REMARK  Name = BDB055660
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.366   1.750  -1.435  0.00  0.00    +0.086 A 
ATOM      2  N   LIG    1       -4.280   1.033  -0.694  0.00  0.00    -0.345 N 
ATOM      3  H   LIG    1       -5.280   1.176  -0.672  0.00  0.00    +0.167 HD
ATOM      4  C   LIG    1       -3.622   0.080   0.031  0.00  0.00    +0.155 A 
ATOM      5  N   LIG    1       -4.240  -0.791   0.875  0.00  0.00    -0.234 NA
ATOM      6  C   LIG    1       -3.421  -1.615   1.480  0.00  0.00    +0.140 A 
ATOM      7  C   LIG    1       -1.992  -1.600   1.267  0.00  0.00    +0.085 A 
ATOM      8  N   LIG    1       -1.421  -0.701   0.388  0.00  0.00    -0.291 N 
ATOM      9  C   LIG    1       -0.061  -0.929   0.384  0.00  0.00    +0.118 A 
ATOM     10  N   LIG    1        0.239  -1.901   1.235  0.00  0.00    -0.239 NA
ATOM     11  C   LIG    1       -0.948  -2.325   1.778  0.00  0.00    +0.140 A 
ATOM     12  C   LIG    1       -2.279   0.201  -0.267  0.00  0.00    +0.092 A 
ATOM     13  C   LIG    1       -2.101   1.249  -1.183  0.00  0.00    +0.047 A 
ENDROOT
BRANCH   9  14
ATOM     14  C   LIG    1        0.925  -0.167  -0.460  0.00  0.00    +0.056 C 
ATOM     15  C   LIG    1        2.159  -1.031  -0.799  0.00  0.00    +0.011 C 
ATOM     16  C   LIG    1        3.356  -0.167  -1.175  0.00  0.00    +0.001 C 
ATOM     17  C   LIG    1        3.791   0.727  -0.012  0.00  0.00    +0.000 C 
ATOM     18  C   LIG    1        2.648   1.089   0.938  0.00  0.00    +0.001 C 
ATOM     19  C   LIG    1        1.310   1.169   0.210  0.00  0.00    +0.011 C 
ENDBRANCH   9  14
TORSDOF 1