REMARK  Name = BDB035147
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.319  -0.986   0.393  0.00  0.00    -0.296 NA
ATOM      2  C   LIG    1        1.031  -1.555   0.586  0.00  0.00    +0.100 C 
ATOM      3  C   LIG    1        2.119  -0.466   0.739  0.00  0.00    +0.100 C 
ATOM      4  N   LIG    1        2.155   0.470  -0.399  0.00  0.00    -0.292 NA
ATOM      5  C   LIG    1        0.798   1.019  -0.617  0.00  0.00    +0.100 C 
ATOM      6  C   LIG    1       -0.271  -0.085  -0.780  0.00  0.00    +0.100 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        3.161   1.549  -0.255  0.00  0.00    +0.101 C 
ATOM      8  C   LIG    1        4.533   1.161   0.379  0.00  0.00    +0.165 C 
ATOM      9  N   LIG    1        5.357   0.275  -0.469  0.00  0.00    -0.277 NA
ATOM     10  C   LIG    1        5.315   0.569  -1.730  0.00  0.00    +0.120 C 
ATOM     11  C   LIG    1        4.499   1.649  -2.349  0.00  0.00    +0.030 C 
ATOM     12  C   LIG    1        3.459   2.098  -1.632  0.00  0.00    -0.004 C 
BRANCH  10  13
ATOM     13  C   LIG    1        6.177  -0.216  -2.714  0.00  0.00    +0.262 C 
ATOM     14  N   LIG    1        7.537  -0.240  -2.501  0.00  0.00    -0.304 N 
ATOM     15  H   LIG    1        8.054  -0.823  -3.151  0.00  0.00    +0.149 HD
ATOM     16  O   LIG    1        5.652  -0.756  -3.680  0.00  0.00    -0.269 OA
BRANCH  14  17
ATOM     17  C   LIG    1        8.234   0.298  -1.377  0.00  0.00    +0.110 C 
ATOM     18  C   LIG    1        9.658  -0.098  -1.103  0.00  0.00    +0.188 C 
ATOM     19  F   LIG    1       10.235  -1.020  -1.959  0.00  0.00    -0.244 F 
ATOM     20  C   LIG    1        8.573  -0.581  -0.201  0.00  0.00    +0.064 C 
ENDBRANCH  14  17
ENDBRANCH  10  13
ENDBRANCH   4   7
BRANCH   1  21
ATOM     21  C   LIG    1       -1.304  -2.063   0.195  0.00  0.00    +0.121 C 
BRANCH  21  31
ATOM     22  C   LIG    1       -7.348   0.439   0.460  0.00  0.00    +0.077 C 
ATOM     23  C   LIG    1       -6.196   1.380   0.149  0.00  0.00    +0.217 C 
ATOM     24  O   LIG    1       -6.367   2.542  -0.208  0.00  0.00    -0.275 OA
ATOM     25  N   LIG    1       -4.931   0.889   0.299  0.00  0.00    -0.307 N 
ATOM     26  H   LIG    1       -4.217   1.594   0.168  0.00  0.00    +0.149 HD
ATOM     27  C   LIG    1       -4.654  -0.242   1.149  0.00  0.00    +0.121 C 
ATOM     28  C   LIG    1       -5.588  -1.446   0.891  0.00  0.00    +0.130 C 
ATOM     29  N   LIG    1       -5.046  -2.477  -0.022  0.00  0.00    -0.286 NA
ATOM     30  C   LIG    1       -3.775  -2.533  -0.194  0.00  0.00    +0.110 C 
ATOM     31  C   LIG    1       -2.740  -1.655   0.400  0.00  0.00    -0.018 C 
ATOM     32  C   LIG    1       -3.200  -0.556   1.015  0.00  0.00    +0.003 C 
ATOM     33  C   LIG    1       -6.958  -1.036   0.321  0.00  0.00    +0.041 C 
BRANCH  22  35
ATOM     34  C   LIG    1       -7.351   0.624   3.055  0.00  0.00    +0.004 C 
ATOM     35  C   LIG    1       -8.098   0.813   1.747  0.00  0.00    +0.009 C 
ENDBRANCH  22  35
ENDBRANCH  21  31
ENDBRANCH   1  21
TORSDOF 6