REMARK  Name = BDB031235
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.641   1.739  -0.183  0.00  0.00    +0.154 C 
ATOM      2  N   LIG    1       -4.258   0.467   0.356  0.00  0.00    -0.294 N 
ATOM      3  C   LIG    1       -2.969  -0.073   0.333  0.00  0.00    +0.089 A 
ATOM      4  C   LIG    1       -3.014  -1.326   0.939  0.00  0.00    +0.159 A 
ATOM      5  N   LIG    1       -1.976  -2.152   1.099  0.00  0.00    -0.235 NA
ATOM      6  C   LIG    1       -0.807  -1.664   0.602  0.00  0.00    +0.126 A 
ATOM      7  C   LIG    1       -0.658  -0.402  -0.001  0.00  0.00    +0.057 A 
ATOM      8  N   LIG    1       -4.320  -1.559   1.336  0.00  0.00    -0.291 N 
ATOM      9  H   LIG    1       -4.648  -2.390   1.794  0.00  0.00    +0.172 HD
ATOM     10  C   LIG    1       -1.783   0.419  -0.158  0.00  0.00    +0.044 A 
ATOM     11  C   LIG    1       -5.114  -0.461   0.981  0.00  0.00    +0.328 A 
ATOM     12  O   LIG    1       -6.311  -0.353   1.186  0.00  0.00    -0.247 OA
ENDROOT
BRANCH   7  13
ATOM     13  C   LIG    1        0.652   0.062  -0.514  0.00  0.00    +0.250 C 
ATOM     14  N   LIG    1        1.745  -0.283   0.259  0.00  0.00    -0.281 N 
ATOM     15  H   LIG    1        1.571  -0.710   1.160  0.00  0.00    +0.155 HD
ATOM     16  O   LIG    1        0.651   0.731  -1.540  0.00  0.00    -0.270 OA
BRANCH  14  17
ATOM     17  C   LIG    1        3.104  -0.014  -0.019  0.00  0.00    +0.034 A 
ATOM     18  C   LIG    1        3.558   0.574  -1.200  0.00  0.00    +0.023 A 
ATOM     19  C   LIG    1        4.924   0.800  -1.401  0.00  0.00    +0.002 A 
ATOM     20  C   LIG    1        5.847   0.437  -0.423  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        5.405  -0.154   0.757  0.00  0.00    +0.002 A 
ATOM     22  C   LIG    1        4.041  -0.380   0.957  0.00  0.00    +0.023 A 
ENDBRANCH  14  17
ENDBRANCH   7  13
TORSDOF 2