COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.090   0.712  -0.331  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.053  -1.544  -0.156  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.300  -3.575  -1.185  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.673  -2.282   0.843  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.421  -1.579   1.946  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.845  -5.813  -0.205  1.00  0.00           C  
HETATM    7  C   UNL     1       6.694  -0.628  -0.704  1.00  0.00           C  
HETATM    8  C   UNL     1       3.595   0.727   0.969  1.00  0.00           C  
HETATM    9  C   UNL     1       4.914   0.417   0.710  1.00  0.00           C  
HETATM   10  C   UNL     1       5.251  -0.294  -0.428  1.00  0.00           C  
HETATM   11  C   UNL     1       4.268  -0.698  -1.314  1.00  0.00           C  
HETATM   12  C   UNL     1       2.945  -0.396  -1.067  1.00  0.00           C  
HETATM   13  C   UNL     1       2.598   0.317   0.082  1.00  0.00           C  
HETATM   14  C   UNL     1       1.183   0.645   0.352  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.589   1.990  -0.241  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.949   1.900   0.006  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.365  -2.196  -1.171  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.918  -4.307  -0.188  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.604  -3.662   0.824  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.682   3.227   0.138  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.032   3.403  -0.342  1.00  0.00           C  
HETATM   22  C   UNL     1       5.991   0.854   1.670  1.00  0.00           C  
HETATM   23  N   UNL     1       0.238   0.360  -0.566  1.00  0.00           N  
HETATM   24  N   UNL     1      -3.276   0.618   0.065  1.00  0.00           N  
HETATM   25  N   UNL     1      -2.125  -0.145  -0.143  1.00  0.00           N  
HETATM   26  O   UNL     1       0.871   1.173   1.402  1.00  0.00           O  
HETATM   27  S   UNL     1      -2.524   4.431  -0.615  1.00  0.00           S  
HETATM   28  H   UNL     1      -0.765  -4.082  -1.974  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.459  -1.437   1.648  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.383  -2.183   2.853  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.961  -0.609   2.136  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.966  -6.140   0.351  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.742  -6.225   0.257  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.774  -6.161  -1.235  1.00  0.00           H  
HETATM   35  H   UNL     1       6.937  -1.589  -0.251  1.00  0.00           H  
HETATM   36  H   UNL     1       6.855  -0.682  -1.780  1.00  0.00           H  
HETATM   37  H   UNL     1       7.334   0.146  -0.279  1.00  0.00           H  
HETATM   38  H   UNL     1       3.333   1.282   1.858  1.00  0.00           H  
HETATM   39  H   UNL     1       4.538  -1.250  -2.203  1.00  0.00           H  
HETATM   40  H   UNL     1       2.180  -0.712  -1.760  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.882  -1.624  -1.950  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.086  -4.236   1.601  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.622   3.203  -0.412  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.859   3.465   1.187  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.534   3.687   0.586  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.348   3.487  -1.186  1.00  0.00           H  
HETATM   47  H   UNL     1       6.145   0.079   2.420  1.00  0.00           H  
HETATM   48  H   UNL     1       6.919   1.021   1.123  1.00  0.00           H  
HETATM   49  H   UNL     1       5.687   1.779   2.160  1.00  0.00           H  
HETATM   50  H   UNL     1       0.482  -0.090  -1.390  1.00  0.00           H  
CONECT    1   23   15   15   25                                       
CONECT    2   25    4    4   17                                       
CONECT    3   17   17   18   28                                       
CONECT    4    5    2    2   19                                       
CONECT    5    4   29   30   31                                       
CONECT    6   18   32   33   34                                       
CONECT    7   10   35   36   37                                       
CONECT    8   13   13    9   38                                       
CONECT    9   10   10    8   22                                       
CONECT   10   11    7    9    9                                       
CONECT   11   12   12   10   39                                       
CONECT   12   11   11   13   40                                       
CONECT   13   12   14    8    8                                       
CONECT   14   26   26   13   23                                       
CONECT   15   21    1    1   16                                       
CONECT   16   15   20   24   24                                       
CONECT   17    2    3    3   41                                       
CONECT   18   19   19    3    6                                       
CONECT   19    4   18   18   42                                       
CONECT   20   27   16   43   44                                       
CONECT   21   27   15   45   46                                       
CONECT   22    9   47   48   49                                       
CONECT   23   14    1   50                                            
CONECT   24   16   16   25                                            
CONECT   25    1   24    2                                            
CONECT   26   14   14                                                 
CONECT   27   21   20                                                 
CONECT   28    3                                                      
CONECT   29    5                                                      
CONECT   30    5                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   17                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
