REMARK  Name = BDB020192
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.099   0.291   0.563  0.00  0.00    +0.229 C 
ATOM      2  N   LIG    1        0.744   0.115  -0.520  0.00  0.00    -0.285 N 
ATOM      3  H   LIG    1        0.302  -0.176  -1.392  0.00  0.00    +0.155 HD
ATOM      4  O   LIG    1        0.263   0.449   1.727  0.00  0.00    -0.275 OA
ENDROOT
BRANCH   1  11
ATOM      5  O   LIG    1       -5.476  -1.042   0.018  0.00  0.00    -0.275 OA
ATOM      6  C   LIG    1       -4.315  -0.671   0.153  0.00  0.00    +0.219 C 
ATOM      7  N   LIG    1       -3.308  -1.208  -0.609  0.00  0.00    -0.256 N 
ATOM      8  H   LIG    1       -3.602  -1.904  -1.281  0.00  0.00    +0.157 HD
ATOM      9  C   LIG    1       -2.034  -0.722  -0.763  0.00  0.00    +0.231 C 
ATOM     10  O   LIG    1       -1.336  -1.103  -1.704  0.00  0.00    -0.275 OA
ATOM     11  C   LIG    1       -1.582   0.368   0.190  0.00  0.00    +0.162 C 
ATOM     12  C   LIG    1       -2.454   0.363   1.451  0.00  0.00    +0.031 C 
ATOM     13  C   LIG    1       -3.924   0.451   1.080  0.00  0.00    +0.097 C 
ENDBRANCH   1  11
BRANCH   2  14
ATOM     14  C   LIG    1        2.154   0.113  -0.528  0.00  0.00    +0.033 A 
ATOM     15  C   LIG    1        2.945   0.452   0.571  0.00  0.00    +0.023 A 
ATOM     16  C   LIG    1        4.340   0.432   0.473  0.00  0.00    +0.002 A 
ATOM     17  C   LIG    1        4.956   0.076  -0.724  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1        4.177  -0.259  -1.828  0.00  0.00    +0.002 A 
ATOM     19  C   LIG    1        2.783  -0.239  -1.730  0.00  0.00    +0.023 A 
ENDBRANCH   2  14
TORSDOF 2