REMARK  Name = BDB035118
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.276  -0.899  -0.714  0.00  0.00    -0.296 NA
ATOM      2  C   LIG    1        1.067  -1.481  -0.592  0.00  0.00    +0.100 C 
ATOM      3  C   LIG    1        2.174  -0.406  -0.414  0.00  0.00    +0.100 C 
ATOM      4  N   LIG    1        1.933   0.850  -1.139  0.00  0.00    -0.292 NA
ATOM      5  C   LIG    1        1.034   0.664  -2.277  0.00  0.00    +0.100 C 
ATOM      6  C   LIG    1       -0.327   0.045  -1.856  0.00  0.00    +0.100 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        3.114   1.681  -1.406  0.00  0.00    +0.101 C 
ATOM      8  C   LIG    1        3.871   2.116  -0.120  0.00  0.00    +0.165 C 
ATOM      9  N   LIG    1        4.931   1.191   0.337  0.00  0.00    -0.277 NA
ATOM     10  C   LIG    1        5.550   0.537  -0.594  0.00  0.00    +0.120 C 
ATOM     11  C   LIG    1        5.255   0.581  -2.047  0.00  0.00    +0.030 C 
ATOM     12  C   LIG    1        4.070   1.088  -2.409  0.00  0.00    -0.004 C 
BRANCH  10  13
ATOM     13  C   LIG    1        6.708  -0.379  -0.170  0.00  0.00    +0.262 C 
ATOM     14  N   LIG    1        7.081  -0.191   1.141  0.00  0.00    -0.304 N 
ATOM     15  H   LIG    1        6.535   0.489   1.669  0.00  0.00    +0.149 HD
ATOM     16  O   LIG    1        7.203  -1.175  -0.956  0.00  0.00    -0.269 OA
BRANCH  14  17
ATOM     17  C   LIG    1        8.095  -0.951   1.796  0.00  0.00    +0.110 C 
ATOM     18  C   LIG    1        8.532  -0.608   3.190  0.00  0.00    +0.188 C 
ATOM     19  F   LIG    1        7.889   0.444   3.820  0.00  0.00    -0.244 F 
ATOM     20  C   LIG    1        7.739  -1.851   2.951  0.00  0.00    +0.064 C 
ENDBRANCH  14  17
ENDBRANCH  10  13
ENDBRANCH   4   7
BRANCH   1  21
ATOM     21  C   LIG    1       -1.312  -1.935  -0.803  0.00  0.00    +0.121 C 
BRANCH  21  31
ATOM     22  C   LIG    1       -7.177   0.876  -0.044  0.00  0.00    +0.077 C 
ATOM     23  C   LIG    1       -5.997   1.764  -0.399  0.00  0.00    +0.217 C 
ATOM     24  O   LIG    1       -6.126   2.947  -0.703  0.00  0.00    -0.275 OA
ATOM     25  N   LIG    1       -4.755   1.199  -0.349  0.00  0.00    -0.307 N 
ATOM     26  H   LIG    1       -4.008   1.865  -0.500  0.00  0.00    +0.149 HD
ATOM     27  C   LIG    1       -4.495   0.010   0.423  0.00  0.00    +0.121 C 
ATOM     28  C   LIG    1       -5.505  -1.128   0.151  0.00  0.00    +0.130 C 
ATOM     29  N   LIG    1       -5.081  -2.108  -0.875  0.00  0.00    -0.286 NA
ATOM     30  C   LIG    1       -3.825  -2.225  -1.118  0.00  0.00    +0.110 C 
ATOM     31  C   LIG    1       -2.711  -1.459  -0.513  0.00  0.00    -0.018 C 
ATOM     32  C   LIG    1       -3.071  -0.376   0.192  0.00  0.00    +0.003 C 
ATOM     33  C   LIG    1       -6.890  -0.611  -0.282  0.00  0.00    +0.041 C 
BRANCH  22  35
ATOM     34  C   LIG    1       -6.979   0.934   2.549  0.00  0.00    +0.004 C 
ATOM     35  C   LIG    1       -7.808   1.224   1.312  0.00  0.00    +0.009 C 
ENDBRANCH  22  35
ENDBRANCH  21  31
ENDBRANCH   1  21
TORSDOF 6