COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.093   1.861   0.282  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.593  -0.350  -1.909  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.370  -1.674  -1.876  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.732  -3.259   0.979  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.116  -3.597  -0.930  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.442  -2.239  -0.881  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.100  -1.925   0.973  1.00  0.00           C  
HETATM    8  C   UNL     1       5.745  -0.418   1.133  1.00  0.00           C  
HETATM    9  N   UNL     1      -1.929  -1.456   0.063  1.00  0.00           N  
HETATM   10  C   UNL     1      -1.356   0.393  -1.119  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.560   1.258  -0.376  1.00  0.00           C  
HETATM   12  C   UNL     1       3.665   0.778  -0.361  1.00  0.00           C  
HETATM   13  C   UNL     1       1.497   0.002  -1.016  1.00  0.00           C  
HETATM   14  O   UNL     1       5.920   1.893  -0.187  1.00  0.00           O  
HETATM   15  S   UNL     1       5.416   0.575  -0.348  1.00  0.00           S  
HETATM   16  O   UNL     1       5.690  -0.176  -1.523  1.00  0.00           O  
HETATM   17  C   UNL     1       7.250  -0.666   1.257  1.00  0.00           C  
HETATM   18  O   UNL     1       7.510  -1.448   2.425  1.00  0.00           O  
HETATM   19  C   UNL     1       1.722   2.021   0.280  1.00  0.00           C  
HETATM   20  C   UNL     1       0.915   1.090  -0.371  1.00  0.00           C  
HETATM   21  C   UNL     1       2.869  -0.146  -1.013  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.149   2.283   0.363  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.521   2.443   0.360  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.319   1.589  -0.374  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.815   1.770  -0.372  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.438   0.855   0.684  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.957   1.039   0.687  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.580   0.124   1.743  1.00  0.00           C  
HETATM   29  C   UNL     1      -9.099   0.308   1.745  1.00  0.00           C  
HETATM   30  C   UNL     1      -2.741   0.561  -1.124  1.00  0.00           C  
HETATM   31  C   UNL     1      -1.243  -4.112   0.011  1.00  0.00           C  
HETATM   32  H   UNL     1       3.719   2.579   0.789  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.398   0.047  -2.511  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.870  -2.324  -2.579  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.048  -3.631   1.728  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.533  -4.233  -1.697  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.704  -1.260   1.725  1.00  0.00           H  
HETATM   38  H   UNL     1       5.391   0.116   2.015  1.00  0.00           H  
HETATM   39  H   UNL     1       5.226  -1.373   1.054  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.904  -0.402  -1.693  1.00  0.00           H  
HETATM   41  H   UNL     1       0.876  -0.721  -1.526  1.00  0.00           H  
HETATM   42  H   UNL     1       7.604  -1.200   0.376  1.00  0.00           H  
HETATM   43  H   UNL     1       7.770   0.289   1.337  1.00  0.00           H  
HETATM   44  H   UNL     1       8.446  -1.644   2.567  1.00  0.00           H  
HETATM   45  H   UNL     1       1.276   2.867   0.782  1.00  0.00           H  
HETATM   46  H   UNL     1       3.322  -0.990  -1.513  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.530   2.954   0.941  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.971   3.239   0.935  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.056   2.808  -0.141  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.214   1.515  -1.354  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.198  -0.182   0.454  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.040   1.111   1.666  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.198   2.077   0.917  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.355   0.784  -0.296  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.340  -0.913   1.512  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.182   0.380   2.725  1.00  0.00           H  
HETATM   57  H   UNL     1      -9.543  -0.343   2.498  1.00  0.00           H  
HETATM   58  H   UNL     1      -9.339   1.346   1.976  1.00  0.00           H  
HETATM   59  H   UNL     1      -9.497   0.053   0.763  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.966  -5.156  -0.006  1.00  0.00           H  
CONECT    1   19   19   12   32                                       
CONECT    2   30    3    3   33                                       
CONECT    3    2    2    6   34                                       
CONECT    4    7   31   31   35                                       
CONECT    5    6    6   31   36                                       
CONECT    6    9    3    5    5                                       
CONECT    7    9    9    4   37                                       
CONECT    8   17   15   38   39                                       
CONECT    9    7    7    6                                            
CONECT   10   11   11   30   40                                       
CONECT   11   22   20   10   10                                       
CONECT   12    1   15   21   21                                       
CONECT   13   20   20   21   41                                       
CONECT   14   15   15                                                 
CONECT   15   12    8   14   14                                       
CONECT   15   16   16                                                 
CONECT   16   15   15                                                 
CONECT   17   18    8   42   43                                       
CONECT   18   17   44                                                 
CONECT   19    1    1   20   45                                       
CONECT   20   19   11   13   13                                       
CONECT   21   12   12   13   46                                       
CONECT   22   23   23   11   47                                       
CONECT   23   22   22   24   48                                       
CONECT   24   23   25   30   30                                       
CONECT   25   26   24   49   50                                       
CONECT   26   27   25   51   52                                       
CONECT   27   28   26   53   54                                       
CONECT   28   29   27   55   56                                       
CONECT   29   28   57   58   59                                       
CONECT   30   24   24   10    2                                       
CONECT   31    4    4    5   60                                       
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39    8                                                      
CONECT   40   10                                                      
CONECT   41   13                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   26                                                      
CONECT   53   27                                                      
CONECT   54   27                                                      
CONECT   55   28                                                      
CONECT   56   28                                                      
CONECT   57   29                                                      
CONECT   58   29                                                      
CONECT   59   29                                                      
CONECT   60   31                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
