COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.640  -0.920   1.079  1.00  0.00           C  
HETATM    2  N   UNL     1       4.570   0.348   0.340  1.00  0.00           N  
HETATM    3  C   UNL     1       5.871   0.685  -0.253  1.00  0.00           C  
HETATM    4  C   UNL     1       3.520   0.302  -0.687  1.00  0.00           C  
HETATM    5  C   UNL     1       2.151   0.198  -0.012  1.00  0.00           C  
HETATM    6  C   UNL     1       1.058   0.150  -1.081  1.00  0.00           C  
HETATM    7  N   UNL     1      -0.253   0.050  -0.435  1.00  0.00           N  
HETATM    8  C   UNL     1      -0.915   1.235  -0.125  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.166   2.394   0.054  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.790   3.589   0.358  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.165   3.641   0.486  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.919   2.496   0.312  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.299   1.291   0.008  1.00  0.00           C  
HETATM   14  S   UNL     1      -3.281  -0.156  -0.199  1.00  0.00           S  
HETATM   15  C   UNL     1      -2.116  -1.466  -0.043  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.754  -1.224  -0.177  1.00  0.00           C  
HETATM   17  C   UNL     1       0.140  -2.282  -0.048  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.322  -3.560   0.203  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.678  -3.796   0.327  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.570  -2.754   0.213  1.00  0.00           C  
HETATM   21  H   UNL     1       5.377  -0.834   1.878  1.00  0.00           H  
HETATM   22  H   UNL     1       3.664  -1.145   1.507  1.00  0.00           H  
HETATM   23  H   UNL     1       4.932  -1.720   0.399  1.00  0.00           H  
HETATM   24  H   UNL     1       6.140  -0.069  -0.993  1.00  0.00           H  
HETATM   25  H   UNL     1       5.810   1.661  -0.734  1.00  0.00           H  
HETATM   26  H   UNL     1       6.630   0.712   0.529  1.00  0.00           H  
HETATM   27  H   UNL     1       3.561   1.210  -1.289  1.00  0.00           H  
HETATM   28  H   UNL     1       3.677  -0.566  -1.327  1.00  0.00           H  
HETATM   29  H   UNL     1       2.111  -0.710   0.590  1.00  0.00           H  
HETATM   30  H   UNL     1       1.995   1.066   0.629  1.00  0.00           H  
HETATM   31  H   UNL     1       1.098   1.057  -1.683  1.00  0.00           H  
HETATM   32  H   UNL     1       1.214  -0.718  -1.722  1.00  0.00           H  
HETATM   33  H   UNL     1       0.909   2.359  -0.045  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.201   4.484   0.495  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.650   4.577   0.723  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.993   2.538   0.414  1.00  0.00           H  
HETATM   37  H   UNL     1       1.201  -2.103  -0.144  1.00  0.00           H  
HETATM   38  H   UNL     1       0.379  -4.376   0.301  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.036  -4.796   0.521  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.629  -2.941   0.311  1.00  0.00           H  
CONECT    1    2   21   22   23                                       
CONECT    2    1    3    4                                            
CONECT    3    2   24   25   26                                       
CONECT    4    2    5   27   28                                       
CONECT    5    4    6   29   30                                       
CONECT    6    5    7   31   32                                       
CONECT    7    6   16    8                                            
CONECT    8    7   13   13    9                                       
CONECT    9    8   10   10   33                                       
CONECT   10    9    9   11   34                                       
CONECT   11   12   12   10   35                                       
CONECT   12   13   11   11   36                                       
CONECT   13   14    8    8   12                                       
CONECT   14   15   13                                                 
CONECT   15   16   16   20   14                                       
CONECT   16   17    7   15   15                                       
CONECT   17   18   18   16   37                                       
CONECT   18   17   17   19   38                                       
CONECT   19   18   20   20   39                                       
CONECT   20   19   19   15   40                                       
CONECT   21    1                                                      
CONECT   22    1                                                      
CONECT   23    1                                                      
CONECT   24    3                                                      
CONECT   25    3                                                      
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   17                                                      
CONECT   38   18                                                      
CONECT   39   19                                                      
CONECT   40   20                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
