COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.047   0.162   0.644  1.00  0.00           C  
HETATM    2  C   UNL     1       0.064  -1.166   0.979  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.081  -1.968   0.932  1.00  0.00           C  
HETATM    4  N   UNL     1      -2.235  -1.422   0.562  1.00  0.00           N  
HETATM    5  N   UNL     1      -1.233   0.640   0.282  1.00  0.00           N  
HETATM    6  C   UNL     1      -2.300  -0.140   0.244  1.00  0.00           C  
HETATM    7  C   UNL     1       1.376  -1.778   1.388  1.00  0.00           C  
HETATM    8  C   UNL     1       2.368  -0.676   1.764  1.00  0.00           C  
HETATM    9  C   UNL     1       1.136   1.092   0.681  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.507   1.777  -0.465  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.130  -4.058   0.670  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.939  -4.112  -0.855  1.00  0.00           C  
HETATM   13  C   UNL     1       0.375  -3.944  -0.649  1.00  0.00           C  
HETATM   14  C   UNL     1       0.286  -3.883   0.885  1.00  0.00           C  
HETATM   15  C   UNL     1       3.489   1.169   0.809  1.00  0.00           C  
HETATM   16  C   UNL     1       3.655   1.936   1.942  1.00  0.00           C  
HETATM   17  C   UNL     1       4.755   2.779   2.077  1.00  0.00           C  
HETATM   18  C   UNL     1       5.695   2.870   1.096  1.00  0.00           C  
HETATM   19  C   UNL     1       5.564   2.105  -0.075  1.00  0.00           C  
HETATM   20  C   UNL     1       4.449   1.243  -0.224  1.00  0.00           C  
HETATM   21  C   UNL     1       6.518   2.178  -1.104  1.00  0.00           C  
HETATM   22  C   UNL     1       6.360   1.423  -2.226  1.00  0.00           C  
HETATM   23  C   UNL     1       5.264   0.576  -2.371  1.00  0.00           C  
HETATM   24  C   UNL     1       4.319   0.480  -1.395  1.00  0.00           C  
HETATM   25  C   UNL     1       3.139  -0.441  -1.571  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.926   2.189  -0.862  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.360   3.439   0.598  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.270   4.201  -0.748  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.936   3.661  -1.326  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.905   1.133   0.062  1.00  0.00           C  
HETATM   31  C   UNL     1      -0.071  -2.569  -1.199  1.00  0.00           C  
HETATM   32  C   UNL     1      -1.604  -2.680  -1.336  1.00  0.00           C  
HETATM   33  N   UNL     1      -1.014  -3.311   1.265  1.00  0.00           N  
HETATM   34  N   UNL     1       2.388   0.325   0.686  1.00  0.00           N  
HETATM   35  N   UNL     1      -0.688  -4.878  -1.108  1.00  0.00           N  
HETATM   36  N   UNL     1      -5.820   2.093   0.306  1.00  0.00           N  
HETATM   37  O   UNL     1      -3.489   0.388  -0.132  1.00  0.00           O  
HETATM   38  H   UNL     1       1.219  -2.432   2.245  1.00  0.00           H  
HETATM   39  H   UNL     1       1.778  -2.360   0.558  1.00  0.00           H  
HETATM   40  H   UNL     1       2.056  -0.205   2.696  1.00  0.00           H  
HETATM   41  H   UNL     1       3.363  -1.105   1.884  1.00  0.00           H  
HETATM   42  H   UNL     1       1.114   1.738  -0.196  1.00  0.00           H  
HETATM   43  H   UNL     1       1.086   1.704   1.581  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.829   1.959  -1.300  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.186   2.362   0.397  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.070  -3.557   0.902  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.148  -5.070   1.073  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.806  -4.530  -1.367  1.00  0.00           H  
HETATM   49  H   UNL     1       1.370  -4.227  -0.994  1.00  0.00           H  
HETATM   50  H   UNL     1       0.376  -4.888   1.297  1.00  0.00           H  
HETATM   51  H   UNL     1       1.088  -3.255   1.273  1.00  0.00           H  
HETATM   52  H   UNL     1       2.923   1.883   2.734  1.00  0.00           H  
HETATM   53  H   UNL     1       4.864   3.371   2.974  1.00  0.00           H  
HETATM   54  H   UNL     1       6.541   3.530   1.219  1.00  0.00           H  
HETATM   55  H   UNL     1       7.373   2.831  -1.005  1.00  0.00           H  
HETATM   56  H   UNL     1       7.095   1.482  -3.015  1.00  0.00           H  
HETATM   57  H   UNL     1       5.161  -0.012  -3.270  1.00  0.00           H  
HETATM   58  H   UNL     1       2.282   0.130  -1.928  1.00  0.00           H  
HETATM   59  H   UNL     1       3.388  -1.216  -2.296  1.00  0.00           H  
HETATM   60  H   UNL     1       2.894  -0.904  -0.615  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.290   1.543  -1.661  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.754   3.935   1.356  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.397   3.371   0.927  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.108   3.946  -1.398  1.00  0.00           H  
HETATM   65  H   UNL     1      -6.219   5.277  -0.585  1.00  0.00           H  
