REMARK  Name = BDB035119
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.239   1.111  -0.813  0.00  0.00    -0.296 NA
ATOM      2  C   LIG    1        1.341   1.246  -1.774  0.00  0.00    +0.100 C 
ATOM      3  C   LIG    1        2.416   0.137  -1.606  0.00  0.00    +0.100 C 
ATOM      4  N   LIG    1        2.608  -0.337  -0.224  0.00  0.00    -0.289 NA
ATOM      5  C   LIG    1        2.227   0.689   0.748  0.00  0.00    +0.100 C 
ATOM      6  C   LIG    1        0.757   1.157   0.573  0.00  0.00    +0.100 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        3.907  -0.977   0.054  0.00  0.00    +0.137 C 
ATOM      8  C   LIG    1        4.202  -2.160  -0.840  0.00  0.00    +0.122 C 
ATOM      9  F   LIG    1        3.185  -2.857  -1.397  0.00  0.00    -0.208 F 
ATOM     10  C   LIG    1        5.448  -2.563  -1.100  0.00  0.00    +0.068 C 
ATOM     11  C   LIG    1        6.531  -1.840  -0.405  0.00  0.00    +0.122 C 
ATOM     12  N   LIG    1        6.434  -0.693   0.180  0.00  0.00    -0.277 NA
ATOM     13  C   LIG    1        5.127  -0.016   0.068  0.00  0.00    +0.168 C 
BRANCH  11  14
ATOM     14  C   LIG    1        7.878  -2.557  -0.414  0.00  0.00    +0.262 C 
ATOM     15  N   LIG    1        8.476  -2.844   0.790  0.00  0.00    -0.313 N 
ATOM     16  H   LIG    1        9.412  -3.219   0.698  0.00  0.00    +0.149 HD
ATOM     17  C   LIG    1        8.033  -2.396   2.088  0.00  0.00    +0.128 C 
ATOM     18  O   LIG    1        8.373  -2.882  -1.486  0.00  0.00    -0.269 OA
ENDBRANCH  11  14
ENDBRANCH   4   7
BRANCH   1  19
ATOM     19  C   LIG    1       -0.820   2.098  -1.049  0.00  0.00    +0.121 C 
BRANCH  19  29
ATOM     20  C   LIG    1       -6.741   0.107   1.089  0.00  0.00    +0.077 C 
ATOM     21  C   LIG    1       -5.763  -1.066   0.936  0.00  0.00    +0.217 C 
ATOM     22  O   LIG    1       -6.111  -2.232   1.112  0.00  0.00    -0.275 OA
ATOM     23  N   LIG    1       -4.479  -0.800   0.547  0.00  0.00    -0.307 N 
ATOM     24  H   LIG    1       -3.886  -1.620   0.569  0.00  0.00    +0.149 HD
ATOM     25  C   LIG    1       -3.898   0.497   0.751  0.00  0.00    +0.121 C 
ATOM     26  C   LIG    1       -4.847   1.583   0.233  0.00  0.00    +0.130 C 
ATOM     27  N   LIG    1       -4.251   2.930   0.310  0.00  0.00    -0.286 NA
ATOM     28  C   LIG    1       -3.005   2.964  -0.035  0.00  0.00    +0.110 C 
ATOM     29  C   LIG    1       -2.133   1.798  -0.376  0.00  0.00    -0.018 C 
ATOM     30  C   LIG    1       -2.582   0.603   0.050  0.00  0.00    +0.003 C 
ATOM     31  C   LIG    1       -6.119   1.517   1.069  0.00  0.00    +0.041 C 
BRANCH  20  33
ATOM     32  C   LIG    1       -7.568   0.153  -1.361  0.00  0.00    +0.004 C 
ATOM     33  C   LIG    1       -7.915  -0.054   0.106  0.00  0.00    +0.009 C 
ENDBRANCH  20  33
ENDBRANCH  19  29
ENDBRANCH   1  19
TORSDOF 5