COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.694  -0.530   0.830  1.00  0.00           C  
HETATM    2  C   UNL     1       0.176  -1.945  -1.083  1.00  0.00           C  
HETATM    3  C   UNL     1       0.936  -3.764  -2.175  1.00  0.00           C  
HETATM    4  C   UNL     1       1.572  -1.829  -1.233  1.00  0.00           C  
HETATM    5  C   UNL     1       3.551   1.361   0.295  1.00  0.00           C  
HETATM    6  C   UNL     1       4.198   2.576   0.111  1.00  0.00           C  
HETATM    7  C   UNL     1       6.314   1.459   0.193  1.00  0.00           C  
HETATM    8  C   UNL     1       8.320   0.650  -1.024  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.469   1.019   1.537  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.103  -0.476   1.512  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.937  -1.093   2.903  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.510  -2.495   2.770  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.989  -0.992  -0.246  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.522  -0.915  -0.429  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.197  -3.214  -1.706  1.00  0.00           C  
HETATM   16  C   UNL     1       1.482   0.201  -0.142  1.00  0.00           C  
HETATM   17  C   UNL     1       5.577   2.622   0.060  1.00  0.00           C  
HETATM   18  C   UNL     1       7.819   1.513   0.138  1.00  0.00           C  
HETATM   19  C   UNL     1       9.850   0.659  -1.038  1.00  0.00           C  
HETATM   20  C   UNL     1       9.942  -1.261   0.434  1.00  0.00           C  
HETATM   21  C   UNL     1       9.927   0.975   1.364  1.00  0.00           C  
HETATM   22  C   UNL     1       8.399   0.975   1.449  1.00  0.00           C  
HETATM   23  C   UNL     1       5.674   0.248   0.382  1.00  0.00           C  
HETATM   24  C   UNL     1       4.295   0.196   0.433  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.915  -1.555  -1.149  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.495  -0.704   0.896  1.00  0.00           C  
HETATM   27  C   UNL     1      -8.651   2.217  -0.047  1.00  0.00           C  
HETATM   28  C   UNL     1      -9.396   3.050  -1.091  1.00  0.00           C  
HETATM   29  N   UNL     1      -6.418   0.702   0.453  1.00  0.00           N  
HETATM   30  N   UNL     1      -4.180  -3.578   2.667  1.00  0.00           N  
HETATM   31  N   UNL     1      -3.995  -0.798   0.609  1.00  0.00           N  
HETATM   32  N   UNL     1       2.001  -2.947  -1.893  1.00  0.00           N  
HETATM   33  N   UNL     1       2.177  -0.746  -0.750  1.00  0.00           N  
HETATM   34  N   UNL     1       2.155   1.311   0.346  1.00  0.00           N  
HETATM   35  N   UNL     1      10.356   0.135   0.238  1.00  0.00           N  
HETATM   36  N   UNL     1       0.168   0.130   0.021  1.00  0.00           N  
HETATM   37  N   UNL     1      -4.108  -1.433  -0.633  1.00  0.00           N  
HETATM   38  O   UNL     1      -7.405   0.605  -1.770  1.00  0.00           O  
HETATM   39  O   UNL     1      -6.199   2.630  -1.016  1.00  0.00           O  
HETATM   40  S   UNL     1      -7.117   1.573  -0.770  1.00  0.00           S  
HETATM   41  H   UNL     1      -2.283  -0.042   1.701  1.00  0.00           H  
HETATM   42  H   UNL     1       0.998  -4.711  -2.690  1.00  0.00           H  
HETATM   43  H   UNL     1       3.623   3.484   0.006  1.00  0.00           H  
HETATM   44  H   UNL     1       7.963  -0.372  -0.898  1.00  0.00           H  
HETATM   45  H   UNL     1       7.945   1.054  -1.965  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.949   1.339   2.462  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.654   1.676   1.232  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.184  -0.535   3.460  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.887  -1.051   3.435  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.191  -3.628  -1.776  1.00  0.00           H  
HETATM   51  H   UNL     1       6.081   3.566  -0.083  1.00  0.00           H  
HETATM   52  H   UNL     1       8.142   2.543  -0.009  1.00  0.00           H  
HETATM   53  H   UNL     1      10.210   0.034  -1.855  1.00  0.00           H  
HETATM   54  H   UNL     1      10.206   1.680  -1.178  1.00  0.00           H  
HETATM   55  H   UNL     1      10.336  -1.874  -0.376  1.00  0.00           H  
HETATM   56  H   UNL     1      10.330  -1.624   1.386  1.00  0.00           H  
HETATM   57  H   UNL     1       8.854  -1.320   0.439  1.00  0.00           H  
HETATM   58  H   UNL     1      10.282   1.994   1.213  1.00  0.00           H  
HETATM   59  H   UNL     1      10.342   0.579   2.290  1.00  0.00           H  
HETATM   60  H   UNL     1       8.081   1.610   2.275  1.00  0.00           H  
HETATM   61  H   UNL     1       8.044  -0.043   1.614  1.00  0.00           H  
HETATM   62  H   UNL     1       6.252  -0.657   0.490  1.00  0.00           H  
HETATM   63  H   UNL     1       3.795  -0.750   0.582  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.678  -2.008  -2.100  1.00  0.00           H  
HETATM   65  H   UNL     1      -6.500  -1.423   0.076  1.00  0.00           H  
HETATM   66  H   UNL     1      -7.276  -0.893   1.632  1.00  0.00           H  
