COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.643   0.000  -2.690  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.091  -0.005  -3.894  1.00  0.00           C  
HETATM    3  C   UNL     1       0.587  -0.002  -5.112  1.00  0.00           C  
HETATM    4  C   UNL     1       1.967  -0.008  -5.134  1.00  0.00           C  
HETATM    5  C   UNL     1       2.688  -0.010  -3.952  1.00  0.00           C  
HETATM    6  C   UNL     1       2.038  -0.006  -2.735  1.00  0.00           C  
HETATM    7  C   UNL     1       0.021   0.005   0.808  1.00  0.00           C  
HETATM    8  C   UNL     1       0.752   0.003   2.001  1.00  0.00           C  
HETATM    9  C   UNL     1       0.093   0.007   3.210  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.296   0.007   3.246  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.027   0.015   2.063  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.377   0.011   0.850  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.565   0.001  -3.865  1.00  0.00           C  
HETATM   14  C   UNL     1       0.879   0.005   4.496  1.00  0.00           C  
HETATM   15  C   UNL     1       2.376  -0.001   4.178  1.00  0.00           C  
HETATM   16  C   UNL     1       0.524  -1.241   5.308  1.00  0.00           C  
HETATM   17  C   UNL     1       0.535   1.257   5.305  1.00  0.00           C  
HETATM   18  N   UNL     1      -0.006   0.002  -1.489  1.00  0.00           N  
HETATM   19  N   UNL     1       0.670   0.001  -0.391  1.00  0.00           N  
HETATM   20  O   UNL     1      -2.152  -0.001  -2.801  1.00  0.00           O  
HETATM   21  O   UNL     1      -2.262   0.010  -5.018  1.00  0.00           O  
HETATM   22  O   UNL     1      -1.941   0.011   4.440  1.00  0.00           O  
HETATM   23  H   UNL     1       0.032   0.000  -6.039  1.00  0.00           H  
HETATM   24  H   UNL     1       2.488  -0.010  -6.080  1.00  0.00           H  
HETATM   25  H   UNL     1       3.768  -0.014  -3.982  1.00  0.00           H  
HETATM   26  H   UNL     1       2.608  -0.007  -1.817  1.00  0.00           H  
HETATM   27  H   UNL     1       1.832  -0.001   1.974  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.106   0.020   2.097  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.946   0.012  -0.067  1.00  0.00           H  
HETATM   30  H   UNL     1       2.944  -0.002   5.108  1.00  0.00           H  
HETATM   31  H   UNL     1       2.621  -0.892   3.601  1.00  0.00           H  
HETATM   32  H   UNL     1       2.628   0.887   3.599  1.00  0.00           H  
HETATM   33  H   UNL     1       0.769  -2.132   4.732  1.00  0.00           H  
HETATM   34  H   UNL     1       1.093  -1.242   6.238  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.541  -1.236   5.534  1.00  0.00           H  
HETATM   36  H   UNL     1       0.788   2.145   4.726  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.530   1.262   5.531  1.00  0.00           H  
HETATM   38  H   UNL     1       1.103   1.256   6.235  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.229   0.014  -4.999  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.082  -0.913   4.685  1.00  0.00           H  
CONECT    1    2    6    6   18                                       
CONECT    2    1    3    3   13                                       
CONECT    3    2    2    4   23                                       
CONECT    4    3    5    5   24                                       
CONECT    5    4    4    6   25                                       
CONECT    6    1    1    5   26                                       
CONECT    7    8   12   12   19                                       
CONECT    8    7    9    9   27                                       
CONECT    9    8    8   10   14                                       
CONECT   10    9   11   11   22                                       
CONECT   11   10   10   12   28                                       
CONECT   12    7    7   11   29                                       
CONECT   13    2   20   20   21                                       
CONECT   14    9   15   16   17                                       
CONECT   15   14   30   31   32                                       
CONECT   16   14   33   34   35                                       
CONECT   17   14   36   37   38                                       
CONECT   18    1   19   19                                            
CONECT   19    7   18   18                                            
CONECT   20   13   13                                                 
CONECT   21   13   39                                                 
CONECT   22   10   40                                                 
CONECT   23    3                                                      
CONECT   24    4                                                      
CONECT   25    5                                                      
CONECT   26    6                                                      
CONECT   27    8                                                      
CONECT   28   11                                                      
CONECT   29   12                                                      
CONECT   30   15                                                      
CONECT   31   15                                                      
CONECT   32   15                                                      
CONECT   33   16                                                      
CONECT   34   16                                                      
CONECT   35   16                                                      
CONECT   36   17                                                      
CONECT   37   17                                                      
CONECT   38   17                                                      
CONECT   39   21                                                      
CONECT   40   22                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
