COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -6.626   2.585  -0.096  1.00  0.00           O  
HETATM    2  C   UNL     1      -5.579   3.201  -0.047  1.00  0.00           C  
HETATM    3  N   UNL     1      -5.590   4.532   0.167  1.00  0.00           N  
HETATM    4  C   UNL     1      -4.298   2.493  -0.217  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.277   1.092  -0.319  1.00  0.00           C  
HETATM    6  N   UNL     1      -5.462   0.370  -0.261  1.00  0.00           N  
HETATM    7  C   UNL     1      -5.427  -1.095  -0.250  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.747  -1.640  -0.798  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.711  -3.170  -0.786  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.511  -3.665   0.647  1.00  0.00           C  
HETATM   11  O   UNL     1      -6.477  -5.093   0.658  1.00  0.00           O  
HETATM   12  C   UNL     1      -5.191  -3.119   1.195  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.227  -1.590   1.184  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.066   0.434  -0.479  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.882   1.165  -0.537  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.913   2.559  -0.434  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.101   3.213  -0.282  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.589   0.466  -0.707  1.00  0.00           C  
HETATM   19  N   UNL     1      -0.470  -0.504  -1.597  1.00  0.00           N  
HETATM   20  C   UNL     1       0.662  -1.161  -1.790  1.00  0.00           C  
HETATM   21  C   UNL     1       1.791  -0.881  -1.076  1.00  0.00           C  
HETATM   22  C   UNL     1       1.747   0.137  -0.109  1.00  0.00           C  
HETATM   23  C   UNL     1       0.528   0.835   0.079  1.00  0.00           C  
HETATM   24  C   UNL     1       2.872   0.484   0.665  1.00  0.00           C  
HETATM   25  C   UNL     1       2.761   1.494   1.597  1.00  0.00           C  
HETATM   26  C   UNL     1       1.557   2.168   1.777  1.00  0.00           C  
HETATM   27  C   UNL     1       0.458   1.859   1.033  1.00  0.00           C  
HETATM   28  N   UNL     1       4.086  -0.189   0.491  1.00  0.00           N  
HETATM   29  C   UNL     1       4.264  -1.537   0.466  1.00  0.00           C  
HETATM   30  N   UNL     1       5.530  -1.791   0.284  1.00  0.00           N  
HETATM   31  C   UNL     1       6.208  -0.629   0.186  1.00  0.00           C  
HETATM   32  C   UNL     1       5.314   0.387   0.308  1.00  0.00           C  
HETATM   33  C   UNL     1       7.669  -0.486  -0.023  1.00  0.00           C  
HETATM   34  C   UNL     1       8.474  -1.619  -0.139  1.00  0.00           C  
HETATM   35  C   UNL     1       9.833  -1.480  -0.335  1.00  0.00           C  
HETATM   36  C   UNL     1      10.397  -0.220  -0.416  1.00  0.00           C  
HETATM   37  C   UNL     1       9.604   0.908  -0.302  1.00  0.00           C  
HETATM   38  C   UNL     1       8.243   0.781  -0.112  1.00  0.00           C  
HETATM   39  H   UNL     1      -6.432   4.997   0.283  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.754   5.023   0.206  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.312   0.835  -0.228  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.603  -1.444  -0.873  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.571  -1.292  -0.175  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.890  -1.288  -1.820  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.652  -3.559  -1.177  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.888  -3.519  -1.410  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.335  -3.316   1.270  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.353  -5.477   1.537  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.048  -3.472   2.217  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.367  -3.468   0.572  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.286  -1.201   1.574  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.050  -1.241   1.807  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.041  -0.643  -0.558  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.993   3.122  -0.483  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.117   4.290  -0.203  1.00  0.00           H  
HETATM   56  H   UNL     1       0.693  -1.943  -2.533  1.00  0.00           H  
HETATM   57  H   UNL     1       2.702  -1.433  -1.252  1.00  0.00           H  
HETATM   58  H   UNL     1       3.619   1.765   2.194  1.00  0.00           H  
HETATM   59  H   UNL     1       1.495   2.955   2.514  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.468   2.393   1.186  1.00  0.00           H  
HETATM   61  H   UNL     1       3.485  -2.276   0.579  1.00  0.00           H  
HETATM   62  H   UNL     1       5.531   1.444   0.271  1.00  0.00           H  
HETATM   63  H   UNL     1       8.034  -2.603  -0.075  1.00  0.00           H  
HETATM   64  H   UNL     1      10.457  -2.357  -0.424  1.00  0.00           H  
HETATM   65  H   UNL     1      11.461  -0.116  -0.568  1.00  0.00           H  
HETATM   66  H   UNL     1      10.050   1.889  -0.366  1.00  0.00           H  
HETATM   67  H   UNL     1       7.624   1.662  -0.027  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    4    1    1                                       
CONECT    3    2   39   40                                            
CONECT    4   17    2    5    5                                       
CONECT    5    4    4   14    6                                       
CONECT    6    5    7   41                                            
CONECT    7    6    8   13   42                                       
CONECT    8    7    9   43   44                                       
CONECT    9    8   10   45   46                                       
CONECT   10    9   11   12   47                                       
CONECT   11   10   48                                                 
CONECT   12   13   10   49   50                                       
CONECT   13    7   12   51   52                                       
CONECT   14   15   15    5   53                                       
CONECT   15   16   18   14   14                                       
CONECT   16   17   17   15   54                                       
CONECT   17   16   16    4   55                                       
CONECT   18   19   15   23   23                                       
CONECT   19   20   20   18                                            
CONECT   20   19   19   21   56                                       
CONECT   21   20   22   22   57                                       
CONECT   22   21   21   23   24                                       
CONECT   23   18   18   22   27                                       
CONECT   24   22   28   25   25                                       
CONECT   25   24   24   26   58                                       
CONECT   26   27   27   25   59                                       
CONECT   27   23   26   26   60                                       
CONECT   28   29   24   32                                            
CONECT   29   30   30   28   61                                       
CONECT   30   29   29   31                                            
CONECT   31   30   32   32   33                                       
CONECT   32   28   31   31   62                                       
CONECT   33   31   38   38   34                                       
CONECT   34   33   35   35   63                                       
CONECT   35   34   34   36   64                                       
CONECT   36   37   37   35   65                                       
CONECT   37   38   36   36   66                                       
CONECT   38   33   33   37   67                                       
CONECT   39    3                                                      
CONECT   40    3                                                      
CONECT   41    6                                                      
CONECT   42    7                                                      
CONECT   43    8                                                      
CONECT   44    8                                                      
CONECT   45    9                                                      
CONECT   46    9                                                      
CONECT   47   10                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   12                                                      
CONECT   51   13                                                      
CONECT   52   13                                                      
CONECT   53   14                                                      
CONECT   54   16                                                      
CONECT   55   17                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   25                                                      
CONECT   59   26                                                      
CONECT   60   27                                                      
CONECT   61   29                                                      
CONECT   62   32                                                      
CONECT   63   34                                                      
CONECT   64   35                                                      
CONECT   65   36                                                      
CONECT   66   37                                                      
CONECT   67   38                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
