COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.482   0.683  -1.548  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.704   0.631  -0.881  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.040  -0.458  -0.108  1.00  0.00           C  
HETATM    4  C   UNL     1       1.004  -2.554  -0.540  1.00  0.00           C  
HETATM    5  C   UNL     1       0.671  -3.627   0.229  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.549  -3.676   0.901  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.449  -2.661   0.792  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.389  -0.411  -0.401  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.249   0.803   0.006  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.890   1.000   1.503  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.388   0.623   1.516  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.716   0.495  -0.154  1.00  0.00           C  
HETATM   13  O   UNL     1      -7.636   1.388   0.243  1.00  0.00           O  
HETATM   14  C   UNL     1       3.189   0.747  -0.105  1.00  0.00           C  
HETATM   15  C   UNL     1       4.193  -0.139   0.239  1.00  0.00           C  
HETATM   16  C   UNL     1       2.932   1.351   2.198  1.00  0.00           C  
HETATM   17  C   UNL     1       5.660  -1.246   1.938  1.00  0.00           C  
HETATM   18  C   UNL     1       2.241   2.158   3.266  1.00  0.00           C  
HETATM   19  C   UNL     1       1.461   2.453   0.500  1.00  0.00           C  
HETATM   20  C   UNL     1       0.420  -0.353  -1.450  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.138  -1.536   0.013  1.00  0.00           C  
HETATM   22  C   UNL     1       0.107  -1.480  -0.661  1.00  0.00           C  
HETATM   23  N   UNL     1      -3.270  -0.494   0.555  1.00  0.00           N  
HETATM   24  O   UNL     1      -7.063  -0.555  -0.639  1.00  0.00           O  
HETATM   25  N   UNL     1       1.640  -0.288  -2.130  1.00  0.00           N  
HETATM   26  S   UNL     1       2.713   0.927  -1.792  1.00  0.00           S  
HETATM   27  O   UNL     1       1.982   2.142  -1.875  1.00  0.00           O  
HETATM   28  O   UNL     1       3.874   0.663  -2.567  1.00  0.00           O  
HETATM   29  C   UNL     1       4.566  -0.280   1.563  1.00  0.00           C  
HETATM   30  C   UNL     1       3.936   0.465   2.542  1.00  0.00           C  
HETATM   31  C   UNL     1       2.555   1.487   0.875  1.00  0.00           C  
HETATM   32  C   UNL     1       4.880  -0.951  -0.828  1.00  0.00           C  
HETATM   33  H   UNL     1      -0.241   1.545  -2.152  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.396   1.455  -0.972  1.00  0.00           H  
HETATM   35  H   UNL     1       1.953  -2.529  -1.054  1.00  0.00           H  
HETATM   36  H   UNL     1       1.362  -4.451   0.321  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.789  -4.539   1.505  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.391  -2.712   1.318  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.986  -1.321  -0.353  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.004  -0.273  -1.411  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.974   1.683  -0.575  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.036   2.036   1.806  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.468   0.325   2.135  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.782   1.469   1.190  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.086   0.301   2.512  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.564   1.146   0.120  1.00  0.00           H  
HETATM   47  H   UNL     1       6.622  -0.734   1.911  1.00  0.00           H  
HETATM   48  H   UNL     1       5.480  -1.627   2.943  1.00  0.00           H  
HETATM   49  H   UNL     1       5.671  -2.076   1.231  1.00  0.00           H  
HETATM   50  H   UNL     1       1.383   1.602   3.644  1.00  0.00           H  
HETATM   51  H   UNL     1       2.937   2.352   4.083  1.00  0.00           H  
HETATM   52  H   UNL     1       1.903   3.105   2.845  1.00  0.00           H  
HETATM   53  H   UNL     1       1.903   3.394   0.172  1.00  0.00           H  
HETATM   54  H   UNL     1       0.865   2.031  -0.309  1.00  0.00           H  
HETATM   55  H   UNL     1       0.822   2.634   1.365  1.00  0.00           H  
HETATM   56  H   UNL     1       1.857  -0.955  -2.800  1.00  0.00           H  
HETATM   57  H   UNL     1       4.228   0.355   3.576  1.00  0.00           H  
HETATM   58  H   UNL     1       5.744  -0.401  -1.203  1.00  0.00           H  
HETATM   59  H   UNL     1       5.209  -1.901  -0.407  1.00  0.00           H  
HETATM   60  H   UNL     1       4.185  -1.138  -1.647  1.00  0.00           H  
CONECT    1    2   20   20   33                                       
CONECT    2    3    3    1   34                                       
CONECT    3   23    2    2   21                                       
CONECT    4   22   22    5   35                                       
CONECT    5    6    6    4   36                                       
CONECT    6    7    5    5   37                                       
CONECT    7   21   21    6   38                                       
CONECT    8    9   23   39   40                                       
CONECT    9   12   10    8   41                                       
CONECT   10    9   11   42   43                                       
CONECT   11   10   23   44   45                                       
CONECT   12   24   24   13    9                                       
CONECT   13   12   46                                                 
CONECT   14   15   15   31   26                                       
CONECT   15   29   32   14   14                                       
CONECT   16   30   18   31   31                                       
CONECT   17   29   47   48   49                                       
CONECT   18   16   50   51   52                                       
CONECT   19   31   53   54   55                                       
CONECT   20    1    1   22   25                                       
CONECT   21    3    7    7   22                                       
CONECT   22   21   20    4    4                                       
CONECT   23    8   11    3                                            
CONECT   24   12   12                                                 
CONECT   25   20   26   56                                            
CONECT   26   14   25   27   27                                       
CONECT   26   28   28                                                 
CONECT   27   26   26                                                 
CONECT   28   26   26                                                 
CONECT   29   17   30   30   15                                       
CONECT   30   29   29   16   57                                       
CONECT   31   16   16   14   19                                       
CONECT   32   15   58   59   60                                       
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   11                                                      
CONECT   46   13                                                      
CONECT   47   17                                                      
CONECT   48   17                                                      
CONECT   49   17                                                      
CONECT   50   18                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   25                                                      
CONECT   57   30                                                      
CONECT   58   32                                                      
CONECT   59   32                                                      
CONECT   60   32                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
