COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.187   1.161   0.572  1.00  0.00           C  
HETATM    2  C   UNL     1       8.483   0.591   0.054  1.00  0.00           C  
HETATM    3  C   UNL     1       9.365  -0.284  -0.841  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.322   2.538   0.463  1.00  0.00           C  
HETATM    5  C   UNL     1       0.044   2.270   0.465  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.115   3.389  -0.587  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.739   1.966  -0.354  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.956   1.273  -0.230  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.874  -0.761   0.025  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.929  -2.151   0.210  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.617  -2.315   0.142  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.457  -0.948  -0.022  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.602  -0.146  -0.106  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.536   1.249  -0.293  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.417  -3.182   0.233  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.559  -4.559   0.398  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.439  -5.361   0.481  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.177  -4.801   0.402  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.029  -3.435   0.239  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.142  -2.624   0.147  1.00  0.00           C  
HETATM   21  N   UNL     1      -4.827  -2.859   0.261  1.00  0.00           N  
HETATM   22  N   UNL     1      -6.989  -0.023  -0.051  1.00  0.00           N  
HETATM   23  N   UNL     1      -5.411   3.268  -0.541  1.00  0.00           N  
HETATM   24  N   UNL     1      -3.530   2.169  -0.439  1.00  0.00           N  
HETATM   25  C   UNL     1      -2.153   1.901  -0.441  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.620   0.994  -1.352  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.275   0.727  -1.363  1.00  0.00           C  
HETATM   28  C   UNL     1       0.589   1.358  -0.443  1.00  0.00           C  
HETATM   29  N   UNL     1       1.924   1.218  -0.308  1.00  0.00           N  
HETATM   30  S   UNL     1       1.346   2.902   1.470  1.00  0.00           S  
HETATM   31  C   UNL     1       2.511   1.903   0.613  1.00  0.00           C  
HETATM   32  N   UNL     1       3.866   1.870   0.875  1.00  0.00           N  
HETATM   33  C   UNL     1       4.746   1.012   0.079  1.00  0.00           C  
HETATM   34  N   UNL     1       7.069   0.301  -0.227  1.00  0.00           N  
HETATM   35  C   UNL     1       6.773  -1.120   0.007  1.00  0.00           C  
HETATM   36  C   UNL     1       7.672  -1.978  -0.887  1.00  0.00           C  
HETATM   37  O   UNL     1       9.041  -1.660  -0.622  1.00  0.00           O  
HETATM   38  H   UNL     1       6.500   2.200   0.467  1.00  0.00           H  
HETATM   39  H   UNL     1       6.245   0.868   1.620  1.00  0.00           H  
HETATM   40  H   UNL     1       8.698   0.375   1.100  1.00  0.00           H  
HETATM   41  H   UNL     1       8.686   1.642  -0.150  1.00  0.00           H  
HETATM   42  H   UNL     1       9.189  -0.031  -1.886  1.00  0.00           H  
HETATM   43  H   UNL     1      10.414  -0.114  -0.597  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.735   3.242   1.171  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.584   4.319  -0.728  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.884   1.822  -0.284  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.886  -2.641   0.312  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.472  -0.511  -0.084  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.545  -4.997   0.460  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.549  -6.427   0.609  1.00  0.00           H  
HETATM   51  H   UNL     1       0.697  -5.432   0.469  1.00  0.00           H  
HETATM   52  H   UNL     1       0.959  -3.003   0.178  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.026  -1.558   0.020  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.270   0.498  -2.057  1.00  0.00           H  
HETATM   55  H   UNL     1       0.125   0.021  -2.076  1.00  0.00           H  
HETATM   56  H   UNL     1       4.235   2.416   1.587  1.00  0.00           H  
HETATM   57  H   UNL     1       4.688   1.305  -0.969  1.00  0.00           H  
HETATM   58  H   UNL     1       4.432  -0.027   0.184  1.00  0.00           H  
HETATM   59  H   UNL     1       6.960  -1.363   1.053  1.00  0.00           H  
HETATM   60  H   UNL     1       5.727  -1.318  -0.230  1.00  0.00           H  
HETATM   61  H   UNL     1       7.496  -3.033  -0.675  1.00  0.00           H  
HETATM   62  H   UNL     1       7.446  -1.774  -1.933  1.00  0.00           H  
CONECT    1   34   33   38   39                                       
CONECT    2    3   34   40   41                                       
CONECT    3   37    2   42   43                                       
CONECT    4    5    5   25   44                                       
CONECT    5   28   30    4    4                                       
CONECT    6   24   23   23   45                                       
CONECT    7   14   14    8   23                                       
CONECT    8   22   22    7   46                                       
CONECT    9   10   10   13   22                                       
CONECT   10   21    9    9   47                                       
CONECT   11   15   21   21   12                                       
CONECT   12   11   13   13   48                                       
CONECT   13   12   12    9   14                                       
CONECT   14   13   24    7    7                                       
CONECT   15   20   20   16   11                                       
CONECT   16   17   17   15   49                                       
CONECT   17   18   16   16   50                                       
CONECT   18   19   19   17   51                                       
CONECT   19   18   18   20   52                                       
CONECT   20   19   15   15   53                                       
CONECT   21   11   11   10                                            
CONECT   22    9    8    8                                            
CONECT   23    7    6    6                                            
CONECT   24   25   14    6                                            
CONECT   25   26   26    4   24                                       
CONECT   26   27   25   25   54                                       
CONECT   27   28   28   26   55                                       
CONECT   28   29   27   27    5                                       
CONECT   29   31   31   28                                            
CONECT   30   31    5                                                 
CONECT   31   32   29   29   30                                       
CONECT   32   33   31   56                                            
CONECT   33    1   32   57   58                                       
CONECT   34    2   35    1                                            
CONECT   35   36   34   59   60                                       
CONECT   36   37   35   61   62                                       
CONECT   37    3   36                                                 
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    2                                                      
CONECT   41    2                                                      
CONECT   42    3                                                      
CONECT   43    3                                                      
CONECT   44    4                                                      
CONECT   45    6                                                      
CONECT   46    8                                                      
CONECT   47   10                                                      
CONECT   48   12                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   26                                                      
CONECT   55   27                                                      
CONECT   56   32                                                      
CONECT   57   33                                                      
CONECT   58   33                                                      
CONECT   59   35                                                      
CONECT   60   35                                                      
CONECT   61   36                                                      
CONECT   62   36                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
