COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      11.535   3.063  -1.380  1.00  0.00           C  
HETATM    2  C   UNL     1      11.509   1.275   0.253  1.00  0.00           C  
HETATM    3  C   UNL     1       9.998   1.065   0.130  1.00  0.00           C  
HETATM    4  C   UNL     1       9.666  -0.407   0.383  1.00  0.00           C  
HETATM    5  C   UNL     1       8.178  -0.613   0.262  1.00  0.00           C  
HETATM    6  C   UNL     1       6.267  -2.013   0.436  1.00  0.00           C  
HETATM    7  C   UNL     1       5.479  -1.254  -0.423  1.00  0.00           C  
HETATM    8  C   UNL     1       4.113  -1.427  -0.440  1.00  0.00           C  
HETATM    9  C   UNL     1       3.519  -2.365   0.408  1.00  0.00           C  
HETATM   10  C   UNL     1       2.055  -2.553   0.393  1.00  0.00           C  
HETATM   11  C   UNL     1       1.694  -0.228  -0.485  1.00  0.00           C  
HETATM   12  C   UNL     1       0.438   0.665  -0.329  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.689  -0.302  -0.776  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.157  -0.284  -0.766  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.244  -1.310  -2.523  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.460  -0.975  -1.962  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.465  -0.275  -0.748  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.738   0.106  -0.107  1.00  0.00           C  
HETATM   19  C   UNL     1      -7.843  -0.729   0.115  1.00  0.00           C  
HETATM   20  C   UNL     1      -8.087  -2.081  -0.170  1.00  0.00           C  
HETATM   21  C   UNL     1      -9.287  -2.629   0.174  1.00  0.00           C  
HETATM   22  C   UNL     1     -10.253  -1.832   0.806  1.00  0.00           C  
HETATM   23  C   UNL     1     -10.000  -0.532   1.072  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.072   1.377   0.404  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.197   2.574   0.390  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.433   2.868  -0.738  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.621   3.984  -0.746  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.564   4.809   0.363  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.319   4.521   1.485  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.140   3.411   1.502  1.00  0.00           C  
HETATM   31  C   UNL     1      -0.202  -1.668  -0.249  1.00  0.00           C  
HETATM   32  C   UNL     1       4.313  -3.126   1.270  1.00  0.00           C  
HETATM   33  C   UNL     1       5.679  -2.949   1.281  1.00  0.00           C  
HETATM   34  C   UNL     1      13.228   2.977   0.349  1.00  0.00           C  
HETATM   35  N   UNL     1      11.828   2.688   0.010  1.00  0.00           N  
HETATM   36  N   UNL     1       7.651  -1.840   0.446  1.00  0.00           N  
HETATM   37  N   UNL     1       1.254  -1.573  -0.071  1.00  0.00           N  
HETATM   38  N   UNL     1      -1.965   0.067  -0.157  1.00  0.00           N  
HETATM   39  N   UNL     1      -3.125  -0.954  -1.908  1.00  0.00           N  
HETATM   40  N   UNL     1      -8.802   0.027   0.733  1.00  0.00           N  
HETATM   41  N   UNL     1      -8.294   1.322   0.896  1.00  0.00           N  
HETATM   42  N   UNL     1      -4.299   0.054  -0.189  1.00  0.00           N  
HETATM   43  O   UNL     1       1.571  -3.592   0.799  1.00  0.00           O  
HETATM   44  O   UNL     1       7.455   0.324  -0.001  1.00  0.00           O  
HETATM   45  H   UNL     1      12.182   2.499  -2.052  1.00  0.00           H  
HETATM   46  H   UNL     1      10.493   2.838  -1.605  1.00  0.00           H  
HETATM   47  H   UNL     1      11.714   4.129  -1.514  1.00  0.00           H  
HETATM   48  H   UNL     1      11.834   0.996   1.255  1.00  0.00           H  
HETATM   49  H   UNL     1      12.023   0.655  -0.482  1.00  0.00           H  
HETATM   50  H   UNL     1       9.484   1.685   0.865  1.00  0.00           H  
HETATM   51  H   UNL     1       9.673   1.344  -0.872  1.00  0.00           H  
HETATM   52  H   UNL     1      10.180  -1.027  -0.352  1.00  0.00           H  
HETATM   53  H   UNL     1       9.991  -0.686   1.385  1.00  0.00           H  
HETATM   54  H   UNL     1       5.939  -0.529  -1.078  1.00  0.00           H  
HETATM   55  H   UNL     1       3.502  -0.837  -1.106  1.00  0.00           H  
HETATM   56  H   UNL     1       2.025  -0.240  -1.523  1.00  0.00           H  
HETATM   57  H   UNL     1       2.495   0.127   0.163  1.00  0.00           H  
HETATM   58  H   UNL     1       0.303   0.971   0.708  1.00  0.00           H  
HETATM   59  H   UNL     1       0.492   1.533  -0.987  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.779  -0.315  -1.862  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.205  -1.856  -3.454  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.386  -1.253  -2.444  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.333  -2.681  -0.658  1.00  0.00           H  
HETATM   64  H   UNL     1      -9.492  -3.668  -0.038  1.00  0.00           H  
HETATM   65  H   UNL     1     -11.206  -2.260   1.082  1.00  0.00           H  
HETATM   66  H   UNL     1     -10.752   0.071   1.559  1.00  0.00           H  
HETATM   67  H   UNL     1      -5.477   2.225  -1.605  1.00  0.00           H  
HETATM   68  H   UNL     1      -4.028   4.213  -1.619  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.926   5.681   0.352  1.00  0.00           H  
HETATM   70  H   UNL     1      -5.271   5.169   2.348  1.00  0.00           H  
HETATM   71  H   UNL     1      -6.733   3.190   2.377  1.00  0.00           H  
HETATM   72  H   UNL     1      -0.678  -1.888   0.706  1.00  0.00           H  
HETATM   73  H   UNL     1      -0.439  -2.450  -0.970  1.00  0.00           H  
HETATM   74  H   UNL     1       3.857  -3.852   1.926  1.00  0.00           H  
HETATM   75  H   UNL     1       6.293  -3.536   1.947  1.00  0.00           H  
HETATM   76  H   UNL     1      13.438   4.030   0.160  1.00  0.00           H  
