COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.561   1.833   0.237  1.00  0.00           C  
HETATM    2  O   UNL     1       7.167   1.617   0.005  1.00  0.00           O  
HETATM    3  C   UNL     1       6.650   0.431   0.415  1.00  0.00           C  
HETATM    4  C   UNL     1       7.458  -0.503   1.031  1.00  0.00           C  
HETATM    5  C   UNL     1       6.935  -1.717   1.452  1.00  0.00           C  
HETATM    6  C   UNL     1       5.602  -2.012   1.263  1.00  0.00           C  
HETATM    7  C   UNL     1       4.765  -1.089   0.644  1.00  0.00           C  
HETATM    8  N   UNL     1       3.427  -1.101   0.325  1.00  0.00           N  
HETATM    9  C   UNL     1       3.106   0.095  -0.292  1.00  0.00           C  
HETATM   10  C   UNL     1       4.222   0.868  -0.370  1.00  0.00           C  
HETATM   11  C   UNL     1       5.287   0.148   0.219  1.00  0.00           C  
HETATM   12  C   UNL     1       1.774   0.469  -0.785  1.00  0.00           C  
HETATM   13  O   UNL     1       1.603   1.551  -1.315  1.00  0.00           O  
HETATM   14  N   UNL     1       0.741  -0.386  -0.650  1.00  0.00           N  
HETATM   15  C   UNL     1      -0.609   0.029  -1.041  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.832  -0.290  -2.520  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.187   0.267  -2.963  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.150   1.796  -2.917  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.485  -0.193  -4.392  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.623  -0.713  -0.208  1.00  0.00           C  
HETATM   21  O   UNL     1      -1.303  -1.727   0.376  1.00  0.00           O  
HETATM   22  N   UNL     1      -2.885  -0.250  -0.113  1.00  0.00           N  
HETATM   23  C   UNL     1      -3.847  -0.921   0.766  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.932   0.072   1.186  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.308   1.179   2.038  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.391   2.181   2.502  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.308   3.264   1.404  1.00  0.00           C  
HETATM   28  N   UNL     1      -3.944   3.179   0.872  1.00  0.00           N  
HETATM   29  C   UNL     1      -3.360   2.016   1.208  1.00  0.00           C  
HETATM   30  O   UNL     1      -2.237   1.686   0.892  1.00  0.00           O  
HETATM   31  C   UNL     1      -4.489  -2.092   0.019  1.00  0.00           C  
HETATM   32  O   UNL     1      -5.427  -2.746   0.877  1.00  0.00           O  
HETATM   33  C   UNL     1      -3.403  -3.086  -0.401  1.00  0.00           C  
HETATM   34  O   UNL     1      -2.652  -3.484   0.748  1.00  0.00           O  
HETATM   35  H   UNL     1       8.763   1.779   1.307  1.00  0.00           H  
HETATM   36  H   UNL     1       9.138   1.067  -0.280  1.00  0.00           H  
HETATM   37  H   UNL     1       8.844   2.816  -0.137  1.00  0.00           H  
HETATM   38  H   UNL     1       8.505  -0.288   1.187  1.00  0.00           H  
HETATM   39  H   UNL     1       7.578  -2.439   1.932  1.00  0.00           H  
HETATM   40  H   UNL     1       5.207  -2.961   1.595  1.00  0.00           H  
HETATM   41  H   UNL     1       2.810  -1.828   0.503  1.00  0.00           H  
HETATM   42  H   UNL     1       4.285   1.851  -0.812  1.00  0.00           H  
HETATM   43  H   UNL     1       0.891  -1.276  -0.295  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.721   1.101  -0.879  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.041   0.166  -3.114  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.819  -1.370  -2.666  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.966  -0.098  -2.294  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.136   2.191  -3.160  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.864   2.122  -1.916  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.422   2.164  -3.640  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.512  -1.282  -4.425  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.450   0.204  -4.707  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.706   0.172  -5.061  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.157   0.526  -0.626  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.332  -1.293   1.651  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.387   0.511   0.298  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.695  -0.447   1.766  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.788   0.752   2.896  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.375   1.712   2.515  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.146   2.596   3.479  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.034   3.060   0.617  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.485   4.251   1.834  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.517   3.873   0.345  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.003  -1.721  -0.866  1.00  0.00           H  
HETATM   65  H   UNL     1      -6.144  -2.175   1.182  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.868  -3.962  -0.853  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.738  -2.613  -1.124  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.945  -4.115   0.555  1.00  0.00           H  
CONECT    1    2   35   36   37                                       
CONECT    2    1    3                                                 
CONECT    3    2   11   11    4                                       
CONECT    4    3    5    5   38                                       
CONECT    5    4    4    6   39                                       
CONECT    6    7    7    5   40                                       
CONECT    7   11    8    6    6                                       
CONECT    8    9    7   41                                            
CONECT    9   10   10   12    8                                       
CONECT   10   11    9    9   42                                       
CONECT   11   10    3    3    7                                       
CONECT   12   14    9   13   13                                       
CONECT   13   12   12                                                 
CONECT   14   15   12   43                                            
CONECT   15   16   20   14   44                                       
CONECT   16   17   15   45   46                                       
CONECT   17   19   16   18   47                                       
CONECT   18   17   48   49   50                                       
CONECT   19   17   51   52   53                                       
CONECT   20   21   21   22   15                                       
CONECT   21   20   20                                                 
CONECT   22   23   20   54                                            
CONECT   23   31   22   24   55                                       
CONECT   24   23   25   56   57                                       
CONECT   25   26   24   29   58                                       
CONECT   26   27   25   59   60                                       
CONECT   27   26   28   61   62                                       
CONECT   28   27   29   63                                            
CONECT   29   25   28   30   30                                       
CONECT   30   29   29                                                 
CONECT   31   33   32   23   64                                       
CONECT   32   31   65                                                 
CONECT   33   34   31   66   67                                       
CONECT   34   33   68                                                 
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    8                                                      
CONECT   42   10                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   18                                                      
CONECT   49   18                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   19                                                      
CONECT   54   22                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   24                                                      
CONECT   58   25                                                      
CONECT   59   26                                                      
CONECT   60   26                                                      
CONECT   61   27                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   31                                                      
CONECT   65   32                                                      
CONECT   66   33                                                      
CONECT   67   33                                                      
CONECT   68   34                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
