COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      11.303   0.599   0.232  1.00  0.00           N  
HETATM    2  C   UNL     1      12.073   1.774   0.669  1.00  0.00           C  
HETATM    3  C   UNL     1      11.461   2.257   1.993  1.00  0.00           C  
HETATM    4  C   UNL     1       9.992   2.610   1.747  1.00  0.00           C  
HETATM    5  N   UNL     1       9.316   1.528   1.040  1.00  0.00           N  
HETATM    6  C   UNL     1       9.931   0.627   0.348  1.00  0.00           C  
HETATM    7  C   UNL     1       9.133  -0.407  -0.349  1.00  0.00           C  
HETATM    8  C   UNL     1       7.742  -0.400  -0.253  1.00  0.00           C  
HETATM    9  C   UNL     1       9.770  -1.389  -1.108  1.00  0.00           C  
HETATM   10  C   UNL     1       9.024  -2.352  -1.757  1.00  0.00           C  
HETATM   11  C   UNL     1       7.646  -2.349  -1.658  1.00  0.00           C  
HETATM   12  C   UNL     1       7.002  -1.372  -0.908  1.00  0.00           C  
HETATM   13  N   UNL     1       5.606  -1.369  -0.815  1.00  0.00           N  
HETATM   14  C   UNL     1       4.940  -0.201  -0.716  1.00  0.00           C  
HETATM   15  O   UNL     1       5.542   0.851  -0.802  1.00  0.00           O  
HETATM   16  C   UNL     1       3.478  -0.201  -0.504  1.00  0.00           C  
HETATM   17  C   UNL     1       2.787   1.009  -0.402  1.00  0.00           C  
HETATM   18  C   UNL     1       1.424   1.008  -0.205  1.00  0.00           C  
HETATM   19  C   UNL     1       2.785  -1.411  -0.411  1.00  0.00           C  
HETATM   20  C   UNL     1       1.422  -1.409  -0.214  1.00  0.00           C  
HETATM   21  C   UNL     1       0.734  -0.200  -0.106  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.733  -0.200   0.108  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.423   1.009   0.204  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.786   1.010   0.403  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.424  -1.408   0.206  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.786  -1.409   0.404  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.477  -0.199   0.507  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.939  -0.198   0.720  1.00  0.00           C  
HETATM   29  O   UNL     1      -5.541   0.855   0.805  1.00  0.00           O  
HETATM   30  N   UNL     1      -5.606  -1.365   0.820  1.00  0.00           N  
HETATM   31  C   UNL     1      -7.001  -1.368   0.914  1.00  0.00           C  
HETATM   32  C   UNL     1      -7.742  -0.397   0.258  1.00  0.00           C  
HETATM   33  C   UNL     1      -7.646  -2.346   1.662  1.00  0.00           C  
HETATM   34  C   UNL     1      -9.025  -2.353   1.757  1.00  0.00           C  
HETATM   35  C   UNL     1      -9.770  -1.387   1.110  1.00  0.00           C  
HETATM   36  C   UNL     1      -9.132  -0.404   0.354  1.00  0.00           C  
HETATM   37  C   UNL     1      -9.930   0.630  -0.344  1.00  0.00           C  
HETATM   38  N   UNL     1      -9.316   1.530  -1.038  1.00  0.00           N  
HETATM   39  C   UNL     1      -9.992   2.607  -1.751  1.00  0.00           C  
HETATM   40  C   UNL     1     -11.459   2.249  -2.000  1.00  0.00           C  
HETATM   41  C   UNL     1     -12.075   1.770  -0.677  1.00  0.00           C  
HETATM   42  N   UNL     1     -11.304   0.596  -0.236  1.00  0.00           N  
HETATM   43  H   UNL     1      11.753  -0.178  -0.135  1.00  0.00           H  
HETATM   44  H   UNL     1      13.116   1.497   0.823  1.00  0.00           H  
HETATM   45  H   UNL     1      12.005   2.562  -0.081  1.00  0.00           H  
HETATM   46  H   UNL     1      11.527   1.464   2.738  1.00  0.00           H  
HETATM   47  H   UNL     1      11.995   3.139   2.343  1.00  0.00           H  
HETATM   48  H   UNL     1       9.498   2.779   2.703  1.00  0.00           H  
HETATM   49  H   UNL     1       9.936   3.519   1.148  1.00  0.00           H  
HETATM   50  H   UNL     1       7.244   0.360   0.330  1.00  0.00           H  
HETATM   51  H   UNL     1      10.847  -1.395  -1.188  1.00  0.00           H  
HETATM   52  H   UNL     1       9.520  -3.111  -2.344  1.00  0.00           H  
HETATM   53  H   UNL     1       7.068  -3.105  -2.168  1.00  0.00           H  
HETATM   54  H   UNL     1       5.118  -2.207  -0.821  1.00  0.00           H  
HETATM   55  H   UNL     1       3.321   1.944  -0.477  1.00  0.00           H  
HETATM   56  H   UNL     1       0.890   1.943  -0.125  1.00  0.00           H  
HETATM   57  H   UNL     1       3.317  -2.346  -0.494  1.00  0.00           H  
HETATM   58  H   UNL     1       0.886  -2.344  -0.142  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.889   1.944   0.124  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.320   1.946   0.478  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.889  -2.343   0.127  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.321  -2.344   0.479  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.118  -2.204   0.827  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.244   0.362  -0.327  1.00  0.00           H  
HETATM   65  H   UNL     1      -7.068  -3.104   2.169  1.00  0.00           H  
HETATM   66  H   UNL     1      -9.521  -3.116   2.338  1.00  0.00           H  
HETATM   67  H   UNL     1     -10.847  -1.396   1.186  1.00  0.00           H  
HETATM   68  H   UNL     1      -9.941   3.519  -1.156  1.00  0.00           H  
HETATM   69  H   UNL     1      -9.495   2.773  -2.707  1.00  0.00           H  
