REMARK  Name = BDB009411
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.071  -0.407  -0.836  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1        0.237  -0.892  -2.129  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        1.168  -1.815  -2.408  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -0.565  -0.420  -3.163  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -1.554   0.530  -2.899  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -1.763   1.001  -1.592  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -0.933   0.530  -0.561  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1   9
ATOM      8  O   LIG    1        0.317  -1.451   1.213  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1        0.898  -0.910   0.275  0.00  0.00    +0.249 C 
ATOM     10  N   LIG    1        2.275  -0.727   0.234  0.00  0.00    -0.294 N 
ATOM     11  C   LIG    1        2.986   0.114  -0.739  0.00  0.00    +0.127 C 
ATOM     12  C   LIG    1        4.302   0.693  -0.188  0.00  0.00    +0.127 C 
ATOM     13  N   LIG    1        5.165  -0.371   0.320  0.00  0.00    -0.297 N 
ATOM     14  C   LIG    1        4.545  -1.558   0.914  0.00  0.00    +0.127 C 
ATOM     15  C   LIG    1        3.083  -1.295   1.316  0.00  0.00    +0.127 C 
BRANCH  13  16
ATOM     16  C   LIG    1        6.482  -0.083   0.603  0.00  0.00    +0.221 A 
ATOM     17  N   LIG    1        7.246  -1.034   1.141  0.00  0.00    -0.203 NA
ATOM     18  C   LIG    1        8.513  -0.703   1.376  0.00  0.00    +0.226 A 
ATOM     19  N   LIG    1        9.075   0.473   1.127  0.00  0.00    -0.224 NA
ATOM     20  C   LIG    1        8.233   1.346   0.591  0.00  0.00    +0.226 A 
ATOM     21  N   LIG    1        6.949   1.131   0.309  0.00  0.00    -0.203 NA
ENDBRANCH  13  16
ENDBRANCH   1   9
BRANCH   6  22
ATOM     22  C   LIG    1       -2.833   2.037  -1.323  0.00  0.00    +0.094 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -3.657   1.779  -0.069  0.00  0.00    +0.087 A 
ATOM     24  C   LIG    1       -4.625   0.627  -0.049  0.00  0.00    +0.059 A 
ATOM     25  N   LIG    1       -4.809  -0.201  -1.146  0.00  0.00    -0.342 N 
ATOM     26  H   LIG    1       -4.495   0.154  -2.042  0.00  0.00    +0.146 HD
ATOM     27  C   LIG    1       -5.916  -1.146  -1.199  0.00  0.00    +0.102 C 
ATOM     28  C   LIG    1       -6.113  -1.771   0.179  0.00  0.00    +0.023 C 
ATOM     29  C   LIG    1       -6.274  -0.695   1.261  0.00  0.00    +0.044 C 
ATOM     30  C   LIG    1       -5.298   0.439   1.097  0.00  0.00    +0.041 A 
ATOM     31  C   LIG    1       -5.100   1.352   2.244  0.00  0.00    +0.270 A 
ATOM     32  O   LIG    1       -5.725   1.220   3.291  0.00  0.00    -0.266 OA
ATOM     33  N   LIG    1       -4.189   2.358   2.061  0.00  0.00    -0.243 N 
ATOM     34  H   LIG    1       -4.035   2.989   2.840  0.00  0.00    +0.192 HD
ATOM     35  N   LIG    1       -3.464   2.587   0.932  0.00  0.00    -0.174 NA
ENDBRANCH  22  23
ENDBRANCH   6  22
TORSDOF 4