COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.472  -2.518   1.166  1.00  0.00           C  
HETATM    2  N   UNL     1       6.091  -2.824  -0.047  1.00  0.00           N  
HETATM    3  C   UNL     1       3.719  -0.216   0.896  1.00  0.00           C  
HETATM    4  C   UNL     1       4.225  -1.991  -1.599  1.00  0.00           C  
HETATM    5  C   UNL     1       3.507   0.559   2.000  1.00  0.00           C  
HETATM    6  C   UNL     1       5.154  -1.636  -2.762  1.00  0.00           C  
HETATM    7  C   UNL     1       2.032   1.054   0.445  1.00  0.00           C  
HETATM    8  C   UNL     1       0.893   1.766  -0.172  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.099   1.111  -0.886  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.156   1.836  -1.403  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.225   3.205  -1.208  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.233   3.869  -0.510  1.00  0.00           C  
HETATM   13  C   UNL     1       0.840   3.162  -0.002  1.00  0.00           C  
HETATM   14  C   UNL     1       2.028   3.752   2.019  1.00  0.00           C  
HETATM   15  C   UNL     1       1.778   2.345   2.567  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.622   0.565  -1.034  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.741  -0.276  -1.654  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.719  -0.704  -0.558  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.956  -0.679   1.104  1.00  0.00           C  
HETATM   20  C   UNL     1       3.612  -3.372  -1.840  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.925  -0.251   0.057  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.936  -2.027   1.458  1.00  0.00           C  
HETATM   23  C   UNL     1      -7.011  -2.855   0.752  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.597  -0.876   2.220  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.170  -2.915   2.440  1.00  0.00           C  
HETATM   26  C   UNL     1       4.777  -1.237   0.742  1.00  0.00           C  
HETATM   27  N   UNL     1       2.442   1.350   1.725  1.00  0.00           N  
HETATM   28  N   UNL     1       2.790   0.110  -0.030  1.00  0.00           N  
HETATM   29  N   UNL     1      -5.004  -1.482   0.461  1.00  0.00           N  
HETATM   30  N   UNL     1       4.990  -2.007  -0.350  1.00  0.00           N  
HETATM   31  N   UNL     1       5.681  -1.561   1.645  1.00  0.00           N  
HETATM   32  O   UNL     1       1.886   3.775   0.599  1.00  0.00           O  
HETATM   33  O   UNL     1      -1.766  -0.156  -2.784  1.00  0.00           O  
HETATM   34  S   UNL     1      -2.420   1.015  -2.316  1.00  0.00           S  
HETATM   35  H   UNL     1       7.295  -2.974   1.697  1.00  0.00           H  
HETATM   36  H   UNL     1       3.430  -1.248  -1.530  1.00  0.00           H  
HETATM   37  H   UNL     1       4.078   0.544   2.917  1.00  0.00           H  
HETATM   38  H   UNL     1       4.585  -1.624  -3.692  1.00  0.00           H  
HETATM   39  H   UNL     1       5.590  -0.652  -2.591  1.00  0.00           H  
HETATM   40  H   UNL     1       5.949  -2.379  -2.832  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.047   0.043  -1.037  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.062   3.760  -1.605  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.296   4.937  -0.362  1.00  0.00           H  
HETATM   44  H   UNL     1       1.310   4.442   2.463  1.00  0.00           H  
HETATM   45  H   UNL     1       3.038   4.067   2.283  1.00  0.00           H  
HETATM   46  H   UNL     1       2.171   2.278   3.582  1.00  0.00           H  
HETATM   47  H   UNL     1       0.707   2.147   2.580  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.046   1.470  -0.599  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.269   0.315  -2.403  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.312  -1.161  -2.125  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.158   0.181  -0.097  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.509  -1.316  -0.994  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.465  -1.273   1.875  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.403   0.206   1.557  1.00  0.00           H  
HETATM   55  H   UNL     1       2.951  -3.625  -1.011  1.00  0.00           H  
HETATM   56  H   UNL     1       3.043  -3.361  -2.769  1.00  0.00           H  
HETATM   57  H   UNL     1       4.407  -4.115  -1.910  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.468  -1.136  -0.386  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.156   0.358   0.532  1.00  0.00           H  
HETATM   60  H   UNL     1      -7.556  -2.222   0.052  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.540  -3.675   0.209  1.00  0.00           H  
HETATM   62  H   UNL     1      -7.702  -3.259   1.492  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.142  -0.243   1.520  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.288  -1.280   2.959  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.831  -0.286   2.723  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.862  -3.319   3.180  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.699  -3.735   1.898  1.00  0.00           H  
HETATM   68  H   UNL     1      -4.404  -2.325   2.944  1.00  0.00           H  
CONECT    1    2    2   31   35                                       
CONECT    2   30    1    1                                            
CONECT    3   26   28    5    5                                       
CONECT    4    6   30   20   36                                       
CONECT    5    3    3   27   37                                       
CONECT    6    4   38   39   40                                       
CONECT    7   28   28    8   27                                       
CONECT    8    9    7   13   13                                       
CONECT    9   10   10    8   41                                       
CONECT   10   34    9    9   11                                       
CONECT   11   10   12   12   42                                       
CONECT   12   11   11   13   43                                       
CONECT   13    8    8   12   32                                       
CONECT   14   32   15   44   45                                       
CONECT   15   27   14   46   47                                       
CONECT   16   21   17   34   48                                       
CONECT   17   18   16   49   50                                       
CONECT   18   29   17   51   52                                       
CONECT   19   29   21   53   54                                       
CONECT   20    4   55   56   57                                       
CONECT   21   19   16   58   59                                       
CONECT   22   23   25   24   29                                       
CONECT   23   22   60   61   62                                       
CONECT   24   22   63   64   65                                       
CONECT   25   22   66   67   68                                       
CONECT   26   30   31   31    3                                       
CONECT   27    7    5   15                                            
CONECT   28    3    7    7                                            
CONECT   29   22   19   18                                            
CONECT   30    4    2   26                                            
CONECT   31    1   26   26                                            
CONECT   32   13   14                                                 
CONECT   33   34   34                                                 
CONECT   34   16   33   33   10                                       
CONECT   35    1                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    9                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   21                                                      
CONECT   60   23                                                      
CONECT   61   23                                                      
CONECT   62   23                                                      
CONECT   63   24                                                      
CONECT   64   24                                                      
CONECT   65   24                                                      
CONECT   66   25                                                      
CONECT   67   25                                                      
CONECT   68   25                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
