COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.147   2.408   0.002  1.00  0.00           C  
HETATM    2  C   UNL     1       4.625   0.503  -0.002  1.00  0.00           C  
HETATM    3  C   UNL     1       6.120  -1.365  -0.008  1.00  0.00           C  
HETATM    4  C   UNL     1       3.529  -0.390  -0.001  1.00  0.00           C  
HETATM    5  C   UNL     1       2.173   0.162   0.008  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.659  -0.731  -0.003  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.454   0.213  -0.004  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.496   1.091  -1.256  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.500   1.099   1.243  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.183  -0.596   0.000  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.846   0.101   0.000  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.116  -0.072   0.005  1.00  0.00           C  
HETATM   13  C   UNL     1       0.709   2.087   0.000  1.00  0.00           C  
HETATM   14  C   UNL     1       2.014   1.568   0.003  1.00  0.00           C  
HETATM   15  C   UNL     1       4.397   1.899   0.000  1.00  0.00           C  
HETATM   16  C   UNL     1       5.928  -0.015  -0.005  1.00  0.00           C  
HETATM   17  C   UNL     1       5.039  -2.240  -0.005  1.00  0.00           C  
HETATM   18  C   UNL     1       3.758  -1.768  -0.002  1.00  0.00           C  
HETATM   19  N   UNL     1      -0.305   1.245   0.001  1.00  0.00           N  
HETATM   20  N   UNL     1       1.091  -0.613   0.010  1.00  0.00           N  
HETATM   21  O   UNL     1      -4.234  -1.802   0.004  1.00  0.00           O  
HETATM   22  S   UNL     1      -1.522  -1.133   0.006  1.00  0.00           S  
HETATM   23  H   UNL     1       3.012   3.480  -0.001  1.00  0.00           H  
HETATM   24  H   UNL     1       7.125  -1.760  -0.010  1.00  0.00           H  
HETATM   25  H   UNL     1      -6.626  -1.362  -0.891  1.00  0.00           H  
HETATM   26  H   UNL     1      -6.629  -1.357   0.889  1.00  0.00           H  
HETATM   27  H   UNL     1      -7.578  -0.146  -0.006  1.00  0.00           H  
HETATM   28  H   UNL     1      -6.416   1.676  -1.259  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.638   1.764  -1.257  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.464   0.460  -2.144  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.470   0.473   2.134  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.642   1.771   1.242  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.419   1.684   1.240  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.761   0.722  -0.891  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.763   0.727   0.889  1.00  0.00           H  
HETATM   36  H   UNL     1       0.540   3.154  -0.003  1.00  0.00           H  
HETATM   37  H   UNL     1       5.242   2.572  -0.002  1.00  0.00           H  
HETATM   38  H   UNL     1       6.777   0.653  -0.007  1.00  0.00           H  
HETATM   39  H   UNL     1       5.215  -3.306  -0.004  1.00  0.00           H  
HETATM   40  H   UNL     1       2.926  -2.456  -0.002  1.00  0.00           H  
CONECT    1   15   14   14   23                                       
CONECT    2   16   15   15    4                                       
CONECT    3   16   16   17   24                                       
CONECT    4    2   18    5    5                                       
CONECT    5    4    4   14   20                                       
CONECT    6    7   25   26   27                                       
CONECT    7    8    9   10    6                                       
CONECT    8    7   28   29   30                                       
CONECT    9    7   31   32   33                                       
CONECT   10   11   21   21    7                                       
CONECT   11   22   10   34   35                                       
CONECT   12   20   20   19   22                                       
CONECT   13   14   19   19   36                                       
CONECT   14    1    1    5   13                                       
CONECT   15    2    2    1   37                                       
CONECT   16    3    3    2   38                                       
CONECT   17    3   18   18   39                                       
CONECT   18   17   17    4   40                                       
CONECT   19   13   13   12                                            
CONECT   20    5   12   12                                            
CONECT   21   10   10                                                 
CONECT   22   12   11                                                 
CONECT   23    1                                                      
CONECT   24    3                                                      
CONECT   25    6                                                      
CONECT   26    6                                                      
CONECT   27    6                                                      
CONECT   28    8                                                      
CONECT   29    8                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32    9                                                      
CONECT   33    9                                                      
CONECT   34   11                                                      
CONECT   35   11                                                      
CONECT   36   13                                                      
CONECT   37   15                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
