COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.038   4.593  -0.465  1.00  0.00           C  
HETATM    2  C   UNL     1       0.417   3.302   0.026  1.00  0.00           C  
HETATM    3  C   UNL     1       1.128   2.517   0.792  1.00  0.00           C  
HETATM    4  C   UNL     1       0.596   1.218   1.330  1.00  0.00           C  
HETATM    5  C   UNL     1       1.053   0.060   0.441  1.00  0.00           C  
HETATM    6  C   UNL     1       2.557  -0.053   0.490  1.00  0.00           C  
HETATM    7  C   UNL     1       3.243  -0.422   1.780  1.00  0.00           C  
HETATM    8  C   UNL     1       3.275   0.171  -0.603  1.00  0.00           C  
HETATM    9  C   UNL     1       4.730  -0.086  -0.596  1.00  0.00           C  
HETATM   10  C   UNL     1       5.534   0.215  -1.638  1.00  0.00           C  
HETATM   11  S   UNL     1       7.177  -0.253  -1.206  1.00  0.00           S  
HETATM   12  C   UNL     1       6.633  -0.803   0.319  1.00  0.00           C  
HETATM   13  C   UNL     1       7.518  -1.405   1.379  1.00  0.00           C  
HETATM   14  N   UNL     1       5.363  -0.627   0.436  1.00  0.00           N  
HETATM   15  C   UNL     1      -0.995   2.961  -0.384  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.972   3.872   0.361  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.414   3.580   0.000  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.939   2.260   0.557  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.381   1.985   1.951  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.615   1.113  -0.387  1.00  0.00           C  
HETATM   21  O   UNL     1      -3.824   1.525  -1.740  1.00  0.00           O  
HETATM   22  C   UNL     1      -4.496  -0.108  -0.103  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.755  -0.025  -0.976  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.710  -1.337  -0.508  1.00  0.00           C  
HETATM   25  O   UNL     1      -3.271  -1.355  -1.635  1.00  0.00           O  
HETATM   26  C   UNL     1      -3.493  -2.485   0.437  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.203  -1.961   1.846  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.789  -3.318   0.503  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.376  -3.410  -0.030  1.00  0.00           C  
HETATM   30  O   UNL     1      -2.288  -3.443  -1.456  1.00  0.00           O  
HETATM   31  C   UNL     1      -1.024  -3.098   0.577  1.00  0.00           C  
HETATM   32  C   UNL     1      -0.513  -1.735   0.195  1.00  0.00           C  
HETATM   33  O   UNL     1      -0.977  -1.140  -0.749  1.00  0.00           O  
HETATM   34  O   UNL     1       0.472  -1.177   0.919  1.00  0.00           O  
HETATM   35  H   UNL     1       2.053   4.678  -0.079  1.00  0.00           H  
HETATM   36  H   UNL     1       1.062   4.593  -1.555  1.00  0.00           H  
HETATM   37  H   UNL     1       0.444   5.438  -0.115  1.00  0.00           H  
HETATM   38  H   UNL     1       2.133   2.825   1.050  1.00  0.00           H  
HETATM   39  H   UNL     1       0.995   1.069   2.339  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.485   1.240   1.382  1.00  0.00           H  
HETATM   41  H   UNL     1       0.741   0.244  -0.584  1.00  0.00           H  
HETATM   42  H   UNL     1       3.432  -1.495   1.797  1.00  0.00           H  
HETATM   43  H   UNL     1       4.189   0.115   1.855  1.00  0.00           H  
HETATM   44  H   UNL     1       2.605  -0.152   2.621  1.00  0.00           H  
HETATM   45  H   UNL     1       2.795   0.540  -1.497  1.00  0.00           H  
HETATM   46  H   UNL     1       5.226   0.663  -2.571  1.00  0.00           H  
HETATM   47  H   UNL     1       8.547  -1.433   1.021  1.00  0.00           H  
HETATM   48  H   UNL     1       7.465  -0.799   2.284  1.00  0.00           H  
HETATM   49  H   UNL     1       7.183  -2.418   1.600  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.105   3.136  -1.461  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.197   1.919  -0.167  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.785   3.841   1.426  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.759   4.910   0.032  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.048   4.385   0.402  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.532   3.590  -1.087  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.036   2.353   0.640  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.678   2.788   2.626  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.775   1.038   2.319  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.294   1.933   1.903  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.571   0.817  -0.259  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.634   0.838  -2.394  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.780  -0.141   0.933  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.468  -0.013  -2.028  1.00  0.00           H  
HETATM   64  H   UNL     1      -6.389  -0.890  -0.782  1.00  0.00           H  
HETATM   65  H   UNL     1      -6.301   0.888  -0.739  1.00  0.00           H  
