COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       8.402  -2.551   4.482  1.00  0.00           N  
HETATM    2  C   UNL     1       7.631  -3.379   5.222  1.00  0.00           C  
HETATM    3  C   UNL     1       6.419  -3.012   5.787  1.00  0.00           C  
HETATM    4  C   UNL     1       5.970  -1.713   5.577  1.00  0.00           C  
HETATM    5  C   UNL     1       6.736  -0.832   4.821  1.00  0.00           C  
HETATM    6  C   UNL     1       7.949  -1.277   4.285  1.00  0.00           C  
HETATM    7  C   UNL     1       8.309   0.974   3.271  1.00  0.00           C  
HETATM    8  N   UNL     1       8.702  -0.386   3.533  1.00  0.00           N  
HETATM    9  C   UNL     1       8.066   0.963   0.357  1.00  0.00           C  
HETATM   10  C   UNL     1       6.875   1.647   0.112  1.00  0.00           C  
HETATM   11  C   UNL     1       5.809   0.992  -0.505  1.00  0.00           C  
HETATM   12  C   UNL     1       5.958  -0.332  -0.863  1.00  0.00           C  
HETATM   13  C   UNL     1       7.125  -1.030  -0.633  1.00  0.00           C  
HETATM   14  C   UNL     1       8.191  -0.375  -0.016  1.00  0.00           C  
HETATM   15  C   UNL     1       9.419  -1.126   0.222  1.00  0.00           C  
HETATM   16  O   UNL     1      10.553  -0.645   0.249  1.00  0.00           O  
HETATM   17  O   UNL     1       9.184  -2.451   0.419  1.00  0.00           O  
HETATM   18  C   UNL     1       4.822  -1.028  -1.520  1.00  0.00           C  
HETATM   19  N   UNL     1       3.589  -0.526  -1.208  1.00  0.00           N  
HETATM   20  O   UNL     1       5.049  -1.984  -2.256  1.00  0.00           O  
HETATM   21  C   UNL     1       2.355  -1.127  -1.761  1.00  0.00           C  
HETATM   22  C   UNL     1       1.806  -2.236  -0.856  1.00  0.00           C  
HETATM   23  C   UNL     1       1.481  -1.730   0.551  1.00  0.00           C  
HETATM   24  C   UNL     1       0.591  -2.931  -1.471  1.00  0.00           C  
HETATM   25  C   UNL     1       5.643  -3.957   6.571  1.00  0.00           C  
HETATM   26  N   UNL     1       4.420  -3.668   7.169  1.00  0.00           N  
HETATM   27  N   UNL     1       6.126  -5.172   6.731  1.00  0.00           N  
HETATM   28  C   UNL     1      11.144   3.028   0.801  1.00  0.00           C  
HETATM   29  C   UNL     1      11.273   3.042   2.189  1.00  0.00           C  
HETATM   30  C   UNL     1      10.344   2.370   2.983  1.00  0.00           C  
HETATM   31  C   UNL     1       9.286   1.683   2.388  1.00  0.00           C  
HETATM   32  C   UNL     1       9.157   1.670   1.000  1.00  0.00           C  
HETATM   33  C   UNL     1      10.085   2.341   0.206  1.00  0.00           C  
HETATM   34  C   UNL     1      12.951   3.385   3.945  1.00  0.00           C  
HETATM   35  C   UNL     1      12.377   3.758   2.809  1.00  0.00           C  
HETATM   36  H   UNL     1       3.914  -4.365   7.706  1.00  0.00           H  
HETATM   37  H   UNL     1       3.992  -2.752   7.104  1.00  0.00           H  
HETATM   38  H   UNL     1       5.480  -5.728   7.302  1.00  0.00           H  
HETATM   39  H   UNL     1       8.033  -4.379   5.351  1.00  0.00           H  
HETATM   40  H   UNL     1       6.393   0.184   4.653  1.00  0.00           H  
HETATM   41  H   UNL     1       5.026  -1.377   5.999  1.00  0.00           H  
HETATM   42  H   UNL     1       9.581  -0.717   3.146  1.00  0.00           H  
HETATM   43  H   UNL     1       8.212   1.484   4.238  1.00  0.00           H  
HETATM   44  H   UNL     1       7.309   0.948   2.820  1.00  0.00           H  
HETATM   45  H   UNL     1      10.441   2.378   4.067  1.00  0.00           H  
HETATM   46  H   UNL     1      12.755   4.622   2.287  1.00  0.00           H  
HETATM   47  H   UNL     1      13.779   3.973   4.330  1.00  0.00           H  
HETATM   48  H   UNL     1      12.661   2.517   4.524  1.00  0.00           H  
HETATM   49  H   UNL     1      11.860   3.547   0.169  1.00  0.00           H  
HETATM   50  H   UNL     1       9.999   2.340  -0.878  1.00  0.00           H  
HETATM   51  H   UNL     1       6.760   2.691   0.395  1.00  0.00           H  
HETATM   52  H   UNL     1       4.885   1.534  -0.690  1.00  0.00           H  
HETATM   53  H   UNL     1       7.221  -2.074  -0.924  1.00  0.00           H  
HETATM   54  H   UNL     1      10.003  -2.965   0.581  1.00  0.00           H  
HETATM   55  H   UNL     1       3.446   0.216  -0.553  1.00  0.00           H  
HETATM   56  H   UNL     1       2.577  -1.518  -2.760  1.00  0.00           H  
HETATM   57  H   UNL     1       1.610  -0.331  -1.875  1.00  0.00           H  
HETATM   58  H   UNL     1       2.599  -2.989  -0.756  1.00  0.00           H  
HETATM   59  H   UNL     1       0.645  -1.024   0.548  1.00  0.00           H  
HETATM   60  H   UNL     1       1.207  -2.565   1.205  1.00  0.00           H  
