REMARK  Name = BDB055665
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.528   1.036  -2.009  0.00  0.00    +0.085 A 
ATOM      2  N   LIG    1       -4.344   0.947  -0.897  0.00  0.00    -0.346 N 
ATOM      3  H   LIG    1       -5.322   1.192  -0.849  0.00  0.00    +0.167 HD
ATOM      4  C   LIG    1       -3.622   0.471   0.166  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1       -4.082   0.262   1.412  0.00  0.00    -0.234 NA
ATOM      6  C   LIG    1       -3.162  -0.209   2.296  0.00  0.00    +0.162 A 
ATOM      7  C   LIG    1       -1.863  -0.440   1.879  0.00  0.00    +0.186 A 
ATOM      8  C   LIG    1       -1.416  -0.227   0.606  0.00  0.00    +0.057 A 
ATOM      9  C   LIG    1       -0.065  -0.572   0.559  0.00  0.00    +0.095 A 
ATOM     10  N   LIG    1        0.320  -0.973   1.788  0.00  0.00    -0.082 NA
ATOM     11  O   LIG    1       -0.806  -0.897   2.606  0.00  0.00    -0.353 OA
ATOM     12  C   LIG    1       -2.350   0.266  -0.317  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1       -2.257   0.610  -1.663  0.00  0.00    +0.030 A 
ENDROOT
BRANCH   9  14
ATOM     14  C   LIG    1        0.908  -0.525  -0.589  0.00  0.00    +0.042 C 
ATOM     15  C   LIG    1        1.533   0.870  -0.741  0.00  0.00    +0.010 C 
ATOM     16  C   LIG    1        2.558   1.196   0.347  0.00  0.00    +0.001 C 
ATOM     17  C   LIG    1        3.418   0.002   0.764  0.00  0.00    +0.000 C 
ATOM     18  C   LIG    1        3.404  -1.115  -0.269  0.00  0.00    +0.001 C 
ATOM     19  C   LIG    1        1.990  -1.629  -0.550  0.00  0.00    +0.010 C 
ENDBRANCH   9  14
TORSDOF 1