COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.919   2.897  -0.465  1.00  0.00           O  
HETATM    2  C   UNL     1       0.988   2.122  -0.419  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.337   2.567   0.146  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.236   4.027   0.592  1.00  0.00           C  
HETATM    5  N   UNL     1       1.135   0.863  -0.878  1.00  0.00           N  
HETATM    6  C   UNL     1       2.421   0.432  -1.433  1.00  0.00           C  
HETATM    7  C   UNL     1       3.278  -0.138  -0.331  1.00  0.00           C  
HETATM    8  O   UNL     1       4.141   0.534   0.443  1.00  0.00           O  
HETATM    9  N   UNL     1       4.684  -0.195   1.240  1.00  0.00           N  
HETATM   10  C   UNL     1       4.275  -1.425   1.120  1.00  0.00           C  
HETATM   11  C   UNL     1       4.723  -2.609   1.938  1.00  0.00           C  
HETATM   12  C   UNL     1       3.322  -1.429   0.075  1.00  0.00           C  
HETATM   13  C   UNL     1       0.069  -0.026  -0.825  1.00  0.00           C  
HETATM   14  S   UNL     1       0.106  -1.696  -1.382  1.00  0.00           S  
HETATM   15  C   UNL     1      -1.578  -1.894  -0.905  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.008  -0.729  -0.387  1.00  0.00           C  
HETATM   17  N   UNL     1      -1.108   0.244  -0.352  1.00  0.00           N  
HETATM   18  C   UNL     1      -3.391  -0.548   0.117  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.788   0.679   0.646  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.076   0.842   1.112  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.973  -0.210   1.057  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.585  -1.430   0.534  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.300  -1.603   0.059  1.00  0.00           C  
HETATM   24  H   UNL     1      -1.108   2.473  -0.619  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.595   1.943   1.001  1.00  0.00           H  
HETATM   26  H   UNL     1       0.535   4.121   1.357  1.00  0.00           H  
HETATM   27  H   UNL     1       0.023   4.651  -0.263  1.00  0.00           H  
HETATM   28  H   UNL     1       2.251  -0.331  -2.193  1.00  0.00           H  
HETATM   29  H   UNL     1       2.928   1.286  -1.882  1.00  0.00           H  
HETATM   30  H   UNL     1       4.081  -2.711   2.812  1.00  0.00           H  
HETATM   31  H   UNL     1       4.659  -3.514   1.332  1.00  0.00           H  
HETATM   32  H   UNL     1       5.754  -2.460   2.259  1.00  0.00           H  
HETATM   33  H   UNL     1       2.764  -2.268  -0.312  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.165  -2.794  -1.011  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.089   1.501   0.689  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.385   1.793   1.522  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.980  -0.078   1.425  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.289  -2.248   0.494  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.998  -2.556  -0.349  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.194   4.349   1.000  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    5    1    1                                       
CONECT    3    4    2   24   25                                       
CONECT    4    3   26   27   40                                       
CONECT    5    6    2   13                                            
CONECT    6    7    5   28   29                                       
CONECT    7   12   12    6    8                                       
CONECT    8    7    9                                                 
CONECT    9   10   10    8                                            
CONECT   10   11   12    9    9                                       
CONECT   11   10   30   31   32                                       
CONECT   12   10    7    7   33                                       
CONECT   13    5   17   17   14                                       
CONECT   14   13   15                                                 
CONECT   15   16   16   14   34                                       
CONECT   16   17   18   15   15                                       
CONECT   17   13   13   16                                            
CONECT   18   23   16   19   19                                       
CONECT   19   18   18   20   35                                       
CONECT   20   21   21   19   36                                       
CONECT   21   22   20   20   37                                       
CONECT   22   23   23   21   38                                       
CONECT   23   22   22   18   39                                       
CONECT   24    3                                                      
CONECT   25    3                                                      
CONECT   26    4                                                      
CONECT   27    4                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30   11                                                      
CONECT   31   11                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   15                                                      
CONECT   35   19                                                      
CONECT   36   20                                                      
CONECT   37   21                                                      
CONECT   38   22                                                      
CONECT   39   23                                                      
CONECT   40    4                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
