COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.318   0.884  -0.858  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.005  -0.471  -0.936  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.312   1.831  -0.680  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.998   0.787   2.431  1.00  0.00           C  
HETATM    5  C   UNL     1      -8.017  -0.595   2.526  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.378   1.400   1.361  1.00  0.00           C  
HETATM    7  C   UNL     1      -7.411  -1.365   1.564  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.777  -0.764   0.467  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.769   0.633   0.376  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.133  -1.606  -0.532  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.678  -0.867  -0.835  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.996   1.439  -0.580  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.670   0.082  -0.657  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.263  -0.346  -0.550  1.00  0.00           C  
HETATM   15  C   UNL     1       2.107   0.146  -0.271  1.00  0.00           C  
HETATM   16  C   UNL     1       3.001   1.373  -0.082  1.00  0.00           C  
HETATM   17  C   UNL     1       4.439   0.935   0.027  1.00  0.00           C  
HETATM   18  C   UNL     1       5.218   0.830  -1.110  1.00  0.00           C  
HETATM   19  C   UNL     1       6.537   0.428  -1.009  1.00  0.00           C  
HETATM   20  C   UNL     1       4.980   0.644   1.265  1.00  0.00           C  
HETATM   21  C   UNL     1       7.076   0.131   0.228  1.00  0.00           C  
HETATM   22  C   UNL     1       6.299   0.243   1.366  1.00  0.00           C  
HETATM   23  N   UNL     1      -4.974  -1.450  -1.113  1.00  0.00           N  
HETATM   24  N   UNL     1       0.709   0.571  -0.378  1.00  0.00           N  
HETATM   25  N   UNL     1       8.778  -2.032   0.235  1.00  0.00           N  
HETATM   26  O   UNL     1      -6.765  -2.585  -0.880  1.00  0.00           O  
HETATM   27  O   UNL     1       0.020  -1.527  -0.616  1.00  0.00           O  
HETATM   28  O   UNL     1       9.417   0.116  -0.801  1.00  0.00           O  
HETATM   29  O   UNL     1       9.172  -0.070   1.679  1.00  0.00           O  
HETATM   30  S   UNL     1      -5.990   1.424  -0.991  1.00  0.00           S  
HETATM   31  S   UNL     1       8.758  -0.380   0.356  1.00  0.00           S  
HETATM   32  H   UNL     1      -3.566   2.879  -0.621  1.00  0.00           H  
HETATM   33  H   UNL     1      -8.470   1.386   3.195  1.00  0.00           H  
HETATM   34  H   UNL     1      -8.507  -1.069   3.363  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.367   2.477   1.290  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.429  -2.442   1.646  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.425  -1.915  -0.894  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.220   2.177  -0.443  1.00  0.00           H  
HETATM   39  H   UNL     1       2.398  -0.379  -1.182  1.00  0.00           H  
HETATM   40  H   UNL     1       2.220  -0.521   0.584  1.00  0.00           H  
HETATM   41  H   UNL     1       2.888   2.040  -0.937  1.00  0.00           H  
HETATM   42  H   UNL     1       2.711   1.897   0.828  1.00  0.00           H  
HETATM   43  H   UNL     1       4.796   1.062  -2.077  1.00  0.00           H  
HETATM   44  H   UNL     1       7.145   0.346  -1.898  1.00  0.00           H  
HETATM   45  H   UNL     1       4.373   0.730   2.154  1.00  0.00           H  
HETATM   46  H   UNL     1       6.721   0.011   2.333  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.755  -2.125  -1.774  1.00  0.00           H  
HETATM   48  H   UNL     1       0.484   1.513  -0.324  1.00  0.00           H  
HETATM   49  H   UNL     1       9.620  -2.511   0.282  1.00  0.00           H  
HETATM   50  H   UNL     1       7.949  -2.520   0.116  1.00  0.00           H  
CONECT    1    3   30    2    2                                       
CONECT    2    1    1   11   23                                       
CONECT    3   12   12    1   32                                       
CONECT    4    6    6    5   33                                       
CONECT    5    4    7    7   34                                       
CONECT    6    4    4    9   35                                       
CONECT    7    5    5    8   36                                       
CONECT    8    9    9    7   10                                       
CONECT    9    6   30    8    8                                       
CONECT   10    8   23   26   26                                       
CONECT   11   13   13    2   37                                       
CONECT   12    3    3   13   38                                       
CONECT   13   12   14   11   11                                       
CONECT   14   24   13   27   27                                       
CONECT   15   16   24   39   40                                       
CONECT   16   17   15   41   42                                       
CONECT   17   20   20   18   16                                       
CONECT   18   19   19   17   43                                       
CONECT   19   21   18   18   44                                       
CONECT   20   22   17   17   45                                       
CONECT   21   31   22   22   19                                       
CONECT   22   21   21   20   46                                       
CONECT   23    2   10   47                                            
CONECT   24   15   14   48                                            
CONECT   25   31   49   50                                            
CONECT   26   10   10                                                 
CONECT   27   14   14                                                 
CONECT   28   31   31                                                 
CONECT   29   31   31                                                 
CONECT   30    9    1                                                 
CONECT   31   25   28   28   29                                       
CONECT   31   29   21                                                 
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
