REMARK  Name = BDB012919
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.758  -1.296  -0.905  0.00  0.00    +0.264 C 
ATOM      2  N   LIG    1        0.178  -1.195   0.114  0.00  0.00    -0.294 N 
ATOM      3  C   LIG    1        1.402  -1.985   0.043  0.00  0.00    +0.130 C 
ATOM      4  C   LIG    1        2.177  -1.604   1.308  0.00  0.00    +0.092 C 
ATOM      5  C   LIG    1        1.041  -1.398   2.313  0.00  0.00    +0.043 C 
ATOM      6  C   LIG    1       -0.051  -0.731   1.479  0.00  0.00    +0.110 C 
ATOM      7  O   LIG    1       -0.553  -2.033  -1.867  0.00  0.00    -0.268 OA
ENDROOT
BRANCH   1  12
ATOM      8  C   LIG    1       -4.044   0.286  -0.920  0.00  0.00    +0.066 A 
ATOM      9  N   LIG    1       -3.326   1.237  -0.308  0.00  0.00    -0.178 NA
ATOM     10  N   LIG    1       -2.080   0.742  -0.291  0.00  0.00    -0.272 N 
ATOM     11  H   LIG    1       -1.341   1.333   0.072  0.00  0.00    +0.189 HD
ATOM     12  C   LIG    1       -1.968  -0.522  -0.796  0.00  0.00    +0.121 A 
ATOM     13  C   LIG    1       -3.235  -0.824  -1.259  0.00  0.00    +0.057 A 
BRANCH   8  15
ATOM     14  C   LIG    1       -6.353  -0.583  -0.469  0.00  0.00    +0.014 C 
ATOM     15  C   LIG    1       -5.512   0.486  -1.169  0.00  0.00    +0.033 C 
ATOM     16  C   LIG    1       -5.829   0.522  -2.666  0.00  0.00    +0.014 C 
ENDBRANCH   8  15
ENDBRANCH   1  12
BRANCH   4  17
ATOM     17  N   LIG    1        2.951  -0.382   1.123  0.00  0.00    -0.311 N 
ATOM     18  H   LIG    1        2.800   0.176   0.292  0.00  0.00    +0.149 HD
ATOM     19  C   LIG    1        3.919   0.010   2.021  0.00  0.00    +0.214 C 
ATOM     20  O   LIG    1        4.172  -0.614   3.048  0.00  0.00    -0.276 OA
BRANCH  19  21
ATOM     21  C   LIG    1        4.618   1.308   1.659  0.00  0.00    +0.099 C 
BRANCH  21  22
ATOM     22  C   LIG    1        5.287   1.271   0.314  0.00  0.00    -0.002 C 
ATOM     23  C   LIG    1        5.794   2.551  -0.298  0.00  0.00    +0.004 C 
ATOM     24  C   LIG    1        4.617   1.843  -0.910  0.00  0.00    +0.004 C 
ENDBRANCH  21  22
ENDBRANCH  19  21
ENDBRANCH   4  17
TORSDOF 5