HETATM   70  H   UNL     1     -11.995   3.129  -2.357  1.00  0.00           H  
HETATM   71  H   UNL     1     -11.521   1.456  -2.745  1.00  0.00           H  
HETATM   72  H   UNL     1     -12.011   2.562   0.070  1.00  0.00           H  
HETATM   73  H   UNL     1     -13.117   1.491  -0.832  1.00  0.00           H  
HETATM   74  H   UNL     1     -11.752  -0.184   0.126  1.00  0.00           H  
CONECT    1    2    6   43                                            
CONECT    2    3    1   44   45                                       
CONECT    3    4    2   46   47                                       
CONECT    4    3    5   48   49                                       
CONECT    5    4    6    6                                            
CONECT    6    1    5    5    7                                       
CONECT    7    6    9    9    8                                       
CONECT    8    7   12   12   50                                       
CONECT    9    7    7   10   51                                       
CONECT   10    9   11   11   52                                       
CONECT   11   10   10   12   53                                       
CONECT   12    8    8   11   13                                       
CONECT   13   12   14   54                                            
CONECT   14   13   15   15   16                                       
CONECT   15   14   14                                                 
CONECT   16   14   17   17   19                                       
CONECT   17   16   16   18   55                                       
CONECT   18   17   21   21   56                                       
CONECT   19   16   20   20   57                                       
CONECT   20   19   19   21   58                                       
CONECT   21   18   18   20   22                                       
CONECT   22   21   25   25   23                                       
CONECT   23   22   24   24   59                                       
CONECT   24   23   23   27   60                                       
CONECT   25   22   22   26   61                                       
CONECT   26   25   27   27   62                                       
CONECT   27   26   26   24   28                                       
CONECT   28   27   29   29   30                                       
CONECT   29   28   28                                                 
CONECT   30   28   31   63                                            
CONECT   31   30   33   33   32                                       
CONECT   32   31   36   36   64                                       
CONECT   33   31   31   34   65                                       
CONECT   34   33   35   35   66                                       
CONECT   35   34   34   36   67                                       
CONECT   36   32   32   35   37                                       
CONECT   37   36   38   38   42                                       
CONECT   38   37   37   39                                            
CONECT   39   38   40   68   69                                       
CONECT   40   39   41   70   71                                       
CONECT   41   42   40   72   73                                       
CONECT   42   37   41   74                                            
CONECT   43    1                                                      
CONECT   44    2                                                      
CONECT   45    2                                                      
CONECT   46    3                                                      
CONECT   47    3                                                      
CONECT   48    4                                                      
CONECT   49    4                                                      
CONECT   50    8                                                      
CONECT   51    9                                                      
CONECT   52   10                                                      
CONECT   53   11                                                      
CONECT   54   13                                                      
CONECT   55   17                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   20                                                      
CONECT   59   23                                                      
CONECT   60   24                                                      
CONECT   61   25                                                      
CONECT   62   26                                                      
CONECT   63   30                                                      
CONECT   64   32                                                      
CONECT   65   33                                                      
CONECT   66   34                                                      
CONECT   67   35                                                      
CONECT   68   39                                                      
CONECT   69   39                                                      
CONECT   70   40                                                      
CONECT   71   40                                                      
CONECT   72   41                                                      
CONECT   73   41                                                      
CONECT   74   42                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
