COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1      -1.726   0.711   2.130  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.765   1.402   1.407  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.784   1.394   0.023  1.00  0.00           C  
HETATM    4  O   UNL     1       1.652   2.659   1.210  1.00  0.00           O  
HETATM    5  O   UNL     1       2.506   2.820  -1.134  1.00  0.00           O  
HETATM    6  C   UNL     1       2.347   0.526  -0.017  1.00  0.00           C  
HETATM    7  C   UNL     1       2.170  -0.201   1.145  1.00  0.00           C  
HETATM    8  C   UNL     1       2.640  -1.499   1.227  1.00  0.00           C  
HETATM    9  C   UNL     1       3.287  -2.069   0.147  1.00  0.00           C  
HETATM   10  C   UNL     1       3.463  -1.342  -1.016  1.00  0.00           C  
HETATM   11  C   UNL     1       2.993  -0.045  -1.098  1.00  0.00           C  
HETATM   12  C   UNL     1       3.801  -3.483   0.236  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.157  -0.294  -2.135  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.781   0.684  -0.653  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.749  -0.011   0.084  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.715   0.007   1.479  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.753  -0.746   2.270  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.637  -0.643  -0.908  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.781  -1.461  -0.637  1.00  0.00           C  
HETATM   20  N   UNL     1      -5.688  -2.111  -0.422  1.00  0.00           N  
HETATM   21  N   UNL     1      -2.059   0.491  -1.991  1.00  0.00           N  
HETATM   22  N   UNL     1       0.189   2.094  -0.696  1.00  0.00           N  
HETATM   23  N   UNL     1       2.756  -4.413  -0.212  1.00  0.00           N  
HETATM   24  S   UNL     1       1.741   2.177  -0.124  1.00  0.00           S  
HETATM   25  H   UNL     1      -1.697   0.722   3.209  1.00  0.00           H  
HETATM   26  H   UNL     1       0.006   1.950   1.928  1.00  0.00           H  
HETATM   27  H   UNL     1       1.664   0.244   1.989  1.00  0.00           H  
HETATM   28  H   UNL     1       2.503  -2.066   2.135  1.00  0.00           H  
HETATM   29  H   UNL     1       3.969  -1.788  -1.860  1.00  0.00           H  
HETATM   30  H   UNL     1       3.128   0.522  -2.007  1.00  0.00           H  
HETATM   31  H   UNL     1       4.681  -3.591  -0.399  1.00  0.00           H  
HETATM   32  H   UNL     1       4.069  -3.707   1.269  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.585  -0.596  -3.080  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.603  -0.093   2.469  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.086  -1.612   1.700  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.320  -1.076   3.214  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.544   0.862  -2.724  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.045   2.530  -1.530  1.00  0.00           H  
HETATM   39  H   UNL     1       2.445  -4.185  -1.144  1.00  0.00           H  
HETATM   40  H   UNL     1       3.077  -5.368  -0.161  1.00  0.00           H  
CONECT    1    2   16   16   25                                       
CONECT    2    3    3    1   26                                       
CONECT    3   22    2    2   14                                       
CONECT    4   24   24                                                 
CONECT    5   24   24                                                 
CONECT    6    7    7   11   24                                       
CONECT    7    8    6    6   27                                       
CONECT    8    9    9    7   28                                       
CONECT    9   12    8    8   10                                       
CONECT   10    9   11   11   29                                       
CONECT   11   10   10    6   30                                       
CONECT   12   23    9   31   32                                       
CONECT   13   21   18   18   33                                       
CONECT   14    3   21   15   15                                       
CONECT   15   14   14   16   18                                       
CONECT   16    1    1   15   17                                       
CONECT   17   16   34   35   36                                       
CONECT   18   15   13   13   19                                       
CONECT   19   18   20   20   20                                       
CONECT   20   19   19   19                                            
CONECT   21   14   13   37                                            
CONECT   22   24    3   38                                            
CONECT   23   12   39   40                                            
CONECT   24    5    5    6    4                                       
CONECT   24    4   22                                                 
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    7                                                      
CONECT   28    8                                                      
CONECT   29   10                                                      
CONECT   30   11                                                      
CONECT   31   12                                                      
CONECT   32   12                                                      
CONECT   33   13                                                      
CONECT   34   17                                                      
CONECT   35   17                                                      
CONECT   36   17                                                      
CONECT   37   21                                                      
CONECT   38   22                                                      
CONECT   39   23                                                      
CONECT   40   23                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
