REMARK  Name = BDB027993
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.513  -0.208   0.886  0.00  0.00    -0.316 N 
ATOM      2  H   LIG    1        0.369  -0.095   1.890  0.00  0.00    +0.148 HD
ENDROOT
BRANCH   1  10
ATOM      3  C   LIG    1       -2.087   0.653  -2.984  0.00  0.00    +0.173 C 
ATOM      4  N   LIG    1       -1.775   0.358  -1.606  0.00  0.00    -0.265 N 
ATOM      5  C   LIG    1       -2.678   0.161  -0.594  0.00  0.00    +0.070 A 
ATOM      6  C   LIG    1       -1.900  -0.095   0.532  0.00  0.00    +0.041 A 
ATOM      7  C   LIG    1       -2.541  -0.351   1.761  0.00  0.00    +0.013 A 
ATOM      8  C   LIG    1       -3.940  -0.337   1.816  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1       -4.695  -0.075   0.673  0.00  0.00    +0.002 A 
ATOM     10  C   LIG    1       -0.552  -0.018   0.075  0.00  0.00    +0.149 A 
ATOM     11  C   LIG    1       -4.080   0.179  -0.557  0.00  0.00    +0.028 A 
ATOM     12  N   LIG    1       -0.487   0.266  -1.226  0.00  0.00    -0.155 NA
ENDBRANCH   1  10
BRANCH   1  13
ATOM     13  C   LIG    1        1.847   0.215   0.458  0.00  0.00    +0.159 C 
ATOM     14  C   LIG    1        2.719   0.463   1.700  0.00  0.00    +0.240 C 
ATOM     15  O   LIG    1        2.247   0.698   2.813  0.00  0.00    -0.273 OA
ATOM     16  N   LIG    1        4.079   0.421   1.510  0.00  0.00    -0.255 N 
ATOM     17  H   LIG    1        4.642   0.575   2.335  0.00  0.00    +0.158 HD
ATOM     18  C   LIG    1        4.741  -0.116   0.436  0.00  0.00    +0.219 C 
ATOM     19  O   LIG    1        5.956  -0.290   0.466  0.00  0.00    -0.275 OA
ATOM     20  C   LIG    1        3.907  -0.432  -0.782  0.00  0.00    +0.098 C 
ATOM     21  C   LIG    1        2.506  -0.870  -0.390  0.00  0.00    +0.041 C 
ENDBRANCH   1  13
TORSDOF 2