COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.907  -0.010   0.038  1.00  0.00           C  
HETATM    2  C   UNL     1       7.182  -1.197   0.128  1.00  0.00           C  
HETATM    3  C   UNL     1       5.699  -1.164   0.148  1.00  0.00           C  
HETATM    4  C   UNL     1       3.721  -0.126   0.109  1.00  0.00           C  
HETATM    5  C   UNL     1       3.286   2.326  -0.046  1.00  0.00           C  
HETATM    6  C   UNL     1       0.533   1.873   0.025  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.631   2.693   0.001  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.454   1.176   0.024  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.685  -0.876  -0.005  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.930  -2.386  -0.006  1.00  0.00           C  
HETATM   11  C   UNL     1      -8.435  -2.659   0.043  1.00  0.00           C  
HETATM   12  C   UNL     1      -8.778  -0.538   1.318  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.601  -1.205  -1.308  1.00  0.00           C  
HETATM   14  C   UNL     1      -9.023  -2.048   1.316  1.00  0.00           C  
HETATM   15  C   UNL     1      -7.273  -0.265   1.269  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.180  -0.603  -0.053  1.00  0.00           C  
HETATM   17  O   UNL     1      -5.318  -1.791  -2.083  1.00  0.00           O  
HETATM   18  O   UNL     1      -3.289  -1.089  -1.564  1.00  0.00           O  
HETATM   19  C   UNL     1      -4.935   0.907  -0.052  1.00  0.00           C  
HETATM   20  O   UNL     1      -2.672   0.250   0.072  1.00  0.00           O  
HETATM   21  N   UNL     1      -3.000   2.444   0.038  1.00  0.00           N  
HETATM   22  C   UNL     1      -1.178   4.015  -0.092  1.00  0.00           C  
HETATM   23  C   UNL     1       0.160   4.275  -0.128  1.00  0.00           C  
HETATM   24  N   UNL     1      -0.791   1.680   0.056  1.00  0.00           N  
HETATM   25  C   UNL     1       1.419   0.786   0.083  1.00  0.00           C  
HETATM   26  C   UNL     1       1.054   3.187  -0.070  1.00  0.00           C  
HETATM   27  C   UNL     1       2.444   3.389  -0.104  1.00  0.00           C  
HETATM   28  C   UNL     1       2.784   1.016   0.048  1.00  0.00           C  
HETATM   29  N   UNL     1       5.018  -0.036   0.084  1.00  0.00           N  
HETATM   30  S   UNL     1       3.255  -1.820   0.225  1.00  0.00           S  
HETATM   31  C   UNL     1       4.954  -2.287   0.229  1.00  0.00           C  
HETATM   32  C   UNL     1       7.856  -2.415   0.197  1.00  0.00           C  
HETATM   33  C   UNL     1       9.236  -2.440   0.177  1.00  0.00           C  
HETATM   34  C   UNL     1       9.950  -1.259   0.088  1.00  0.00           C  
HETATM   35  C   UNL     1       9.286  -0.047   0.019  1.00  0.00           C  
HETATM   36  H   UNL     1       7.390   0.936  -0.021  1.00  0.00           H  
HETATM   37  H   UNL     1       4.354   2.487  -0.077  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.164  -0.429  -0.876  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.511  -2.821  -0.914  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.451  -2.833   0.865  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.913  -2.212  -0.829  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.609  -3.735   0.041  1.00  0.00           H  
HETATM   43  H   UNL     1      -9.256  -0.091   0.446  1.00  0.00           H  
HETATM   44  H   UNL     1      -9.197  -0.103   2.225  1.00  0.00           H  
HETATM   45  H   UNL     1     -10.095  -2.242   1.351  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.544  -2.495   2.188  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.794  -0.712   2.141  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.098   0.811   1.270  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.702  -1.050   0.818  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.964  -1.491  -2.381  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.430   1.355   0.810  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.337   1.341  -0.967  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.626   3.184   0.075  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.888   4.828  -0.135  1.00  0.00           H  
HETATM   55  H   UNL     1       0.525   5.288  -0.201  1.00  0.00           H  
HETATM   56  H   UNL     1       1.039  -0.222   0.156  1.00  0.00           H  
HETATM   57  H   UNL     1       2.842   4.391  -0.175  1.00  0.00           H  
HETATM   58  H   UNL     1       5.334  -3.296   0.285  1.00  0.00           H  
HETATM   59  H   UNL     1       7.299  -3.338   0.267  1.00  0.00           H  
HETATM   60  H   UNL     1       9.759  -3.383   0.232  1.00  0.00           H  
HETATM   61  H   UNL     1      11.030  -1.283   0.073  1.00  0.00           H  
HETATM   62  H   UNL     1       9.849   0.872  -0.051  1.00  0.00           H  
CONECT    1    2    2   35   36                                       
CONECT    2    1    1    3   32                                       
CONECT    3    2   29   31   31                                       
CONECT    4   28   29   29   30                                       
CONECT    5   27   27   28   37                                       
CONECT    6   24   24   25   26                                       
CONECT    7   21   22   22   24                                       
CONECT    8   19   20   20   21                                       
CONECT    9   10   15   16   38                                       
CONECT   10    9   11   39   40                                       
CONECT   11   10   14   41   42                                       
CONECT   12   14   15   43   44                                       
CONECT   13   16   17   17   18                                       
CONECT   14   11   12   45   46                                       
CONECT   15    9   12   47   48                                       
CONECT   16    9   13   19   49                                       
CONECT   17   13   13                                                 
CONECT   18   13   50                                                 
CONECT   19    8   16   51   52                                       
CONECT   20    8    8                                                 
CONECT   21    7    8   53                                            
CONECT   22    7    7   23   54                                       
CONECT   23   22   26   26   55                                       
CONECT   24    6    6    7                                            
CONECT   25    6   28   28   56                                       
CONECT   26    6   23   23   27                                       
CONECT   27    5    5   26   57                                       
CONECT   28    4    5   25   25                                       
CONECT   29    3    4    4                                            
CONECT   30    4   31                                                 
CONECT   31    3    3   30   58                                       
CONECT   32    2   33   33   59                                       
CONECT   33   32   32   34   60                                       
CONECT   34   33   35   35   61                                       
CONECT   35    1   34   34   62                                       
CONECT   36    1                                                      
CONECT   37    5                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   12                                                      
CONECT   45   14                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   21                                                      
CONECT   54   22                                                      
CONECT   55   23                                                      
CONECT   56   25                                                      
CONECT   57   27                                                      
CONECT   58   31                                                      
CONECT   59   32                                                      
CONECT   60   33                                                      
CONECT   61   34                                                      
CONECT   62   35                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
