COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       7.852  -0.367   0.371  1.00  0.00           N  
HETATM    2  N   UNL     1      -1.079   3.766  -0.214  1.00  0.00           N  
HETATM    3  C   UNL     1       5.396  -0.126   0.201  1.00  0.00           C  
HETATM    4  C   UNL     1       6.647  -0.963   0.277  1.00  0.00           C  
HETATM    5  C   UNL     1       2.059   2.232  -0.001  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.895  -0.848  -1.510  1.00  0.00           C  
HETATM    7  C   UNL     1      -7.364  -1.027   0.211  1.00  0.00           C  
HETATM    8  C   UNL     1      -8.409  -0.860   1.316  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.998   0.460   0.771  1.00  0.00           C  
HETATM   10  C   UNL     1       2.669  -0.004   0.009  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.778  -0.549  -0.479  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.938  -0.559   0.511  1.00  0.00           C  
HETATM   13  C   UNL     1      -8.447   0.046   0.083  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.325   0.105   0.660  1.00  0.00           C  
HETATM   15  C   UNL     1       0.693   1.910  -0.107  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.295   2.945  -0.167  1.00  0.00           C  
HETATM   17  C   UNL     1       1.328  -0.422  -0.091  1.00  0.00           C  
HETATM   18  C   UNL     1       0.313   0.553  -0.154  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.109   0.165  -0.265  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.567  -0.497  -1.406  1.00  0.00           C  
HETATM   21  C   UNL     1       1.002  -1.815  -0.135  1.00  0.00           C  
HETATM   22  N   UNL     1       0.743  -2.921  -0.170  1.00  0.00           N  
HETATM   23  N   UNL     1       2.979   1.283   0.050  1.00  0.00           N  
HETATM   24  N   UNL     1       2.444   3.557   0.046  1.00  0.00           N  
HETATM   25  O   UNL     1       6.569  -2.173   0.254  1.00  0.00           O  
HETATM   26  O   UNL     1      -5.086  -0.897  -0.586  1.00  0.00           O  
HETATM   27  S   UNL     1       3.951  -1.210   0.083  1.00  0.00           S  
HETATM   28  H   UNL     1       7.914   0.601   0.390  1.00  0.00           H  
HETATM   29  H   UNL     1       8.657  -0.905   0.424  1.00  0.00           H  
HETATM   30  H   UNL     1       5.315   0.490   1.097  1.00  0.00           H  
HETATM   31  H   UNL     1       5.441   0.516  -0.679  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.250  -1.361  -2.392  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.446  -1.904  -0.431  1.00  0.00           H  
HETATM   34  H   UNL     1      -9.178  -1.628   1.401  1.00  0.00           H  
HETATM   35  H   UNL     1      -8.081  -0.418   2.257  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.648   0.972   1.655  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.933   0.521   0.655  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.578  -1.048   1.415  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.145   1.085   0.212  1.00  0.00           H  
HETATM   40  H   UNL     1      -9.242  -0.126  -0.643  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.014   0.336   1.459  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.881  -0.734  -2.205  1.00  0.00           H  
HETATM   43  H   UNL     1       1.775   4.258   0.005  1.00  0.00           H  
HETATM   44  H   UNL     1       3.384   3.786   0.119  1.00  0.00           H  
CONECT    1    4   28   29                                            
CONECT    2   16   16   16                                            
CONECT    3   27    4   30   31                                       
CONECT    4    1    3   25   25                                       
CONECT    5   15   15   23   24                                       
CONECT    6   11   20   20   32                                       
CONECT    7   13    8   12   33                                       
CONECT    8   13    7   34   35                                       
CONECT    9   14   19   19   36                                       
CONECT   10   17   27   23   23                                       
CONECT   11   26   14   14    6                                       
CONECT   12    7   26   37   38                                       
CONECT   13    8    7   39   40                                       
CONECT   14   11   11    9   41                                       
CONECT   15   18   16    5    5                                       
CONECT   16   15    2    2    2                                       
CONECT   17   21   18   18   10                                       
CONECT   18   19   17   17   15                                       
CONECT   19    9    9   20   18                                       
CONECT   20    6    6   19   42                                       
CONECT   21   22   22   22   17                                       
CONECT   22   21   21   21                                            
CONECT   23   10   10    5                                            
CONECT   24    5   43   44                                            
CONECT   25    4    4                                                 
CONECT   26   12   11                                                 
CONECT   27   10    3                                                 
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   20                                                      
CONECT   43   24                                                      
CONECT   44   24                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
