REMARK  Name = BDB026377
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.574   0.038   0.820  0.00  0.00    -0.289 N 
ATOM      2  C   LIG    1       -0.027   0.403   2.019  0.00  0.00    +0.217 C 
ATOM      3  O   LIG    1        0.398   1.228   2.812  0.00  0.00    -0.276 OA
ATOM      4  C   LIG    1       -1.282  -0.415   2.202  0.00  0.00    +0.105 C 
ATOM      5  C   LIG    1       -1.480  -1.107   0.849  0.00  0.00    +0.045 C 
ATOM      6  C   LIG    1       -0.075  -1.121   0.244  0.00  0.00    +0.117 C 
ENDROOT
BRANCH   1  13
ATOM      7  O   LIG    1        5.723  -0.051  -1.087  0.00  0.00    -0.275 OA
ATOM      8  C   LIG    1        4.625   0.153  -0.579  0.00  0.00    +0.219 C 
ATOM      9  N   LIG    1        4.253  -0.482   0.580  0.00  0.00    -0.255 N 
ATOM     10  H   LIG    1        4.910  -1.173   0.916  0.00  0.00    +0.158 HD
ATOM     11  C   LIG    1        2.967  -0.626   1.051  0.00  0.00    +0.240 C 
ATOM     12  O   LIG    1        2.692  -1.533   1.833  0.00  0.00    -0.273 OA
ATOM     13  C   LIG    1        1.956   0.411   0.530  0.00  0.00    +0.163 C 
ATOM     14  C   LIG    1        2.201   0.638  -0.960  0.00  0.00    +0.041 C 
ATOM     15  C   LIG    1        3.627   1.123  -1.169  0.00  0.00    +0.098 C 
ENDBRANCH   1  13
BRANCH   5  16
ATOM     16  C   LIG    1       -2.499  -0.426  -0.053  0.00  0.00    -0.042 A 
ATOM     17  C   LIG    1       -2.448   0.946  -0.348  0.00  0.00    +0.004 A 
ATOM     18  C   LIG    1       -3.396   1.531  -1.191  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1       -4.406   0.755  -1.753  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1       -4.469  -0.607  -1.474  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -3.523  -1.194  -0.632  0.00  0.00    +0.004 A 
ENDBRANCH   5  16
TORSDOF 2