COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       9.457   1.806  -1.306  1.00  0.00           C  
HETATM    2  C   UNL     1       2.929  -1.865   0.330  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.487   0.531  -0.247  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.908  -0.700  -0.851  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.765  -1.482  -0.669  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.045  -2.898  -0.842  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.844   1.616   0.373  1.00  0.00           C  
HETATM    8  C   UNL     1       3.941  -1.122   3.193  1.00  0.00           C  
HETATM    9  C   UNL     1       4.628  -0.797   1.893  1.00  0.00           C  
HETATM   10  C   UNL     1       4.194  -1.116   0.660  1.00  0.00           C  
HETATM   11  C   UNL     1       6.057  -0.054   0.432  1.00  0.00           C  
HETATM   12  C   UNL     1       7.238   0.597  -0.173  1.00  0.00           C  
HETATM   13  C   UNL     1       8.196   1.206   0.639  1.00  0.00           C  
HETATM   14  C   UNL     1       9.296   1.811   0.068  1.00  0.00           C  
HETATM   15  C   UNL     1       8.514   1.199  -2.117  1.00  0.00           C  
HETATM   16  C   UNL     1       7.406   0.595  -1.559  1.00  0.00           C  
HETATM   17  C   UNL     1       1.780  -0.871   0.149  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.543  -0.840  -0.356  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.628   1.297  -0.436  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.826   0.692  -0.734  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.297  -3.185  -1.133  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.059   1.534  -0.938  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.089   2.457   0.200  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.204   0.505   0.755  1.00  0.00           C  
HETATM   25  N   UNL     1       5.089  -0.649  -0.225  1.00  0.00           N  
HETATM   26  N   UNL     1      -7.214   1.796   0.417  1.00  0.00           N  
HETATM   27  O   UNL     1       5.790  -0.128   1.748  1.00  0.00           O  
HETATM   28  O   UNL     1       0.580  -1.581  -0.163  1.00  0.00           O  
HETATM   29  O   UNL     1      -6.059   3.629  -0.109  1.00  0.00           O  
HETATM   30  O   UNL     1      -8.180  -0.186   0.974  1.00  0.00           O  
HETATM   31  S   UNL     1      -4.280  -1.736  -1.227  1.00  0.00           S  
HETATM   32  S   UNL     1      -5.513  -0.020   0.828  1.00  0.00           S  
HETATM   33  H   UNL     1      10.320   2.281  -1.748  1.00  0.00           H  
HETATM   34  H   UNL     1       3.070  -2.429  -0.592  1.00  0.00           H  
HETATM   35  H   UNL     1       2.691  -2.552   1.143  1.00  0.00           H  
HETATM   36  H   UNL     1       0.450   1.013  -0.008  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.283  -3.657  -0.739  1.00  0.00           H  
HETATM   38  H   UNL     1       4.288  -2.089   3.556  1.00  0.00           H  
HETATM   39  H   UNL     1       4.174  -0.353   3.930  1.00  0.00           H  
HETATM   40  H   UNL     1       2.863  -1.159   3.035  1.00  0.00           H  
HETATM   41  H   UNL     1       8.076   1.204   1.712  1.00  0.00           H  
HETATM   42  H   UNL     1      10.033   2.291   0.695  1.00  0.00           H  
HETATM   43  H   UNL     1       8.645   1.198  -3.189  1.00  0.00           H  
HETATM   44  H   UNL     1       6.671   0.121  -2.192  1.00  0.00           H  
HETATM   45  H   UNL     1       1.639  -0.307   1.072  1.00  0.00           H  
HETATM   46  H   UNL     1       2.018  -0.184  -0.663  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.576   2.372  -0.348  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.671  -4.185  -1.293  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.685   1.082  -1.708  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.767   2.536  -1.250  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.062   2.259   0.328  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.216   2.011   1.172  1.00  0.00           H  
CONECT    1   15   15   14   33                                       
CONECT    2   17   10   34   35                                       
CONECT    3   19   19   18   36                                       
CONECT    4   20   20    5   31                                       
CONECT    5   18   18    4    6                                       
CONECT    6    5   21   21   37                                       
CONECT    7   23   22   32   52                                       
CONECT    8    9   38   39   40                                       
CONECT    9   10   10   27    8                                       
CONECT   10   25    2    9    9                                       
CONECT   11   12   25   25   27                                       
CONECT   12   16   16   13   11                                       
CONECT   13   14   14   12   41                                       
CONECT   14    1   13   13   42                                       
CONECT   15    1    1   16   43                                       
CONECT   16   15   12   12   44                                       
CONECT   17    2   28   45   46                                       
CONECT   18    3   28    5    5                                       
CONECT   19    3    3   20   47                                       
CONECT   20   22   19    4    4                                       
CONECT   21   31    6    6   48                                       
CONECT   22    7   20   49   50                                       
CONECT   23   29   29   26    7                                       
CONECT   24   26   30   30   32                                       
CONECT   25   11   11   10                                            
CONECT   26   23   24   51                                            
CONECT   27   11    9                                                 
CONECT   28   17   18                                                 
CONECT   29   23   23                                                 
CONECT   30   24   24                                                 
CONECT   31    4   21                                                 
CONECT   32    7   24                                                 
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    6                                                      
CONECT   38    8                                                      
CONECT   39    8                                                      
CONECT   40    8                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   17                                                      
CONECT   47   19                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   22                                                      
CONECT   51   26                                                      
CONECT   52    7                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
