COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.303   2.535   0.024  1.00  0.00           C  
HETATM    2  C   UNL     1       4.095  -0.409   0.287  1.00  0.00           C  
HETATM    3  C   UNL     1       6.338  -0.410   0.789  1.00  0.00           C  
HETATM    4  C   UNL     1       5.407  -2.429   0.168  1.00  0.00           C  
HETATM    5  C   UNL     1       4.165  -1.788   0.024  1.00  0.00           C  
HETATM    6  C   UNL     1       2.112  -1.171  -0.302  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.477  -3.023   0.408  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.717  -4.221  -0.248  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.205  -4.218  -1.539  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.458  -3.021  -2.190  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.226  -1.821  -1.554  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.737  -1.810  -0.245  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.486  -0.529   0.442  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.181   2.468  -0.341  1.00  0.00           C  
HETATM   15  C   UNL     1       1.141   2.946  -1.206  1.00  0.00           C  
HETATM   16  C   UNL     1       2.435   2.112  -1.074  1.00  0.00           C  
HETATM   17  C   UNL     1       2.225   1.295   0.220  1.00  0.00           C  
HETATM   18  N   UNL     1      -3.727   0.635  -0.192  1.00  0.00           N  
HETATM   19  N   UNL     1       2.789  -0.049   0.072  1.00  0.00           N  
HETATM   20  N   UNL     1       5.196   0.233   0.663  1.00  0.00           N  
HETATM   21  N   UNL     1       6.453  -1.704   0.553  1.00  0.00           N  
HETATM   22  N   UNL     1       5.537  -3.785  -0.076  1.00  0.00           N  
HETATM   23  N   UNL     1       2.921  -2.190  -0.330  1.00  0.00           N  
HETATM   24  O   UNL     1      -2.997  -3.024   1.677  1.00  0.00           O  
HETATM   25  O   UNL     1      -1.947   2.165   0.827  1.00  0.00           O  
HETATM   26  O   UNL     1       1.440   4.343  -1.164  1.00  0.00           O  
HETATM   27  O   UNL     1       3.573   2.967  -0.947  1.00  0.00           O  
HETATM   28  O   UNL     1       0.791   1.224   0.386  1.00  0.00           O  
HETATM   29  O   UNL     1      -3.761   3.097  -0.354  1.00  0.00           O  
HETATM   30  O   UNL     1      -4.058   1.970   1.857  1.00  0.00           O  
HETATM   31  O   UNL     1      -3.060  -0.523   1.581  1.00  0.00           O  
HETATM   32  S   UNL     1      -3.445   2.073   0.579  1.00  0.00           S  
HETATM   33  H   UNL     1       0.460   3.237   0.843  1.00  0.00           H  
HETATM   34  H   UNL     1       7.213   0.141   1.100  1.00  0.00           H  
HETATM   35  H   UNL     1       1.059  -1.209  -0.541  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.521  -5.158   0.252  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.390  -5.154  -2.046  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.839  -3.029  -3.201  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.424  -0.891  -2.065  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.500   3.429  -0.745  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.337   1.690  -1.089  1.00  0.00           H  
HETATM   42  H   UNL     1       0.616   2.696  -2.127  1.00  0.00           H  
HETATM   43  H   UNL     1       2.549   1.448  -1.931  1.00  0.00           H  
HETATM   44  H   UNL     1       2.678   1.807   1.070  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.067   0.630  -1.101  1.00  0.00           H  
HETATM   46  H   UNL     1       4.765  -4.304  -0.350  1.00  0.00           H  
HETATM   47  H   UNL     1       6.400  -4.216   0.027  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.032  -3.020   1.733  1.00  0.00           H  
HETATM   49  H   UNL     1       1.965   4.656  -1.913  1.00  0.00           H  
HETATM   50  H   UNL     1       3.752   3.503  -1.732  1.00  0.00           H  
CONECT    1   28   15   14   33                                       
CONECT    2   20   20    5   19                                       
CONECT    3   21   21   20   34                                       
CONECT    4   21   22    5    5                                       
CONECT    5    4    4    2   23                                       
CONECT    6   19   23   23   35                                       
CONECT    7   12   12    8   24                                       
CONECT    8    9    9    7   36                                       
CONECT    9   10    8    8   37                                       
CONECT   10   11   11    9   38                                       
CONECT   11   10   10   12   39                                       
CONECT   12   11   13    7    7                                       
CONECT   13   31   31   12   18                                       
CONECT   14    1   25   40   41                                       
CONECT   15   16   26    1   42                                       
CONECT   16   27   17   15   43                                       
CONECT   17   19   16   28   44                                       
CONECT   18   13   32   45                                            
CONECT   19    2   17    6                                            
CONECT   20    3    2    2                                            
CONECT   21    3    3    4                                            
CONECT   22    4   46   47                                            
CONECT   23    5    6    6                                            
CONECT   24    7   48                                                 
CONECT   25   14   32                                                 
CONECT   26   15   49                                                 
CONECT   27   16   50                                                 
CONECT   28   17    1                                                 
CONECT   29   32   32                                                 
CONECT   30   32   32                                                 
CONECT   31   13   13                                                 
CONECT   32   25   18   29   29                                       
CONECT   32   30   30                                                 
CONECT   33    1                                                      
CONECT   34    3                                                      
CONECT   35    6                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   22                                                      
CONECT   47   22                                                      
CONECT   48   24                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
