REMARK  Name = BDB045750
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.124   1.230  -2.253  0.00  0.00    +0.044 C 
ATOM      2  C   LIG    1       -1.338   0.038  -1.357  0.00  0.00    -0.042 A 
ATOM      3  C   LIG    1       -0.530  -0.295  -0.234  0.00  0.00    -0.001 A 
ATOM      4  C   LIG    1       -1.006  -1.356   0.582  0.00  0.00    +0.047 A 
ATOM      5  C   LIG    1       -0.362  -1.659   1.886  0.00  0.00    +0.257 A 
ATOM      6  N   LIG    1        0.682  -0.867   2.274  0.00  0.00    -0.321 N 
ATOM      7  H   LIG    1        1.087  -1.101   3.172  0.00  0.00    +0.169 HD
ATOM      8  C   LIG    1        1.273   0.104   1.463  0.00  0.00    +0.052 A 
ATOM      9  C   LIG    1        2.426   0.730   1.949  0.00  0.00    +0.064 A 
ATOM     10  C   LIG    1        3.110   1.613   1.133  0.00  0.00    +0.125 A 
ATOM     11  C   LIG    1        2.674   1.857  -0.156  0.00  0.00    +0.039 A 
ATOM     12  C   LIG    1        1.511   1.232  -0.627  0.00  0.00    +0.013 A 
ATOM     13  F   LIG    1        4.221   2.209   1.583  0.00  0.00    -0.205 F 
ATOM     14  O   LIG    1       -0.757  -2.568   2.610  0.00  0.00    -0.267 OA
ATOM     15  C   LIG    1       -2.131  -2.126   0.243  0.00  0.00    +0.014 A 
ATOM     16  C   LIG    1       -2.843  -1.844  -0.909  0.00  0.00    +0.001 A 
ATOM     17  C   LIG    1        0.742   0.376   0.182  0.00  0.00    +0.007 A 
ATOM     18  C   LIG    1       -2.456  -0.764  -1.692  0.00  0.00    +0.004 A 
ENDROOT
TORSDOF 0