HETATM   61  H   UNL     1       2.349  -1.231   0.995  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.265  -2.253  -1.556  1.00  0.00           H  
HETATM   63  H   UNL     1       0.282  -3.783  -0.856  1.00  0.00           H  
HETATM   64  H   UNL     1       0.826  -3.311  -2.471  1.00  0.00           H  
CONECT    1    2    6    6                                            
CONECT    2    1    3    3   39                                       
CONECT    3    2    2   25    4                                       
CONECT    4    3    5    5   41                                       
CONECT    5    4    4    6   40                                       
CONECT    6    1    1    5    8                                       
CONECT    7    8   43   44   31                                       
CONECT    8    6    7   42                                            
CONECT    9   32   10   10   14                                       
CONECT   10    9    9   51   11                                       
CONECT   11   10   52   12   12                                       
CONECT   12   11   11   13   18                                       
CONECT   13   12   53   14   14                                       
CONECT   14    9   13   13   15                                       
CONECT   15   14   16   16   17                                       
CONECT   16   15   15                                                 
CONECT   17   15   54                                                 
CONECT   18   12   20   20   19                                       
CONECT   19   18   55   21                                            
CONECT   20   18   18                                                 
CONECT   21   19   56   57   22                                       
CONECT   22   21   58   23   24                                       
CONECT   23   22   59   60   61                                       
CONECT   24   22   62   63   64                                       
CONECT   25    3   26   27   27                                       
CONECT   26   25   36   37                                            
CONECT   27   25   25   38                                            
CONECT   28   29   49   33   33                                       
CONECT   29   28   30   30   35                                       
CONECT   30   29   29   31   45                                       
CONECT   31    7   30   32   32                                       
CONECT   32    9   31   31   33                                       
CONECT   33   28   28   32   50                                       
CONECT   34   35   35   47   48                                       
CONECT   35   29   34   34   46                                       
CONECT   36   26                                                      
CONECT   37   26                                                      
CONECT   38   27                                                      
CONECT   39    2                                                      
CONECT   40    5                                                      
CONECT   41    4                                                      
CONECT   42    8                                                      
CONECT   43    7                                                      
CONECT   44    7                                                      
CONECT   45   30                                                      
CONECT   46   35                                                      
CONECT   47   34                                                      
CONECT   48   34                                                      
CONECT   49   28                                                      
CONECT   50   33                                                      
CONECT   51   10                                                      
CONECT   52   11                                                      
CONECT   53   13                                                      
CONECT   54   17                                                      
CONECT   55   19                                                      
CONECT   56   21                                                      
CONECT   57   21                                                      
CONECT   58   22                                                      
CONECT   59   23                                                      
CONECT   60   23                                                      
CONECT   61   23                                                      
CONECT   62   24                                                      
CONECT   63   24                                                      
CONECT   64   24                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
