COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.122   2.519   0.159  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.952   0.272   0.004  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.188   1.634   0.051  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.827   2.053   0.216  1.00  0.00           C  
HETATM    5  C   UNL     1       4.254   0.251  -0.663  1.00  0.00           C  
HETATM    6  C   UNL     1       4.377   0.153  -3.036  1.00  0.00           C  
HETATM    7  C   UNL     1       5.455  -0.440  -0.630  1.00  0.00           C  
HETATM    8  C   UNL     1       3.638   0.627   0.522  1.00  0.00           C  
HETATM    9  C   UNL     1       2.335   1.383   0.486  1.00  0.00           C  
HETATM   10  C   UNL     1       4.217   0.307   1.735  1.00  0.00           C  
HETATM   11  C   UNL     1       5.411  -0.387   1.771  1.00  0.00           C  
HETATM   12  C   UNL     1       6.035  -0.759   0.589  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.816  -0.922  -0.106  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.733  -1.682  -0.025  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.628  -0.215   0.056  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.566   0.681   0.164  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.149   1.162   0.330  1.00  0.00           C  
HETATM   18  C   UNL     1       1.173   0.394   0.367  1.00  0.00           C  
HETATM   19  N   UNL     1      -5.033  -2.016  -0.106  1.00  0.00           N  
HETATM   20  N   UNL     1      -1.261   0.215   0.216  1.00  0.00           N  
HETATM   21  O   UNL     1      -7.028  -0.916  -0.184  1.00  0.00           O  
HETATM   22  O   UNL     1       7.209  -1.442   0.625  1.00  0.00           O  
HETATM   23  O   UNL     1       3.684   0.565  -1.856  1.00  0.00           O  
HETATM   24  O   UNL     1      -2.800  -2.461  -0.010  1.00  0.00           O  
HETATM   25  H   UNL     1      -4.310   3.582   0.195  1.00  0.00           H  
HETATM   26  H   UNL     1      -6.199   2.010   0.004  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.008   2.752   0.300  1.00  0.00           H  
HETATM   28  H   UNL     1       5.366   0.610  -3.054  1.00  0.00           H  
HETATM   29  H   UNL     1       4.478  -0.933  -3.037  1.00  0.00           H  
HETATM   30  H   UNL     1       3.815   0.466  -3.915  1.00  0.00           H  
HETATM   31  H   UNL     1       5.939  -0.729  -1.551  1.00  0.00           H  
HETATM   32  H   UNL     1       2.226   1.962   1.403  1.00  0.00           H  
HETATM   33  H   UNL     1       2.329   2.056  -0.372  1.00  0.00           H  
HETATM   34  H   UNL     1       3.736   0.600   2.656  1.00  0.00           H  
HETATM   35  H   UNL     1       5.863  -0.635   2.720  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.258   1.742   1.247  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.155   1.835  -0.528  1.00  0.00           H  
HETATM   38  H   UNL     1       1.283  -0.185  -0.550  1.00  0.00           H  
HETATM   39  H   UNL     1       1.179  -0.278   1.224  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.363  -2.927  -0.169  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.084  -0.738   0.176  1.00  0.00           H  
HETATM   42  H   UNL     1       7.105  -2.403   0.642  1.00  0.00           H  
CONECT    1    4    4    3   25                                       
CONECT    2   15   13    3    3                                       
CONECT    3    2    2    1   26                                       
CONECT    4   16    1    1   27                                       
CONECT    5    7    7    8   23                                       
CONECT    6   23   28   29   30                                       
CONECT    7   12    5    5   31                                       
CONECT    8   10   10    5    9                                       
CONECT    9    8   18   32   33                                       
CONECT   10   11    8    8   34                                       
CONECT   11   12   12   10   35                                       
CONECT   12   22   11   11    7                                       
CONECT   13   19    2   21   21                                       
CONECT   14   24   24   15   19                                       
CONECT   15   16   16   14    2                                       
CONECT   16   20   15   15    4                                       
CONECT   17   18   20   36   37                                       
CONECT   18    9   17   38   39                                       
CONECT   19   14   13   40                                            
CONECT   20   17   16   41                                            
CONECT   21   13   13                                                 
CONECT   22   12   42                                                 
CONECT   23    5    6                                                 
CONECT   24   14   14                                                 
CONECT   25    1                                                      
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    9                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   17                                                      
CONECT   37   17                                                      
CONECT   38   18                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   22                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
