REMARK  Name = BDB009314
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.115  -1.053  -0.350  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -1.005  -2.436  -0.253  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        0.037  -3.002   0.373  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -1.970  -3.256  -0.825  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -3.065  -2.687  -1.482  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -3.212  -1.290  -1.556  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -2.217  -0.475  -0.993  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1   9
ATOM      8  O   LIG    1       -0.500   0.496   1.242  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1       -0.121  -0.180   0.287  0.00  0.00    +0.249 C 
ATOM     10  N   LIG    1        1.172  -0.132  -0.217  0.00  0.00    -0.294 N 
ATOM     11  C   LIG    1        2.130   0.740   0.469  0.00  0.00    +0.127 C 
ATOM     12  C   LIG    1        3.473   0.871  -0.258  0.00  0.00    +0.128 C 
ATOM     13  N   LIG    1        3.999  -0.441  -0.650  0.00  0.00    -0.282 N 
ATOM     14  C   LIG    1        5.351  -0.719  -0.780  0.00  0.00    +0.305 C 
ATOM     15  N   LIG    1        6.205   0.033   0.026  0.00  0.00    -0.285 N 
ATOM     16  C   LIG    1        6.041  -0.119   1.474  0.00  0.00    +0.109 C 
ATOM     17  C   LIG    1        6.769   0.984   2.235  0.00  0.00    +0.019 C 
ATOM     18  C   LIG    1        8.239   1.052   1.827  0.00  0.00    +0.003 C 
ATOM     19  C   LIG    1        8.373   1.173   0.311  0.00  0.00    +0.019 C 
ATOM     20  C   LIG    1        7.600   0.069  -0.403  0.00  0.00    +0.109 C 
ATOM     21  O   LIG    1        5.772  -1.566  -1.566  0.00  0.00    -0.252 OA
ATOM     22  C   LIG    1        3.055  -1.331  -1.331  0.00  0.00    +0.128 C 
ATOM     23  C   LIG    1        1.636  -0.758  -1.462  0.00  0.00    +0.127 C 
ENDBRANCH   1   9
BRANCH   6  24
ATOM     24  C   LIG    1       -4.402  -0.704  -2.286  0.00  0.00    +0.092 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -4.966   0.567  -1.658  0.00  0.00    +0.069 A 
ATOM     26  C   LIG    1       -5.885   0.465  -0.481  0.00  0.00    -0.016 A 
ATOM     27  C   LIG    1       -6.234  -0.870   0.114  0.00  0.00    +0.037 C 
ATOM     28  C   LIG    1       -6.918  -0.768   1.481  0.00  0.00    +0.005 C 
ATOM     29  C   LIG    1       -7.966   0.338   1.492  0.00  0.00    +0.005 C 
ATOM     30  C   LIG    1       -7.337   1.692   1.156  0.00  0.00    +0.041 C 
ATOM     31  C   LIG    1       -6.372   1.620   0.005  0.00  0.00    +0.023 A 
ATOM     32  C   LIG    1       -5.969   2.913  -0.602  0.00  0.00    +0.268 A 
ATOM     33  O   LIG    1       -6.387   3.986  -0.179  0.00  0.00    -0.266 OA
ATOM     34  N   LIG    1       -5.106   2.834  -1.661  0.00  0.00    -0.243 N 
ATOM     35  H   LIG    1       -4.818   3.707  -2.089  0.00  0.00    +0.192 HD
ATOM     36  N   LIG    1       -4.606   1.691  -2.203  0.00  0.00    -0.175 NA
ENDBRANCH  24  25
ENDBRANCH   6  24
TORSDOF 3