REMARK  Name = BDB061765
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.829   0.188  -0.202  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -0.913   0.744  -1.474  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1       -1.917   1.569  -1.806  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1        0.054   0.455  -2.431  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1        1.131  -0.374  -2.106  0.00  0.00    +0.008 A 
ATOM      6  C   LIG    1        1.261  -0.905  -0.812  0.00  0.00    -0.027 A 
ATOM      7  C   LIG    1        0.261  -0.626   0.134  0.00  0.00    +0.021 A 
ENDROOT
BRANCH   1  15
ATOM      8  C   LIG    1       -6.540   1.192   2.184  0.00  0.00    +0.025 C 
ATOM      9  C   LIG    1       -5.569   0.773   1.082  0.00  0.00    +0.068 C 
ATOM     10  N   LIG    1       -6.066  -0.453   0.421  0.00  0.00    -0.311 NA
ATOM     11  H   LIG    1       -6.618  -1.014   1.070  0.00  0.00    +0.122 HD
ATOM     12  C   LIG    1       -4.981  -1.284  -0.124  0.00  0.00    +0.100 C 
ATOM     13  C   LIG    1       -3.714  -0.505  -0.521  0.00  0.00    +0.123 C 
ATOM     14  N   LIG    1       -3.168   0.253   0.612  0.00  0.00    -0.295 N 
ATOM     15  C   LIG    1       -1.821   0.495   0.844  0.00  0.00    +0.249 C 
ATOM     16  O   LIG    1       -1.391   0.927   1.913  0.00  0.00    -0.270 OA
ATOM     17  C   LIG    1       -4.131   0.656   1.638  0.00  0.00    +0.126 C 
ENDBRANCH   1  15
BRANCH   6  18
ATOM     18  C   LIG    1        2.434  -1.792  -0.440  0.00  0.00    +0.162 C 
BRANCH  18  19
ATOM     19  N   LIG    1        3.739  -1.210  -0.756  0.00  0.00    -0.289 N 
ATOM     20  C   LIG    1        4.316  -0.193   0.067  0.00  0.00    +0.059 A 
ATOM     21  C   LIG    1        5.558   0.353  -0.279  0.00  0.00    +0.063 A 
ATOM     22  C   LIG    1        6.162   1.357   0.492  0.00  0.00    +0.015 A 
ATOM     23  C   LIG    1        5.522   1.831   1.633  0.00  0.00    +0.001 A 
ATOM     24  C   LIG    1        4.288   1.302   1.996  0.00  0.00    +0.002 A 
ATOM     25  C   LIG    1        6.246  -0.140  -1.481  0.00  0.00    +0.262 A 
ATOM     26  O   LIG    1        7.328   0.309  -1.842  0.00  0.00    -0.267 OA
ATOM     27  N   LIG    1        5.606  -1.127  -2.175  0.00  0.00    -0.274 N 
ATOM     28  H   LIG    1        6.063  -1.464  -3.008  0.00  0.00    +0.173 HD
ATOM     29  C   LIG    1        3.691   0.298   1.223  0.00  0.00    +0.027 A 
ATOM     30  C   LIG    1        4.386  -1.671  -1.893  0.00  0.00    +0.330 A 
ATOM     31  O   LIG    1        3.922  -2.521  -2.651  0.00  0.00    -0.246 OA
ENDBRANCH  18  19
ENDBRANCH   6  18
TORSDOF 3