REMARK  Name = BDB061770
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.499   0.787  -1.292  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -0.294   1.131  -2.623  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        0.665   2.001  -2.971  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -1.076   0.559  -3.620  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -2.083  -0.349  -3.279  0.00  0.00    +0.008 A 
ATOM      6  C   LIG    1       -2.329  -0.680  -1.935  0.00  0.00    -0.027 A 
ATOM      7  C   LIG    1       -1.515  -0.111  -0.941  0.00  0.00    +0.021 A 
ENDROOT
BRANCH   1  14
ATOM      8  C   LIG    1        2.169  -0.274   2.785  0.00  0.00    +0.026 C 
ATOM      9  C   LIG    1        3.151   0.456   1.861  0.00  0.00    +0.071 C 
ATOM     10  N   LIG    1        3.831  -0.567   1.038  0.00  0.00    -0.296 NA
ATOM     11  C   LIG    1        3.712  -0.344  -0.406  0.00  0.00    +0.103 C 
ATOM     12  C   LIG    1        2.249  -0.093  -0.819  0.00  0.00    +0.123 C 
ATOM     13  N   LIG    1        1.612   0.984  -0.052  0.00  0.00    -0.295 N 
ATOM     14  C   LIG    1        0.302   1.406  -0.228  0.00  0.00    +0.249 C 
ATOM     15  O   LIG    1       -0.257   2.239   0.481  0.00  0.00    -0.270 OA
ATOM     16  C   LIG    1        2.404   1.544   1.042  0.00  0.00    +0.126 C 
BRANCH  10  17
ATOM     17  C   LIG    1        5.178  -0.913   1.485  0.00  0.00    +0.088 C 
BRANCH  17  18
ATOM     18  C   LIG    1        6.212   0.139   1.204  0.00  0.00    +0.003 C 
ATOM     19  C   LIG    1        7.062   0.085  -0.043  0.00  0.00    +0.005 C 
ATOM     20  C   LIG    1        7.676  -0.217   1.294  0.00  0.00    +0.005 C 
ENDBRANCH  17  18
ENDBRANCH  10  17
ENDBRANCH   1  14
BRANCH   6  21
ATOM     21  C   LIG    1       -3.418  -1.678  -1.591  0.00  0.00    +0.162 C 
BRANCH  21  22
ATOM     22  N   LIG    1       -4.197  -1.336  -0.400  0.00  0.00    -0.289 N 
ATOM     23  C   LIG    1       -5.192  -0.311  -0.435  0.00  0.00    +0.059 A 
ATOM     24  C   LIG    1       -5.918  -0.015   0.725  0.00  0.00    +0.063 A 
ATOM     25  C   LIG    1       -6.905   0.981   0.739  0.00  0.00    +0.015 A 
ATOM     26  C   LIG    1       -7.179   1.700  -0.420  0.00  0.00    +0.001 A 
ATOM     27  C   LIG    1       -6.469   1.422  -1.584  0.00  0.00    +0.002 A 
ATOM     28  C   LIG    1       -5.640  -0.769   1.956  0.00  0.00    +0.262 A 
ATOM     29  O   LIG    1       -6.258  -0.568   2.996  0.00  0.00    -0.267 OA
ATOM     30  N   LIG    1       -4.656  -1.713   1.870  0.00  0.00    -0.274 N 
ATOM     31  H   LIG    1       -4.451  -2.231   2.710  0.00  0.00    +0.173 HD
ATOM     32  C   LIG    1       -5.485   0.424  -1.593  0.00  0.00    +0.027 A 
ATOM     33  C   LIG    1       -3.924  -2.038   0.765  0.00  0.00    +0.330 A 
ATOM     34  O   LIG    1       -3.069  -2.919   0.852  0.00  0.00    -0.246 OA
ENDBRANCH  21  22
ENDBRANCH   6  21
TORSDOF 5