COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.230  -0.773  -0.706  1.00  0.00           C  
HETATM    2  N   UNL     1       1.102  -0.164   1.257  1.00  0.00           N  
HETATM    3  O   UNL     1      -0.347  -2.114  -0.225  1.00  0.00           O  
HETATM    4  C   UNL     1      -3.284   1.695   0.155  1.00  0.00           C  
HETATM    5  N   UNL     1      -2.665  -0.521  -0.659  1.00  0.00           N  
HETATM    6  O   UNL     1      -2.654   1.620   1.183  1.00  0.00           O  
HETATM    7  C   UNL     1      -3.004  -1.744   0.101  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.402   0.060  -0.185  1.00  0.00           C  
HETATM    9  C   UNL     1       5.937   0.882   0.350  1.00  0.00           C  
HETATM   10  C   UNL     1       4.166  -0.651   0.849  1.00  0.00           C  
HETATM   11  C   UNL     1       4.136   0.587  -1.200  1.00  0.00           C  
HETATM   12  C   UNL     1       1.086  -0.167  -0.212  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.775   0.440  -0.520  1.00  0.00           C  
HETATM   14  C   UNL     1       2.258  -1.001  -0.733  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.858  -0.234   0.347  1.00  0.00           C  
HETATM   16  C   UNL     1       5.356  -0.041   1.200  1.00  0.00           C  
HETATM   17  C   UNL     1       5.326   1.196  -0.850  1.00  0.00           C  
HETATM   18  C   UNL     1       3.556  -0.336  -0.351  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.551  -1.746   0.178  1.00  0.00           C  
HETATM   20  H   UNL     1      -0.242  -0.776  -1.796  1.00  0.00           H  
HETATM   21  H   UNL     1       1.020  -1.101   1.622  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.343  -2.187   0.739  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.649  -2.629  -0.427  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.574  -1.700   1.102  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.390   0.063   0.905  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.313   1.083  -0.552  1.00  0.00           H  
HETATM   27  H   UNL     1       6.864   1.361   0.626  1.00  0.00           H  
HETATM   28  H   UNL     1       3.713  -1.373   1.512  1.00  0.00           H  
HETATM   29  H   UNL     1       3.659   0.833  -2.138  1.00  0.00           H  
HETATM   30  H   UNL     1       1.175   0.855  -0.579  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.180   0.682  -1.503  1.00  0.00           H  
HETATM   32  H   UNL     1       2.218  -1.998  -0.296  1.00  0.00           H  
HETATM   33  H   UNL     1       2.195  -1.077  -1.819  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.758   0.065   1.391  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.854   0.003  -0.026  1.00  0.00           H  
HETATM   36  H   UNL     1       5.833  -0.288   2.137  1.00  0.00           H  
HETATM   37  H   UNL     1       5.780   1.918  -1.513  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.987  -2.132  -0.743  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.898  -2.314   1.042  1.00  0.00           H  
HETATM   40  H   UNL     1       1.932   0.290   1.608  1.00  0.00           H  
HETATM   41  O   UNL     1      -3.548   2.895  -0.385  1.00  0.00           O  
HETATM   42  H   UNL     1      -3.213   3.671   0.084  1.00  0.00           H  
CONECT    1    3   20    8   12                                       
CONECT    2   12   21   40                                            
CONECT    3    1   22                                                 
CONECT    4   13    6    6   41                                       
CONECT    5   13    7    8                                            
CONECT    6    4    4                                                 
CONECT    7    5   19   23   24                                       
CONECT    8    1    5   25   26                                       
CONECT    9   16   16   17   27                                       
CONECT   10   18   18   28   16                                       
CONECT   11   18   29   17   17                                       
CONECT   12    2    1   14   30                                       
CONECT   13    4    5   15   31                                       
CONECT   14   12   32   33   18                                       
CONECT   15   13   34   35   19                                       
CONECT   16    9    9   10   36                                       
CONECT   17    9   11   11   37                                       
CONECT   18   10   10   11   14                                       
CONECT   19    7   15   38   39                                       
CONECT   20    1                                                      
CONECT   21    2                                                      
CONECT   22    3                                                      
CONECT   23    7                                                      
CONECT   24    7                                                      
CONECT   25    8                                                      
CONECT   26    8                                                      
CONECT   27    9                                                      
CONECT   28   10                                                      
CONECT   29   11                                                      
CONECT   30   12                                                      
CONECT   31   13                                                      
CONECT   32   14                                                      
CONECT   33   14                                                      
CONECT   34   15                                                      
CONECT   35   15                                                      
CONECT   36   16                                                      
CONECT   37   17                                                      
CONECT   38   19                                                      
CONECT   39   19                                                      
CONECT   40    2                                                      
CONECT   41    4   42                                                 
CONECT   42   41                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
