COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.933   3.813  -0.365  1.00  0.00           C  
HETATM    2  C   UNL     1       3.355   2.430  -0.208  1.00  0.00           C  
HETATM    3  N   UNL     1       4.180   1.411  -0.095  1.00  0.00           N  
HETATM    4  C   UNL     1       3.713   0.171   0.046  1.00  0.00           C  
HETATM    5  C   UNL     1       2.322  -0.024   0.071  1.00  0.00           C  
HETATM    6  C   UNL     1       2.114  -1.469   0.234  1.00  0.00           C  
HETATM    7  C   UNL     1       3.348  -2.030   0.294  1.00  0.00           C  
HETATM    8  N   UNL     1       4.301  -1.058   0.183  1.00  0.00           N  
HETATM    9  C   UNL     1       0.814  -2.174   0.317  1.00  0.00           C  
HETATM   10  C   UNL     1       0.552  -3.289  -0.480  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.680  -3.919  -0.369  1.00  0.00           C  
HETATM   12  N   UNL     1      -0.957  -5.031  -1.156  1.00  0.00           N  
HETATM   13  N   UNL     1      -1.595  -3.473   0.479  1.00  0.00           N  
HETATM   14  C   UNL     1      -1.380  -2.421   1.248  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.183  -1.742   1.202  1.00  0.00           C  
HETATM   16  C   UNL     1       1.483   1.092  -0.052  1.00  0.00           C  
HETATM   17  N   UNL     1       0.107   0.949  -0.032  1.00  0.00           N  
HETATM   18  C   UNL     1      -0.754   2.128  -0.162  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.199   1.703  -0.111  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.859   1.642   1.104  1.00  0.00           C  
HETATM   21  F   UNL     1      -2.209   1.963   2.244  1.00  0.00           F  
HETATM   22  C   UNL     1      -4.187   1.252   1.150  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.853   0.924  -0.016  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.194   0.984  -1.229  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.868   1.380  -1.278  1.00  0.00           C  
HETATM   26  F   UNL     1      -2.224   1.439  -2.465  1.00  0.00           F  
HETATM   27  N   UNL     1       2.042   2.291  -0.184  1.00  0.00           N  
HETATM   28  H   UNL     1       4.070   4.032  -1.424  1.00  0.00           H  
HETATM   29  H   UNL     1       3.251   4.543   0.072  1.00  0.00           H  
HETATM   30  H   UNL     1       4.895   3.865   0.145  1.00  0.00           H  
HETATM   31  H   UNL     1       3.546  -3.085   0.413  1.00  0.00           H  
HETATM   32  H   UNL     1       5.258  -1.216   0.198  1.00  0.00           H  
HETATM   33  H   UNL     1       1.295  -3.655  -1.172  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.291  -5.363  -1.779  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.816  -5.476  -1.083  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.152  -2.092   1.928  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.017  -0.883   1.835  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.289   0.069   0.068  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.549   2.819   0.655  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.554   2.620  -1.114  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.703   1.204   2.098  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.888   0.619   0.022  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.716   0.732  -2.140  1.00  0.00           H  
CONECT    1    2   28   29   30                                       
CONECT    2   27    1    3    3                                       
CONECT    3    2    2    4                                            
CONECT    4    5    5    3    8                                       
CONECT    5   16    4    4    6                                       
CONECT    6    5    9    7    7                                       
CONECT    7    6    6    8   31                                       
CONECT    8    4    7   32                                            
CONECT    9   15    6   10   10                                       
CONECT   10    9    9   11   33                                       
CONECT   11   13   13   10   12                                       
CONECT   12   11   34   35                                            
CONECT   13   14   11   11                                            
CONECT   14   15   15   13   36                                       
CONECT   15   14   14    9   37                                       
CONECT   16   17   27   27    5                                       
CONECT   17   18   16   38                                            
CONECT   18   19   17   39   40                                       
CONECT   19   25   20   20   18                                       
CONECT   20   22   19   19   21                                       
CONECT   21   20                                                      
CONECT   22   23   23   20   41                                       
CONECT   23   24   22   22   42                                       
CONECT   24   25   25   23   43                                       
CONECT   25   24   24   26   19                                       
CONECT   26   25                                                      
CONECT   27   16   16    2                                            
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33   10                                                      
CONECT   34   12                                                      
CONECT   35   12                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   18                                                      
CONECT   41   22                                                      
CONECT   42   23                                                      
CONECT   43   24                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
