REMARK  Name = BDB064219
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.907   0.498  -1.606  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -0.854   1.284  -2.751  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1       -0.040   0.972  -3.768  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -1.622   2.441  -2.839  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -2.459   2.805  -1.780  0.00  0.00    +0.008 A 
ATOM      6  C   LIG    1       -2.547   2.005  -0.626  0.00  0.00    -0.027 A 
ATOM      7  C   LIG    1       -1.752   0.851  -0.544  0.00  0.00    +0.021 A 
ENDROOT
BRANCH   1  13
ATOM      8  N   LIG    1        3.622  -0.655  -0.746  0.00  0.00    -0.299 N 
ATOM      9  C   LIG    1        2.937   0.464  -0.260  0.00  0.00    +0.233 C 
ATOM     10  O   LIG    1        3.495   1.542  -0.043  0.00  0.00    -0.274 OA
ATOM     11  C   LIG    1        1.465   0.271   0.166  0.00  0.00    +0.204 C 
ATOM     12  N   LIG    1        0.806  -0.868  -0.476  0.00  0.00    -0.287 N 
ATOM     13  C   LIG    1       -0.099  -0.730  -1.528  0.00  0.00    +0.250 C 
ATOM     14  O   LIG    1       -0.297  -1.606  -2.366  0.00  0.00    -0.270 OA
ATOM     15  C   LIG    1        1.604  -2.083  -0.432  0.00  0.00    +0.127 C 
ATOM     16  C   LIG    1        2.897  -1.847  -1.208  0.00  0.00    +0.127 C 
BRANCH   8  17
ATOM     17  C   LIG    1        5.015  -0.508  -1.168  0.00  0.00    +0.108 C 
BRANCH  17  18
ATOM     18  C   LIG    1        5.978  -1.430  -0.409  0.00  0.00    +0.022 C 
BRANCH  18  20
ATOM     19  C   LIG    1        6.876  -2.291   1.774  0.00  0.00    +0.007 C 
ATOM     20  C   LIG    1        6.023  -1.204   1.115  0.00  0.00    -0.016 C 
ATOM     21  C   LIG    1        6.579   0.174   1.480  0.00  0.00    +0.007 C 
ENDBRANCH  18  20
ENDBRANCH  17  18
ENDBRANCH   8  17
ENDBRANCH   1  13
BRANCH   6  22
ATOM     22  C   LIG    1       -3.444   2.426   0.523  0.00  0.00    +0.162 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -4.262   1.342   1.069  0.00  0.00    -0.289 N 
ATOM     24  C   LIG    1       -5.441   0.893   0.397  0.00  0.00    +0.059 A 
ATOM     25  C   LIG    1       -6.194  -0.150   0.948  0.00  0.00    +0.063 A 
ATOM     26  C   LIG    1       -7.356  -0.627   0.325  0.00  0.00    +0.015 A 
ATOM     27  C   LIG    1       -7.782  -0.059  -0.871  0.00  0.00    +0.001 A 
ATOM     28  C   LIG    1       -7.049   0.980  -1.436  0.00  0.00    +0.002 A 
ATOM     29  C   LIG    1       -5.756  -0.760   2.213  0.00  0.00    +0.262 A 
ATOM     30  O   LIG    1       -6.371  -1.678   2.740  0.00  0.00    -0.267 OA
ATOM     31  N   LIG    1       -4.619  -0.239   2.764  0.00  0.00    -0.274 N 
ATOM     32  H   LIG    1       -4.301  -0.659   3.625  0.00  0.00    +0.173 HD
ATOM     33  C   LIG    1       -5.889   1.452  -0.809  0.00  0.00    +0.027 A 
ATOM     34  C   LIG    1       -3.840   0.758   2.255  0.00  0.00    +0.330 A 
ATOM     35  O   LIG    1       -2.813   1.080   2.851  0.00  0.00    -0.246 OA
ENDBRANCH  22  23
ENDBRANCH   6  22
TORSDOF 6