HETATM   67  H   UNL     1      -8.412   2.843   0.814  1.00  0.00           H  
HETATM   68  H   UNL     1      -9.280   1.386   0.271  1.00  0.00           H  
HETATM   69  H   UNL     1      -8.767   3.882  -1.410  1.00  0.00           H  
HETATM   70  H   UNL     1      -9.635   2.425  -1.952  1.00  0.00           H  
HETATM   71  H   UNL     1     -10.318   3.438  -0.657  1.00  0.00           H  
HETATM   72  H   UNL     1       2.923  -3.133  -2.132  1.00  0.00           H  
HETATM   73  H   UNL     1       1.657   2.054   0.722  1.00  0.00           H  
CONECT    1   31   13   13   41                                       
CONECT    2   14   15    4    4                                       
CONECT    3   15   15   32   42                                       
CONECT    4    2    2   33   32                                       
CONECT    5   24   34    6    6                                       
CONECT    6    5    5   17   43                                       
CONECT    7   23   18   17   17                                       
CONECT    8   19   18   44   45                                       
CONECT    9   29   10   46   47                                       
CONECT   10   26    9   31   11                                       
CONECT   11   10   12   48   49                                       
CONECT   12   11   30   30   30                                       
CONECT   13   25    1    1   14                                       
CONECT   14   13   36   36    2                                       
CONECT   15    2    3    3   50                                       
CONECT   16   36   34   33   33                                       
CONECT   17    7    7    6   51                                       
CONECT   18    8    7   22   52                                       
CONECT   19    8   35   53   54                                       
CONECT   20   35   55   56   57                                       
CONECT   21   35   22   58   59                                       
CONECT   22   18   21   60   61                                       
CONECT   23   24   24    7   62                                       
CONECT   24   23   23    5   63                                       
CONECT   25   37   37   13   64                                       
CONECT   26   29   10   65   66                                       
CONECT   27   28   40   67   68                                       
CONECT   28   27   69   70   71                                       
CONECT   29   40   26    9                                            
CONECT   30   12   12   12                                            
CONECT   31   37   10    1                                            
CONECT   32    3    4   72                                            
CONECT   33   16   16    4                                            
CONECT   34    5   16   73                                            
CONECT   35   19   20   21                                            
CONECT   36   14   14   16                                            
CONECT   37   25   25   31                                            
CONECT   38   40   40                                                 
CONECT   39   40   40                                                 
CONECT   40   39   39   38   38                                       
CONECT   40   27   29                                                 
CONECT   41    1                                                      
CONECT   42    3                                                      
CONECT   43    6                                                      
CONECT   44    8                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47    9                                                      
CONECT   48   11                                                      
CONECT   49   11                                                      
CONECT   50   15                                                      
CONECT   51   17                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   21                                                      
CONECT   60   22                                                      
CONECT   61   22                                                      
CONECT   62   23                                                      
CONECT   63   24                                                      
CONECT   64   25                                                      
CONECT   65   26                                                      
CONECT   66   26                                                      
CONECT   67   27                                                      
CONECT   68   27                                                      
CONECT   69   28                                                      
CONECT   70   28                                                      
CONECT   71   28                                                      
CONECT   72   32                                                      
CONECT   73   34                                                      
MASTER        0    0    0    0    0    0    0    0   73    0   73    0
END
