REMARK  Name = BDB055034
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.830  -0.311  -0.070  0.00  0.00    -0.313 N 
ATOM      2  H   LIG    1       -1.068  -1.256  -0.340  0.00  0.00    +0.149 HD
ATOM      3  C   LIG    1        0.495  -0.016   0.177  0.00  0.00    +0.214 C 
ATOM      4  O   LIG    1        0.874   1.025   0.701  0.00  0.00    -0.276 OA
ENDROOT
BRANCH   1   6
ATOM      5  C   LIG    1       -2.240   0.323   1.835  0.00  0.00    +0.027 C 
ATOM      6  C   LIG    1       -1.904   0.570   0.366  0.00  0.00    +0.067 C 
ATOM      7  C   LIG    1       -3.135   0.367  -0.512  0.00  0.00    +0.027 C 
ENDBRANCH   1   6
BRANCH   3   8
ATOM      8  C   LIG    1        1.435  -1.125  -0.254  0.00  0.00    +0.107 C 
BRANCH   8   9
ATOM      9  C   LIG    1        2.898  -0.731  -0.096  0.00  0.00    +0.129 C 
BRANCH   9  10
ATOM     10  C   LIG    1        3.336   0.385  -1.006  0.00  0.00    +0.305 C 
ATOM     11  O   LIG    1        4.304   1.106  -0.825  0.00  0.00    -0.251 OA
BRANCH  10  12
ATOM     12  O   LIG    1        2.622   0.489  -2.141  0.00  0.00    -0.481 OA
ATOM     13  H   LIG    1        3.031   1.256  -2.595  0.00  0.00    +0.295 HD
ENDBRANCH  10  12
ENDBRANCH   9  10
ENDBRANCH   8   9
ENDBRANCH   3   8
TORSDOF 5