COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -8.459  -2.415   1.445  1.00  0.00           C  
HETATM    2  C   UNL     1      -9.192  -1.347   1.927  1.00  0.00           C  
HETATM    3  C   UNL     1      -9.043  -0.095   1.360  1.00  0.00           C  
HETATM    4  N   UNL     1      -1.672   2.035  -0.483  1.00  0.00           N  
HETATM    5  C   UNL     1      -8.163   0.089   0.311  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.246   0.006  -1.865  1.00  0.00           C  
HETATM    7  N   UNL     1       1.133   3.346   1.115  1.00  0.00           N  
HETATM    8  C   UNL     1      -2.991   0.589  -1.270  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.855  -0.079  -0.959  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.002   0.920  -0.438  1.00  0.00           C  
HETATM   11  C   UNL     1       0.405   0.733   0.069  1.00  0.00           C  
HETATM   12  N   UNL     1       5.133  -1.510  -0.401  1.00  0.00           N  
HETATM   13  C   UNL     1       1.345   1.685  -0.672  1.00  0.00           C  
HETATM   14  C   UNL     1       0.982   3.132  -0.329  1.00  0.00           C  
HETATM   15  C   UNL     1       2.522   3.136   1.541  1.00  0.00           C  
HETATM   16  N   UNL     1       7.089  -2.862  -0.254  1.00  0.00           N  
HETATM   17  O   UNL     1       5.287   0.625   0.182  1.00  0.00           O  
HETATM   18  C   UNL     1       4.597  -0.286  -0.223  1.00  0.00           C  
HETATM   19  C   UNL     1       6.476  -1.728  -0.119  1.00  0.00           C  
HETATM   20  S   UNL     1       7.562  -0.539   0.457  1.00  0.00           S  
HETATM   21  C   UNL     1       8.864  -1.725   0.482  1.00  0.00           C  
HETATM   22  C   UNL     1       8.370  -2.891   0.061  1.00  0.00           C  
HETATM   23  C   UNL     1       3.140  -0.049  -0.529  1.00  0.00           C  
HETATM   24  C   UNL     1       2.790   1.413  -0.245  1.00  0.00           C  
HETATM   25  C   UNL     1       2.932   1.690   1.254  1.00  0.00           C  
HETATM   26  O   UNL     1      -2.779   1.871  -0.942  1.00  0.00           O  
HETATM   27  N   UNL     1      -5.145  -0.427  -0.787  1.00  0.00           N  
HETATM   28  C   UNL     1      -4.563  -1.546  -0.034  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.470  -0.780  -1.316  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.430  -0.980  -0.171  1.00  0.00           C  
HETATM   31  C   UNL     1      -7.579  -2.232   0.395  1.00  0.00           C  
HETATM   32  H   UNL     1      -8.572  -3.393   1.891  1.00  0.00           H  
HETATM   33  H   UNL     1      -9.880  -1.490   2.747  1.00  0.00           H  
HETATM   34  H   UNL     1      -9.616   0.740   1.737  1.00  0.00           H  
HETATM   35  H   UNL     1      -8.047   1.066  -0.132  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.745   0.761  -2.473  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.989  -0.850  -2.489  1.00  0.00           H  
HETATM   38  H   UNL     1       0.808   4.264   1.380  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.648  -1.133  -1.080  1.00  0.00           H  
HETATM   40  H   UNL     1       0.438   0.947   1.137  1.00  0.00           H  
HETATM   41  H   UNL     1       0.720  -0.296  -0.105  1.00  0.00           H  
HETATM   42  H   UNL     1       4.581  -2.238  -0.725  1.00  0.00           H  
HETATM   43  H   UNL     1       1.248   1.530  -1.747  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.051   3.325  -0.619  1.00  0.00           H  
HETATM   45  H   UNL     1       1.643   3.810  -0.868  1.00  0.00           H  
HETATM   46  H   UNL     1       3.176   3.815   0.994  1.00  0.00           H  
HETATM   47  H   UNL     1       2.608   3.333   2.610  1.00  0.00           H  
HETATM   48  H   UNL     1       9.884  -1.540   0.784  1.00  0.00           H  
HETATM   49  H   UNL     1       8.970  -3.785  -0.016  1.00  0.00           H  
HETATM   50  H   UNL     1       2.949  -0.271  -1.579  1.00  0.00           H  
HETATM   51  H   UNL     1       2.528  -0.698   0.097  1.00  0.00           H  
HETATM   52  H   UNL     1       3.464   2.064  -0.802  1.00  0.00           H  
HETATM   53  H   UNL     1       3.968   1.539   1.556  1.00  0.00           H  
HETATM   54  H   UNL     1       2.287   1.012   1.813  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.615  -1.235   0.405  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.249  -1.847   0.758  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.394  -2.387  -0.706  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.831   0.024  -1.957  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.397  -1.701  -1.894  1.00  0.00           H  
HETATM   60  H   UNL     1      -7.007  -3.067   0.018  1.00  0.00           H  
CONECT    1   31   31    2   32                                       
CONECT    2    1    3    3   33                                       
CONECT    3    2    2    5   34                                       
CONECT    4   26   10   10                                            
CONECT    5   30   30    3   35                                       
CONECT    6   27    8   36   37                                       
CONECT    7   14   15   38                                            
CONECT    8    6    9    9   26                                       
CONECT    9    8    8   10   39                                       
CONECT   10    9    4    4   11                                       
CONECT   11   10   13   40   41                                       
CONECT   12   18   19   42                                            
CONECT   13   11   14   24   43                                       
CONECT   14   13    7   44   45                                       
CONECT   15    7   25   46   47                                       
CONECT   16   19   19   22                                            
CONECT   17   18   18                                                 
CONECT   18   23   17   17   12                                       
CONECT   19   12   20   16   16                                       
CONECT   20   19   21                                                 
CONECT   21   20   22   22   48                                       
CONECT   22   21   21   16   49                                       
CONECT   23   24   18   50   51                                       
CONECT   24   13   23   25   52                                       
CONECT   25   24   15   53   54                                       
CONECT   26    8    4                                                 
CONECT   27   29   28    6                                            
CONECT   28   27   55   56   57                                       
CONECT   29   30   27   58   59                                       
CONECT   30   31   29    5    5                                       
CONECT   31    1    1   30   60                                       
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    9                                                      
CONECT   40   11                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   23                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   25                                                      
CONECT   55   28                                                      
CONECT   56   28                                                      
CONECT   57   28                                                      
CONECT   58   29                                                      
CONECT   59   29                                                      
CONECT   60   31                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
