COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.327   1.108  -0.268  1.00  0.00           C  
HETATM    2  C   UNL     1       1.296   2.862  -0.005  1.00  0.00           C  
HETATM    3  C   UNL     1       2.304   1.998   0.753  1.00  0.00           C  
HETATM    4  C   UNL     1       3.300   1.365  -0.223  1.00  0.00           C  
HETATM    5  C   UNL     1       4.039   0.220   0.466  1.00  0.00           C  
HETATM    6  C   UNL     1       3.630  -1.091  -0.154  1.00  0.00           C  
HETATM    7  C   UNL     1       2.849  -2.096   0.655  1.00  0.00           C  
HETATM    8  C   UNL     1       1.994  -2.950  -0.280  1.00  0.00           C  
HETATM    9  C   UNL     1       0.910  -3.670   0.523  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.415  -2.975   0.308  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.459  -1.655   0.287  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.947  -1.540   0.104  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.115  -0.793  -0.003  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.052   0.587  -0.142  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.826   1.228  -0.214  1.00  0.00           C  
HETATM   16  C   UNL     1       1.392   4.311   0.482  1.00  0.00           C  
HETATM   17  N   UNL     1      -0.066   2.340   0.252  1.00  0.00           N  
HETATM   18  O   UNL     1       0.570   0.518  -0.834  1.00  0.00           O  
HETATM   19  O   UNL     1       3.929  -1.339  -1.298  1.00  0.00           O  
HETATM   20  O   UNL     1      -5.320  -1.416   0.027  1.00  0.00           O  
HETATM   21  O   UNL     1      -2.786   2.576  -0.370  1.00  0.00           O  
HETATM   22  C   UNL     1      -1.716  -0.908   0.087  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.646   0.489  -0.132  1.00  0.00           C  
HETATM   24  H   UNL     1       1.508   2.822  -1.074  1.00  0.00           H  
HETATM   25  H   UNL     1       2.846   2.618   1.467  1.00  0.00           H  
HETATM   26  H   UNL     1       1.776   1.211   1.291  1.00  0.00           H  
HETATM   27  H   UNL     1       2.766   0.983  -1.092  1.00  0.00           H  
HETATM   28  H   UNL     1       4.019   2.118  -0.546  1.00  0.00           H  
HETATM   29  H   UNL     1       5.114   0.358   0.346  1.00  0.00           H  
HETATM   30  H   UNL     1       3.790   0.213   1.527  1.00  0.00           H  
HETATM   31  H   UNL     1       3.539  -2.737   1.204  1.00  0.00           H  
HETATM   32  H   UNL     1       2.205  -1.572   1.360  1.00  0.00           H  
HETATM   33  H   UNL     1       1.530  -2.313  -1.032  1.00  0.00           H  
HETATM   34  H   UNL     1       2.627  -3.687  -0.775  1.00  0.00           H  
HETATM   35  H   UNL     1       0.835  -4.705   0.187  1.00  0.00           H  
HETATM   36  H   UNL     1       1.165  -3.649   1.582  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.310  -3.561   0.178  1.00  0.00           H  
HETATM   38  H   UNL     1       0.460  -1.096   0.444  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.005  -2.612   0.225  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.962   1.164  -0.194  1.00  0.00           H  
HETATM   41  H   UNL     1       2.397   4.690   0.298  1.00  0.00           H  
HETATM   42  H   UNL     1       0.669   4.924  -0.055  1.00  0.00           H  
HETATM   43  H   UNL     1       1.179   4.349   1.551  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.720   2.840   0.764  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.693  -1.509   0.915  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.776   3.068   0.463  1.00  0.00           H  
CONECT    1   23   17   18   18                                       
CONECT    2   16   17    3   24                                       
CONECT    3    4    2   25   26                                       
CONECT    4    5    3   27   28                                       
CONECT    5    6    4   29   30                                       
CONECT    6    7   19   19    5                                       
CONECT    7    8    6   31   32                                       
CONECT    8    7    9   33   34                                       
CONECT    9    8   10   35   36                                       
CONECT   10    9   11   11   37                                       
CONECT   11   22   10   10   38                                       
CONECT   12   13   22   22   39                                       
CONECT   13   20   12   14   14                                       
CONECT   14   13   13   15   40                                       
CONECT   15   14   23   23   21                                       
CONECT   16    2   41   42   43                                       
CONECT   17    1    2   44                                            
CONECT   18    1    1                                                 
CONECT   19    6    6                                                 
CONECT   20   13   45                                                 
CONECT   21   15   46                                                 
CONECT   22   12   12   11   23                                       
CONECT   23   22   15   15    1                                       
CONECT   24    2                                                      
CONECT   25    3                                                      
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    5                                                      
CONECT   31    7                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   14                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