HETATM   77  H   UNL     1      13.399   2.756   1.403  1.00  0.00           H  
HETATM   78  H   UNL     1      13.885   2.360  -0.263  1.00  0.00           H  
HETATM   79  H   UNL     1       8.234  -2.603   0.585  1.00  0.00           H  
HETATM   80  H   UNL     1      -1.973   0.558   0.680  1.00  0.00           H  
CONECT    1   35   45   46   47                                       
CONECT    2   35    3   48   49                                       
CONECT    3    2    4   50   51                                       
CONECT    4    3    5   52   53                                       
CONECT    5   44   44    4   36                                       
CONECT    6   36   33   33    7                                       
CONECT    7    6    8    8   54                                       
CONECT    8    7    7    9   55                                       
CONECT    9   32   32    8   10                                       
CONECT   10    9   43   43   37                                       
CONECT   11   37   12   56   57                                       
CONECT   12   11   13   58   59                                       
CONECT   13   31   12   38   60                                       
CONECT   14   38   42   42   39                                       
CONECT   15   39   39   16   61                                       
CONECT   16   17   17   15   62                                       
CONECT   17   18   42   16   16                                       
CONECT   18   19   19   17   24                                       
CONECT   19   20   40   18   18                                       
CONECT   20   21   21   19   63                                       
CONECT   21   22   20   20   64                                       
CONECT   22   21   23   23   65                                       
CONECT   23   22   22   40   66                                       
CONECT   24   41   41   18   25                                       
CONECT   25   24   30   30   26                                       
CONECT   26   25   27   27   67                                       
CONECT   27   26   26   28   68                                       
CONECT   28   29   29   27   69                                       
CONECT   29   30   28   28   70                                       
CONECT   30   25   25   29   71                                       
CONECT   31   37   13   72   73                                       
CONECT   32   33    9    9   74                                       
CONECT   33    6    6   32   75                                       
CONECT   34   35   76   77   78                                       
CONECT   35    1   34    2                                            
CONECT   36    5    6   79                                            
CONECT   37   10   11   31                                            
CONECT   38   13   14   80                                            
CONECT   39   14   15   15                                            
CONECT   40   23   19   41                                            
CONECT   41   40   24   24                                            
CONECT   42   14   14   17                                            
CONECT   43   10   10                                                 
CONECT   44    5    5                                                 
CONECT   45    1                                                      
CONECT   46    1                                                      
CONECT   47    1                                                      
CONECT   48    2                                                      
CONECT   49    2                                                      
CONECT   50    3                                                      
CONECT   51    3                                                      
CONECT   52    4                                                      
CONECT   53    4                                                      
CONECT   54    7                                                      
CONECT   55    8                                                      
CONECT   56   11                                                      
CONECT   57   11                                                      
CONECT   58   12                                                      
CONECT   59   12                                                      
CONECT   60   13                                                      
CONECT   61   15                                                      
CONECT   62   16                                                      
CONECT   63   20                                                      
CONECT   64   21                                                      
CONECT   65   22                                                      
CONECT   66   23                                                      
CONECT   67   26                                                      
CONECT   68   27                                                      
CONECT   69   28                                                      
CONECT   70   29                                                      
CONECT   71   30                                                      
CONECT   72   31                                                      
CONECT   73   31                                                      
CONECT   74   32                                                      
CONECT   75   33                                                      
CONECT   76   34                                                      
CONECT   77   34                                                      
CONECT   78   34                                                      
CONECT   79   36                                                      
CONECT   80   38                                                      
MASTER        0    0    0    0    0    0    0    0   80    0   80    0
END
