REMARK  Name = BDB064099
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.721   0.317   2.071  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1        0.366  -1.010   2.300  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1       -0.921  -1.386   2.328  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1        1.347  -1.978   2.495  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1        2.696  -1.617   2.471  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1        3.074  -0.285   2.245  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1        2.072   0.684   2.064  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1   9
ATOM      8  O   LIG    1       -0.212   2.348   2.661  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1       -0.305   1.367   1.927  0.00  0.00    +0.250 C 
ATOM     10  N   LIG    1       -1.325   1.217   0.990  0.00  0.00    -0.288 N 
ATOM     11  C   LIG    1       -2.334   2.284   0.948  0.00  0.00    +0.184 C 
ATOM     12  C   LIG    1       -3.561   1.832   0.236  0.00  0.00    +0.151 A 
ATOM     13  N   LIG    1       -4.711   2.458   0.116  0.00  0.00    -0.133 NA
ATOM     14  N   LIG    1       -5.553   1.659  -0.621  0.00  0.00    -0.134 NA
ATOM     15  C   LIG    1       -4.905   0.559  -0.952  0.00  0.00    +0.139 A 
ATOM     16  N   LIG    1       -3.639   0.645  -0.443  0.00  0.00    -0.312 N 
ATOM     17  C   LIG    1       -2.551  -0.305  -0.512  0.00  0.00    +0.144 C 
ATOM     18  C   LIG    1       -1.222   0.383  -0.213  0.00  0.00    +0.130 C 
BRANCH  15  19
ATOM     19  C   LIG    1       -5.446  -0.612  -1.712  0.00  0.00    +0.085 C 
ATOM     20  C   LIG    1       -6.609  -0.244  -2.633  0.00  0.00    +0.171 C 
ATOM     21  O   LIG    1       -7.829  -0.708  -2.025  0.00  0.00    -0.379 OA
ATOM     22  C   LIG    1       -7.514  -1.173  -0.710  0.00  0.00    +0.160 C 
ATOM     23  C   LIG    1       -6.075  -1.632  -0.780  0.00  0.00    +0.041 C 
ENDBRANCH  15  19
ENDBRANCH   1   9
BRANCH   6  24
ATOM     24  C   LIG    1        4.533   0.117   2.234  0.00  0.00    +0.093 C 
BRANCH  24  25
ATOM     25  C   LIG    1        4.958   0.755   0.917  0.00  0.00    +0.074 A 
ATOM     26  C   LIG    1        5.326  -0.096  -0.244  0.00  0.00    +0.011 A 
ATOM     27  C   LIG    1        5.673   0.558  -1.426  0.00  0.00    +0.050 A 
ATOM     28  C   LIG    1        6.028  -0.169  -2.568  0.00  0.00    +0.014 A 
ATOM     29  C   LIG    1        6.039  -1.562  -2.527  0.00  0.00    +0.001 A 
ATOM     30  C   LIG    1        5.696  -2.223  -1.349  0.00  0.00    +0.001 A 
ATOM     31  C   LIG    1        5.665   2.029  -1.464  0.00  0.00    +0.272 A 
ATOM     32  O   LIG    1        5.955   2.643  -2.484  0.00  0.00    -0.266 OA
ATOM     33  N   LIG    1        5.314   2.661  -0.297  0.00  0.00    -0.242 N 
ATOM     34  H   LIG    1        5.303   3.677  -0.302  0.00  0.00    +0.192 HD
ATOM     35  C   LIG    1        5.340  -1.495  -0.209  0.00  0.00    +0.010 A 
ATOM     36  N   LIG    1        4.961   2.056   0.867  0.00  0.00    -0.175 NA
ENDBRANCH  24  25
ENDBRANCH   6  24
TORSDOF 4