HETATM   66  H   UNL     1      -4.049  -1.368   2.194  1.00  0.00           H  
HETATM   67  H   UNL     1      -3.047  -2.802   2.521  1.00  0.00           H  
HETATM   68  H   UNL     1      -2.308  -1.340   1.826  1.00  0.00           H  
HETATM   69  H   UNL     1      -5.030  -3.695  -0.490  1.00  0.00           H  
HETATM   70  H   UNL     1      -4.648  -4.156   1.186  1.00  0.00           H  
HETATM   71  H   UNL     1      -5.606  -2.691   0.862  1.00  0.00           H  
HETATM   72  H   UNL     1      -2.653  -4.437   0.292  1.00  0.00           H  
HETATM   73  H   UNL     1      -1.589  -4.021  -1.793  1.00  0.00           H  
HETATM   74  H   UNL     1      -1.015  -3.225   1.653  1.00  0.00           H  
HETATM   75  H   UNL     1      -0.294  -3.836   0.175  1.00  0.00           H  
CONECT    1    2   35   36   37                                       
CONECT    2    1    3    3   15                                       
CONECT    3    2    2    4   38                                       
CONECT    4    3    5   39   40                                       
CONECT    5    4    6   34   41                                       
CONECT    6    5    7    8    8                                       
CONECT    7    6   42   43   44                                       
CONECT    8    6    6    9   45                                       
CONECT    9    8   10   10   14                                       
CONECT   10    9    9   11   46                                       
CONECT   11   10   12                                                 
CONECT   12   11   13   14   14                                       
CONECT   13   12   47   48   49                                       
CONECT   14    9   12   12                                            
CONECT   15    2   16   50   51                                       
CONECT   16   15   17   52   53                                       
CONECT   17   16   18   54   55                                       
CONECT   18   17   19   20   56                                       
CONECT   19   18   57   58   59                                       
CONECT   20   18   21   22   60                                       
CONECT   21   20   61                                                 
CONECT   22   20   23   24   62                                       
CONECT   23   22   63   64   65                                       
CONECT   24   22   25   25   26                                       
CONECT   25   24   24                                                 
CONECT   26   24   27   28   29                                       
CONECT   27   26   66   67   68                                       
CONECT   28   26   69   70   71                                       
CONECT   29   26   30   31   72                                       
CONECT   30   29   73                                                 
CONECT   31   29   32   74   75                                       
CONECT   32   31   33   33   34                                       
CONECT   33   32   32                                                 
CONECT   34    5   32                                                 
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    7                                                      
CONECT   43    7                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46   10                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   13                                                      
CONECT   50   15                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   16                                                      
CONECT   54   17                                                      
CONECT   55   17                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   19                                                      
CONECT   59   19                                                      
CONECT   60   20                                                      
CONECT   61   21                                                      
CONECT   62   22                                                      
CONECT   63   23                                                      
CONECT   64   23                                                      
CONECT   65   23                                                      
CONECT   66   27                                                      
CONECT   67   27                                                      
CONECT   68   27                                                      
CONECT   69   28                                                      
CONECT   70   28                                                      
CONECT   71   28                                                      
CONECT   72   29                                                      
CONECT   73   30                                                      
CONECT   74   31                                                      
CONECT   75   31                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
