.00    -0.169 NA
ATOM      4  N   LIG    1        2.326  -2.518   1.850  0.00  0.00    -0.282 N 
ATOM      5  H   LIG    1        2.684  -3.305   2.381  0.00  0.00    +0.188 HD
ATOM      6  C   LIG    1        3.029  -1.519   1.250  0.00  0.00    +0.129 A 
ENDROOT
BRANCH   2   7
ATOM      7  C   LIG    1       -0.588  -0.883   0.443  0.00  0.00    +0.161 A 
ATOM      8  N   LIG    1       -0.842   0.067  -0.513  0.00  0.00    -0.337 N 
ATOM      9  H   LIG    1       -0.153   0.550  -1.062  0.00  0.00    +0.167 HD
ATOM     10  C   LIG    1       -2.198   0.160  -0.694  0.00  0.00    +0.067 A 
ATOM     11  C   LIG    1       -2.719  -0.788   0.177  0.00  0.00    +0.090 A 
ATOM     12  C   LIG    1       -4.108  -0.967   0.244  0.00  0.00    +0.030 A 
ATOM     13  C   LIG    1       -4.926  -0.179  -0.576  0.00  0.00    +0.002 A 
ATOM     14  C   LIG    1       -4.372   0.763  -1.446  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1       -2.987   0.955  -1.528  0.00  0.00    +0.028 A 
ATOM     16  N   LIG    1       -1.717  -1.430   0.856  0.00  0.00    -0.226 NA
ENDBRANCH   2   7
BRANCH   1  19
ATOM     17  C   LIG    1        3.589   2.426  -0.801  0.00  0.00    +0.109 C 
ATOM     18  C   LIG    1        3.633   1.043  -0.201  0.00  0.00    +0.214 C 
ATOM     19  N   LIG    1        2.368   0.538   0.052  0.00  0.00    -0.283 N 
ATOM     20  H   LIG    1        1.582   1.144  -0.119  0.00  0.00    +0.155 HD
ATOM     21  O   LIG    1        4.702   0.470  -0.022  0.00  0.00    -0.276 OA
ENDBRANCH   1  19
TORSDOF 2