REMARK  Name = BDB032160
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.425  -1.776  -0.919  0.00  0.00    -0.007 A 
ATOM      2  C   LIG    1       -1.239  -0.690  -1.277  0.00  0.00    +0.020 A 
ATOM      3  C   LIG    1       -2.568  -0.723  -0.894  0.00  0.00    +0.045 A 
ATOM      4  C   LIG    1       -3.627   0.265  -1.127  0.00  0.00    +0.248 C 
ATOM      5  N   LIG    1       -4.796  -0.270  -0.603  0.00  0.00    -0.282 N 
ATOM      6  C   LIG    1       -4.550  -1.511   0.123  0.00  0.00    +0.147 C 
ATOM      7  O   LIG    1       -3.459   1.341  -1.665  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1       -3.117  -1.772  -0.166  0.00  0.00    +0.017 A 
ATOM      9  C   LIG    1       -2.323  -2.833   0.199  0.00  0.00    +0.129 A 
ATOM     10  F   LIG    1       -2.832  -3.849   0.906  0.00  0.00    -0.205 F 
ATOM     11  C   LIG    1       -0.977  -2.842  -0.171  0.00  0.00    +0.045 A 
ENDROOT
BRANCH   5  12
ATOM     12  C   LIG    1       -6.032   0.484  -0.415  0.00  0.00    +0.163 C 
ATOM     13  C   LIG    1       -5.910   1.465   0.761  0.00  0.00    +0.240 C 
ATOM     14  O   LIG    1       -5.195   1.263   1.742  0.00  0.00    -0.273 OA
ATOM     15  N   LIG    1       -6.745   2.558   0.724  0.00  0.00    -0.255 N 
ATOM     16  H   LIG    1       -6.688   3.185   1.514  0.00  0.00    +0.158 HD
ATOM     17  C   LIG    1       -7.703   2.856  -0.213  0.00  0.00    +0.219 C 
ATOM     18  O   LIG    1       -8.463   3.808  -0.058  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1       -7.827   1.908  -1.383  0.00  0.00    +0.098 C 
ATOM     20  C   LIG    1       -6.506   1.213  -1.673  0.00  0.00    +0.041 C 
ENDBRANCH   5  12
BRANCH   1  21
ATOM     21  C   LIG    1        1.039  -1.781  -1.280  0.00  0.00    +0.269 C 
BRANCH  21  22
ATOM     22  O   LIG    1        1.739  -1.095  -0.241  0.00  0.00    -0.445 OA
BRANCH  22  25
ATOM     23  N   LIG    1        3.630  -0.372   0.626  0.00  0.00    -0.251 N 
ATOM     24  H   LIG    1        2.944  -0.038   1.288  0.00  0.00    +0.158 HD
ATOM     25  C   LIG    1        3.086  -1.059  -0.420  0.00  0.00    +0.405 C 
ATOM     26  O   LIG    1        3.655  -1.571  -1.371  0.00  0.00    -0.226 OA
BRANCH  23  30
ATOM     27  C   LIG    1        6.891   1.784   3.598  0.00  0.00    +0.044 C 
ATOM     28  C   LIG    1        6.596   0.974   2.371  0.00  0.00    -0.048 A 
ATOM     29  C   LIG    1        5.274   0.653   2.033  0.00  0.00    +0.026 A 
ATOM     30  C   LIG    1        4.981  -0.083   0.877  0.00  0.00    +0.037 A 
ATOM     31  C   LIG    1        6.029  -0.485   0.047  0.00  0.00    +0.026 A 
ATOM     32  C   LIG    1        7.357  -0.148   0.352  0.00  0.00    -0.048 A 
ATOM     33  C   LIG    1        8.475  -0.609  -0.537  0.00  0.00    +0.044 C 
ATOM     34  C   LIG    1        7.631   0.575   1.519  0.00  0.00    +0.006 A 
ENDBRANCH  23  30
ENDBRANCH  22  25
ENDBRANCH  21  22
ENDBRANCH   1  21
TORSDOF 5