REMARK  Name = BDB055662
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.323  -2.160  -1.332  0.00  0.00    +0.086 A 
ATOM      2  N   LIG    1       -4.290  -1.306  -0.847  0.00  0.00    -0.345 N 
ATOM      3  H   LIG    1       -5.287  -1.466  -0.848  0.00  0.00    +0.167 HD
ATOM      4  C   LIG    1       -3.689  -0.184  -0.348  0.00  0.00    +0.155 A 
ATOM      5  N   LIG    1       -4.372   0.853   0.212  0.00  0.00    -0.232 NA
ATOM      6  C   LIG    1       -3.598   1.824   0.634  0.00  0.00    +0.159 A 
ATOM      7  C   LIG    1       -2.153   1.796   0.512  0.00  0.00    +0.157 A 
ATOM      8  N   LIG    1       -1.520   0.720  -0.075  0.00  0.00    -0.292 N 
ATOM      9  C   LIG    1       -0.167   0.978  -0.057  0.00  0.00    +0.047 A 
ATOM     10  C   LIG    1       -0.074   2.209   0.577  0.00  0.00    +0.135 A 
ATOM     11  N   LIG    1       -1.305   2.713   0.919  0.00  0.00    -0.234 NA
ATOM     12  C   LIG    1       -2.328  -0.339  -0.529  0.00  0.00    +0.092 A 
ATOM     13  C   LIG    1       -2.083  -1.577  -1.143  0.00  0.00    +0.047 A 
ENDROOT
BRANCH   9  14
ATOM     14  C   LIG    1        0.895   0.065  -0.601  0.00  0.00    +0.038 C 
ATOM     15  C   LIG    1        1.314  -0.958   0.475  0.00  0.00    +0.010 C 
ATOM     16  C   LIG    1        2.686  -1.550   0.182  0.00  0.00    +0.001 C 
ATOM     17  C   LIG    1        3.779  -0.480   0.186  0.00  0.00    +0.000 C 
ATOM     18  C   LIG    1        3.274   0.909  -0.204  0.00  0.00    +0.001 C 
ATOM     19  C   LIG    1        2.103   0.836  -1.180  0.00  0.00    +0.010 C 
ENDBRANCH   9  14
TORSDOF 1