COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.300   1.210   0.039  1.00  0.00           C  
HETATM    2  N   UNL     1       4.922  -0.082  -0.136  1.00  0.00           N  
HETATM    3  C   UNL     1       4.276  -1.269  -0.172  1.00  0.00           C  
HETATM    4  O   UNL     1       4.876  -2.323  -0.234  1.00  0.00           O  
HETATM    5  C   UNL     1       2.806  -1.196  -0.131  1.00  0.00           C  
HETATM    6  C   UNL     1       1.823  -2.180   0.072  1.00  0.00           C  
HETATM    7  C   UNL     1       0.621  -1.555   0.016  1.00  0.00           C  
HETATM    8  N   UNL     1       0.842  -0.215  -0.251  1.00  0.00           N  
HETATM    9  C   UNL     1       2.162   0.019  -0.275  1.00  0.00           C  
HETATM   10  C   UNL     1       2.857   1.349  -0.415  1.00  0.00           C  
HETATM   11  C   UNL     1       2.111   2.352   0.469  1.00  0.00           C  
HETATM   12  C   UNL     1       1.306   3.338  -0.320  1.00  0.00           C  
HETATM   13  C   UNL     1       0.007   3.463  -0.317  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.932   2.641   0.510  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.301   3.458   1.760  1.00  0.00           C  
HETATM   16  N   UNL     1      -2.185   2.350  -0.236  1.00  0.00           N  
HETATM   17  C   UNL     1      -2.548   0.997  -0.227  1.00  0.00           C  
HETATM   18  N   UNL     1      -1.581   0.143   0.089  1.00  0.00           N  
HETATM   19  C   UNL     1      -1.815  -1.165   0.102  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.738  -2.096   0.203  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.023  -3.414   0.488  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.347  -3.843   0.508  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.387  -2.993   0.254  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.143  -1.637  -0.008  1.00  0.00           C  
HETATM   25  N   UNL     1      -4.095  -0.772  -0.382  1.00  0.00           N  
HETATM   26  C   UNL     1      -3.829   0.514  -0.511  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.911   1.454  -0.974  1.00  0.00           C  
HETATM   28  H   UNL     1       4.346   1.463   1.097  1.00  0.00           H  
HETATM   29  H   UNL     1       4.894   1.939  -0.508  1.00  0.00           H  
HETATM   30  H   UNL     1       5.887  -0.100  -0.242  1.00  0.00           H  
HETATM   31  H   UNL     1       1.989  -3.230   0.250  1.00  0.00           H  
HETATM   32  H   UNL     1       0.205   0.496  -0.421  1.00  0.00           H  
HETATM   33  H   UNL     1       2.820   1.679  -1.450  1.00  0.00           H  
HETATM   34  H   UNL     1       1.469   1.816   1.155  1.00  0.00           H  
HETATM   35  H   UNL     1       2.853   2.907   1.049  1.00  0.00           H  
HETATM   36  H   UNL     1       1.856   4.040  -0.963  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.416   4.231  -0.974  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.448   1.727   0.821  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.782   4.388   1.458  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.986   2.881   2.382  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.398   3.683   2.327  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.696   3.046  -0.706  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.215  -4.110   0.667  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.561  -4.880   0.730  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.401  -3.372   0.267  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.454   1.837  -0.110  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.461   2.285  -1.518  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.600   0.921  -1.630  1.00  0.00           H  
CONECT    1    2   10   28   29                                       
CONECT    2    3    1   30                                            
CONECT    3    4    4    5    2                                       
CONECT    4    3    3                                                 
CONECT    5    6    3    9    9                                       
CONECT    6    5    7    7   31                                       
CONECT    7    6    6   20    8                                       
CONECT    8    7    9   32                                            
CONECT    9    5    5    8   10                                       
CONECT   10    9    1   11   33                                       
CONECT   11   10   12   34   35                                       
CONECT   12   11   13   13   36                                       
CONECT   13   12   12   14   37                                       
CONECT   14   16   13   15   38                                       
CONECT   15   14   39   40   41                                       
CONECT   16   17   14   42                                            
CONECT   17   18   18   26   16                                       
CONECT   18   19   17   17                                            
CONECT   19   20   20   24   18                                       
CONECT   20   21    7   19   19                                       
CONECT   21   22   22   20   43                                       
CONECT   22   21   21   23   44                                       
CONECT   23   22   24   24   45                                       
CONECT   24   23   23   19   25                                       
CONECT   25   24   26   26                                            
CONECT   26   25   25   17   27                                       
CONECT   27   26   46   47   48                                       
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    6                                                      
CONECT   32    8                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   27                                                      
CONECT   47   27                                                      
CONECT   48   27                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