HETATM   66  H   UNL     1      -4.087   4.202  -0.907  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.933   3.722  -2.414  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.480   0.148  -0.135  1.00  0.00           H  
HETATM   69  H   UNL     1      -7.549   1.082   0.939  1.00  0.00           H  
HETATM   70  H   UNL     1      -7.489   1.456  -0.800  1.00  0.00           H  
HETATM   71  H   UNL     1       0.191  -1.776  -0.499  1.00  0.00           H  
HETATM   72  H   UNL     1       0.386  -2.382  -2.171  1.00  0.00           H  
HETATM   73  H   UNL     1      -1.903  -2.549  -2.376  1.00  0.00           H  
HETATM   74  H   UNL     1      -2.096  -1.942  -0.703  1.00  0.00           H  
HETATM   75  H   UNL     1      -0.674  -5.734  -0.573  1.00  0.00           H  
CONECT    1    2    2    5    9                                       
CONECT    2    3    7    1    1                                       
CONECT    3   33    4    4    2                                       
CONECT    4    3    3    6                                            
CONECT    5    6    6    1                                            
CONECT    6    4   37    5    5                                       
CONECT    7    2    8   38   39                                       
CONECT    8    7   34   40   41                                       
CONECT    9    1   34   42   43                                       
CONECT   10   26   37   44   45                                       
CONECT   11   12   33   46   47                                       
CONECT   12   35   11   32   48                                       
CONECT   13   35   14   31   49                                       
CONECT   14   13   33   50   51                                       
CONECT   15   34   16   16   20                                       
CONECT   16   15   15   17   52                                       
CONECT   17   16   18   18   53                                       
CONECT   18   17   17   19   54                                       
CONECT   19   20   18   21   21                                       
CONECT   20   15   24   24   19                                       
CONECT   21   19   19   22   55                                       
CONECT   22   23   23   21   56                                       
CONECT   23   24   22   22   57                                       
CONECT   24   25   20   20   23                                       
CONECT   25   24   58   59   60                                       
CONECT   26   10   36   29   61                                       
CONECT   27   36   28   62   63                                       
CONECT   28   29   27   64   65                                       
CONECT   29   26   28   66   67                                       
CONECT   30   36   68   69   70                                       
CONECT   31   13   32   71   72                                       
CONECT   32   12   31   73   74                                       
CONECT   33   11   14    3                                            
CONECT   34    8    9   15                                            
CONECT   35   12   13   75                                            
CONECT   36   30   26   27                                            
CONECT   37   10    6                                                 
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   11                                                      
CONECT   48   12                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   14                                                      
CONECT   52   16                                                      
CONECT   53   17                                                      
CONECT   54   18                                                      
CONECT   55   21                                                      
CONECT   56   22                                                      
CONECT   57   23                                                      
CONECT   58   25                                                      
CONECT   59   25                                                      
CONECT   60   25                                                      
CONECT   61   26                                                      
CONECT   62   27                                                      
CONECT   63   27                                                      
CONECT   64   28                                                      
CONECT   65   28                                                      
CONECT   66   29                                                      
CONECT   67   29                                                      
CONECT   68   30                                                      
CONECT   69   30                                                      
CONECT   70   30                                                      
CONECT   71   31                                                      
CONECT   72   31                                                      
CONECT   73   32                                                      
CONECT   74   32                                                      
CONECT   75   35                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
