REMARK  Name = BDB063042
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.749   1.555   0.485  0.00  0.00    +0.038 A 
ATOM      2  C   LIG    1        0.156   0.541   0.833  0.00  0.00    +0.029 A 
ATOM      3  C   LIG    1        1.506   0.622   0.452  0.00  0.00    +0.073 A 
ATOM      4  C   LIG    1        1.927   1.741  -0.270  0.00  0.00    +0.136 A 
ATOM      5  F   LIG    1        3.205   1.875  -0.658  0.00  0.00    -0.205 F 
ATOM      6  C   LIG    1        1.038   2.761  -0.609  0.00  0.00    +0.040 A 
ATOM      7  C   LIG    1       -0.302   2.672  -0.230  0.00  0.00    +0.016 A 
ENDROOT
BRANCH   1   9
ATOM      8  O   LIG    1       -2.434   0.816   1.949  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1       -2.166   1.423   0.920  0.00  0.00    +0.244 C 
ATOM     10  N   LIG    1       -3.109   1.989   0.090  0.00  0.00    -0.307 N 
ATOM     11  H   LIG    1       -2.840   2.250  -0.848  0.00  0.00    +0.149 HD
BRANCH  10  12
ATOM     12  C   LIG    1       -4.524   1.782   0.314  0.00  0.00    +0.139 C 
BRANCH  12  13
ATOM     13  C   LIG    1       -5.057   0.715  -0.608  0.00  0.00    -0.030 A 
ATOM     14  C   LIG    1       -5.731   1.056  -1.789  0.00  0.00    +0.005 A 
ATOM     15  C   LIG    1       -6.200   0.060  -2.647  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1       -5.995  -1.283  -2.338  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1       -5.320  -1.634  -1.170  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1       -4.851  -0.640  -0.310  0.00  0.00    +0.005 A 
ENDBRANCH  12  13
ENDBRANCH  10  12
ENDBRANCH   1   9
BRANCH   3  19
ATOM     19  C   LIG    1        2.422  -0.499   0.834  0.00  0.00    +0.251 C 
ATOM     20  N   LIG    1        3.758  -0.341   0.514  0.00  0.00    -0.281 N 
ATOM     21  H   LIG    1        4.023   0.515   0.039  0.00  0.00    +0.155 HD
ATOM     22  O   LIG    1        1.930  -1.471   1.397  0.00  0.00    -0.270 OA
BRANCH  20  23
ATOM     23  C   LIG    1        4.819  -1.238   0.764  0.00  0.00    +0.034 A 
ATOM     24  C   LIG    1        4.672  -2.468   1.407  0.00  0.00    +0.023 A 
ATOM     25  C   LIG    1        5.780  -3.297   1.614  0.00  0.00    +0.002 A 
ATOM     26  C   LIG    1        7.043  -2.904   1.181  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1        7.202  -1.679   0.540  0.00  0.00    +0.002 A 
ATOM     28  C   LIG    1        6.095  -0.851   0.333  0.00  0.00    +0.023 A 
ENDBRANCH  20  23
ENDBRANCH   3  19
TORSDOF 5