REMARK  Name = BDB051343
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -5.577   2.593   0.545  0.00  0.00    -0.266 OA
ATOM      2  C   LIG    1       -4.829   1.642   0.338  0.00  0.00    +0.273 A 
ATOM      3  C   LIG    1       -5.157   0.510  -0.490  0.00  0.00    +0.112 A 
ATOM      4  N   LIG    1       -4.273  -0.529  -0.685  0.00  0.00    -0.310 N 
ATOM      5  C   LIG    1       -4.857  -1.458  -1.515  0.00  0.00    +0.092 A 
ATOM      6  C   LIG    1       -6.118  -1.010  -1.849  0.00  0.00    +0.020 A 
ATOM      7  C   LIG    1       -2.996  -0.544  -0.086  0.00  0.00    +0.070 A 
ATOM      8  C   LIG    1       -2.664   0.553   0.723  0.00  0.00    +0.066 A 
ATOM      9  C   LIG    1       -1.418   0.608   1.349  0.00  0.00    +0.032 A 
ATOM     10  C   LIG    1       -0.496  -0.436   1.173  0.00  0.00    -0.032 A 
ATOM     11  C   LIG    1       -0.843  -1.526   0.355  0.00  0.00    +0.007 A 
ATOM     12  C   LIG    1       -2.088  -1.587  -0.275  0.00  0.00    +0.028 A 
ATOM     13  C   LIG    1       -6.308   0.233  -1.202  0.00  0.00    +0.033 A 
ATOM     14  N   LIG    1       -3.577   1.603   0.910  0.00  0.00    -0.319 N 
ATOM     15  H   LIG    1       -3.341   2.395   1.491  0.00  0.00    +0.169 HD
ENDROOT
BRANCH  10  16
ATOM     16  C   LIG    1        0.859  -0.389   1.839  0.00  0.00    +0.116 C 
BRANCH  16  17
ATOM     17  N   LIG    1        1.914  -0.203   0.849  0.00  0.00    -0.308 NA
ATOM     18  H   LIG    1        1.748   0.660   0.333  0.00  0.00    +0.123 HD
BRANCH  17  19
ATOM     19  C   LIG    1        3.228  -0.130   1.484  0.00  0.00    +0.116 C 
BRANCH  19  20
ATOM     20  C   LIG    1        4.306   0.138   0.461  0.00  0.00    -0.034 A 
ATOM     21  C   LIG    1        4.631  -0.834  -0.497  0.00  0.00    +0.005 A 
ATOM     22  C   LIG    1        5.625  -0.591  -1.446  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        6.303   0.626  -1.449  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1        5.987   1.602  -0.506  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1        4.992   1.361   0.444  0.00  0.00    +0.005 A 
ENDBRANCH  19  20
ENDBRANCH  17  19
ENDBRANCH  16  17
ENDBRANCH  10  16
TORSDOF 4