REMARK  Name = BDB031297
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.063   0.816   0.146  0.00  0.00    +0.220 C 
ATOM      2  N   LIG    1        1.127   0.374   0.917  0.00  0.00    -0.285 N 
ATOM      3  H   LIG    1        0.985   0.352   1.919  0.00  0.00    +0.155 HD
ATOM      4  O   LIG    1        0.052   0.926  -1.075  0.00  0.00    -0.275 OA
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1        2.399  -0.044   0.468  0.00  0.00    +0.035 A 
ATOM      6  C   LIG    1        2.772  -0.077  -0.881  0.00  0.00    +0.051 A 
ATOM      7  C   LIG    1        4.048  -0.509  -1.169  0.00  0.00    +0.069 A 
ATOM      8  C   LIG    1        4.946  -0.901  -0.182  0.00  0.00    +0.067 A 
ATOM      9  N   LIG    1        6.131  -1.277  -0.803  0.00  0.00    -0.306 N 
ATOM     10  H   LIG    1        6.975  -1.610  -0.366  0.00  0.00    +0.170 HD
ATOM     11  C   LIG    1        5.982  -1.121  -2.189  0.00  0.00    +0.325 A 
ATOM     12  O   LIG    1        6.821  -1.355  -3.040  0.00  0.00    -0.247 OA
ATOM     13  C   LIG    1        4.617  -0.884   1.149  0.00  0.00    +0.029 A 
ATOM     14  N   LIG    1        4.682  -0.643  -2.401  0.00  0.00    -0.306 N 
ATOM     15  H   LIG    1        4.296  -0.439  -3.309  0.00  0.00    +0.170 HD
ATOM     16  C   LIG    1        3.324  -0.448   1.469  0.00  0.00    +0.025 A 
ENDBRANCH   2   5
BRANCH   1  22
ATOM     17  C   LIG    1       -5.431  -0.642  -1.386  0.00  0.00    +0.109 C 
ATOM     18  C   LIG    1       -4.925  -0.757   0.031  0.00  0.00    +0.212 C 
ATOM     19  N   LIG    1       -3.800  -0.012   0.360  0.00  0.00    -0.302 N 
ATOM     20  C   LIG    1       -3.241  -0.135   1.702  0.00  0.00    +0.108 C 
ATOM     21  C   LIG    1       -1.718  -0.101   1.672  0.00  0.00    +0.032 C 
ATOM     22  C   LIG    1       -1.164   1.167   0.998  0.00  0.00    +0.078 C 
ATOM     23  C   LIG    1       -2.229   1.898   0.165  0.00  0.00    +0.032 C 
ATOM     24  C   LIG    1       -3.148   0.920  -0.561  0.00  0.00    +0.108 C 
ATOM     25  O   LIG    1       -5.506  -1.479   0.841  0.00  0.00    -0.276 OA
ENDBRANCH   1  22
TORSDOF 2