REMARK  Name = BDB009362
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.030   0.540   0.041  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1        1.290   1.907   0.033  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        2.303   2.413  -0.686  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1        0.507   2.774   0.787  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -0.558   2.273   1.539  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -0.860   0.901   1.526  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -0.049   0.034   0.776  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1   9
ATOM      8  O   LIG    1        1.248  -1.012  -1.655  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1        1.834  -0.382  -0.777  0.00  0.00    +0.249 C 
ATOM     10  N   LIG    1        3.199  -0.512  -0.528  0.00  0.00    -0.297 N 
ATOM     11  C   LIG    1        3.950  -1.408  -1.401  0.00  0.00    +0.110 C 
ATOM     12  C   LIG    1        5.450  -1.391  -1.127  0.00  0.00    +0.050 C 
ATOM     13  C   LIG    1        5.925   0.033  -0.858  0.00  0.00    +0.118 C 
ATOM     14  C   LIG    1        5.182   0.682   0.315  0.00  0.00    +0.050 C 
ATOM     15  C   LIG    1        3.889  -0.044   0.672  0.00  0.00    +0.110 C 
BRANCH  13  16
ATOM     16  O   LIG    1        7.322   0.031  -0.574  0.00  0.00    -0.392 OA
ATOM     17  H   LIG    1        7.781  -0.308  -1.362  0.00  0.00    +0.210 HD
ENDBRANCH  13  16
ENDBRANCH   1   9
BRANCH   6  18
ATOM     18  C   LIG    1       -2.012   0.372   2.353  0.00  0.00    +0.094 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -2.882  -0.651   1.635  0.00  0.00    +0.087 A 
ATOM     20  C   LIG    1       -3.769  -0.200   0.506  0.00  0.00    +0.059 A 
ATOM     21  N   LIG    1       -3.838   1.127   0.107  0.00  0.00    -0.342 N 
ATOM     22  H   LIG    1       -3.500   1.818   0.767  0.00  0.00    +0.146 HD
ATOM     23  C   LIG    1       -4.873   1.585  -0.808  0.00  0.00    +0.102 C 
ATOM     24  C   LIG    1       -5.099   0.526  -1.885  0.00  0.00    +0.023 C 
ATOM     25  C   LIG    1       -5.391  -0.847  -1.264  0.00  0.00    +0.044 C 
ATOM     26  C   LIG    1       -4.488  -1.157  -0.102  0.00  0.00    +0.041 A 
ATOM     27  C   LIG    1       -4.413  -2.560   0.361  0.00  0.00    +0.270 A 
ATOM     28  O   LIG    1       -5.082  -3.448  -0.158  0.00  0.00    -0.266 OA
ATOM     29  N   LIG    1       -3.566  -2.804   1.409  0.00  0.00    -0.243 N 
ATOM     30  H   LIG    1       -3.497  -3.763   1.734  0.00  0.00    +0.192 HD
ATOM     31  N   LIG    1       -2.799  -1.882   2.051  0.00  0.00    -0.174 NA
ENDBRANCH  18  19
ENDBRANCH   6  18
TORSDOF 4