REMARK  Name = BDB064181
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.048  -0.365   0.273  0.00  0.00    +0.029 C 
ATOM      2  C   LIG    1       -0.874   0.450  -0.253  0.00  0.00    +0.119 C 
ATOM      3  N   LIG    1        0.239  -0.476  -0.249  0.00  0.00    -0.271 N 
ATOM      4  C   LIG    1       -0.219  -1.801  -0.234  0.00  0.00    +0.220 C 
ATOM      5  O   LIG    1        0.419  -2.841  -0.281  0.00  0.00    -0.275 OA
ATOM      6  C   LIG    1       -1.729  -1.772  -0.214  0.00  0.00    +0.102 C 
ENDROOT
BRANCH   3   7
ATOM      7  C   LIG    1        1.591  -0.051  -0.372  0.00  0.00    +0.039 A 
ATOM      8  C   LIG    1        2.660  -0.955  -0.294  0.00  0.00    +0.064 A 
ATOM      9  C   LIG    1        3.978  -0.512  -0.415  0.00  0.00    +0.160 A 
ATOM     10  F   LIG    1        4.979  -1.400  -0.331  0.00  0.00    -0.202 F 
ATOM     11  C   LIG    1        4.257   0.830  -0.614  0.00  0.00    +0.159 A 
ATOM     12  F   LIG    1        5.523   1.252  -0.729  0.00  0.00    -0.202 F 
ATOM     13  C   LIG    1        3.221   1.749  -0.696  0.00  0.00    +0.043 A 
ATOM     14  C   LIG    1        1.897   1.309  -0.575  0.00  0.00    +0.026 A 
ENDBRANCH   3   7
BRANCH   1  15
ATOM     15  C   LIG    1       -3.406   0.130  -0.210  0.00  0.00    +0.083 C 
BRANCH  15  16
ATOM     16  N   LIG    1       -3.658   1.488   0.258  0.00  0.00    -0.330 NA
ATOM     17  H   LIG    1       -3.741   1.493   1.276  0.00  0.00    +0.118 HD
ATOM     18  H   LIG    1       -4.566   1.800  -0.090  0.00  0.00    +0.118 HD
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 3