COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.956   0.960  -0.899  1.00  0.00           C  
HETATM    2  C   UNL     1       1.641   0.699  -1.236  1.00  0.00           C  
HETATM    3  C   UNL     1       1.047  -0.483  -0.837  1.00  0.00           C  
HETATM    4  C   UNL     1       1.768  -1.405  -0.101  1.00  0.00           C  
HETATM    5  C   UNL     1       3.083  -1.145   0.236  1.00  0.00           C  
HETATM    6  C   UNL     1       3.677   0.038  -0.163  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.387  -0.767  -1.203  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.309  -0.231  -0.107  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.283  -1.660  -0.073  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.467   0.470  -1.243  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.497  -2.664   0.729  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.160   1.428  -0.308  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.651   2.586   0.150  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.632   3.159   0.992  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.681   2.318   0.997  1.00  0.00           C  
HETATM   16  N   UNL     1      -2.703  -0.507  -0.463  1.00  0.00           N  
HETATM   17  N   UNL     1      -3.347  -3.826   1.026  1.00  0.00           N  
HETATM   18  N   UNL     1       5.348   1.156   1.716  1.00  0.00           N  
HETATM   19  O   UNL     1      -4.437  -1.888  -0.368  1.00  0.00           O  
HETATM   20  O   UNL     1      -5.392   1.274   0.203  1.00  0.00           O  
HETATM   21  O   UNL     1       5.966  -0.895   0.491  1.00  0.00           O  
HETATM   22  O   UNL     1       5.836   1.299  -0.699  1.00  0.00           O  
HETATM   23  S   UNL     1       5.356   0.367   0.261  1.00  0.00           S  
HETATM   24  H   UNL     1       3.422   1.882  -1.214  1.00  0.00           H  
HETATM   25  H   UNL     1       1.078   1.419  -1.811  1.00  0.00           H  
HETATM   26  H   UNL     1       1.303  -2.329   0.212  1.00  0.00           H  
HETATM   27  H   UNL     1       3.646  -1.865   0.811  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.624  -0.279  -2.148  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.530  -1.843  -1.304  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.072  -0.719   0.839  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.166   0.845  -0.006  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.211  -0.049  -1.848  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.791   1.023  -1.895  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.628  -2.987   0.156  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.168  -2.207   1.662  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.679   2.997  -0.079  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.553   4.093   1.528  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.602   2.459   1.544  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.717  -4.229   0.179  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.842  -4.514   1.564  1.00  0.00           H  
HETATM   41  H   UNL     1       6.094   1.054   2.328  1.00  0.00           H  
HETATM   42  H   UNL     1       4.598   1.721   1.958  1.00  0.00           H  
CONECT    1    2    2    6   24                                       
CONECT    2    3    1    1   25                                       
CONECT    3    7    4    4    2                                       
CONECT    4    3    3    5   26                                       
CONECT    5    4    6    6   27                                       
CONECT    6    5    5    1   23                                       
CONECT    7    8    3   28   29                                       
CONECT    8   16    7   30   31                                       
CONECT    9   11   19   19   16                                       
CONECT   10   16   12   32   33                                       
CONECT   11   17    9   34   35                                       
CONECT   12   10   20   13   13                                       
CONECT   13   12   12   14   36                                       
CONECT   14   15   15   13   37                                       
CONECT   15   20   14   14   38                                       
CONECT   16    9   10    8                                            
CONECT   17   11   39   40                                            
CONECT   18   23   41   42                                            
CONECT   19    9    9                                                 
CONECT   20   12   15                                                 
CONECT   21   23   23                                                 
CONECT   22   23   23                                                 
CONECT   23    6   18   21   21                                       
CONECT   23   22   22                                                 
CONECT   24    1                                                      
CONECT   25    2                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    7                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31    8                                                      
CONECT   32   10                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   11                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   17                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   18                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
