COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.982   3.772   1.306  1.00  0.00           C  
HETATM    2  C   UNL     1       4.078   5.145   1.404  1.00  0.00           C  
HETATM    3  C   UNL     1       3.665   5.947   0.356  1.00  0.00           C  
HETATM    4  C   UNL     1       3.154   5.378  -0.797  1.00  0.00           C  
HETATM    5  C   UNL     1       3.054   4.006  -0.907  1.00  0.00           C  
HETATM    6  C   UNL     1       3.468   3.193   0.147  1.00  0.00           C  
HETATM    7  C   UNL     1       3.363   1.717   0.035  1.00  0.00           C  
HETATM    8  C   UNL     1       3.772   0.905   1.090  1.00  0.00           C  
HETATM    9  C   UNL     1       3.672  -0.467   0.980  1.00  0.00           C  
HETATM   10  C   UNL     1       2.849   1.139  -1.124  1.00  0.00           C  
HETATM   11  C   UNL     1       2.754  -0.234  -1.223  1.00  0.00           C  
HETATM   12  C   UNL     1       3.167  -1.036  -0.175  1.00  0.00           C  
HETATM   13  S   UNL     1       3.042  -2.789  -0.308  1.00  0.00           S  
HETATM   14  O   UNL     1       3.040  -3.087  -1.697  1.00  0.00           O  
HETATM   15  O   UNL     1       3.991  -3.329   0.601  1.00  0.00           O  
HETATM   16  N   UNL     1       1.549  -3.219   0.265  1.00  0.00           N  
HETATM   17  C   UNL     1       0.341  -2.786  -0.442  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.350  -4.002  -1.062  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.532  -3.537  -1.915  1.00  0.00           C  
HETATM   20  C   UNL     1       0.646  -4.760  -1.942  1.00  0.00           C  
HETATM   21  P   UNL     1      -0.794  -1.977   0.733  1.00  0.00           P  
HETATM   22  O   UNL     1      -0.034  -1.033   1.583  1.00  0.00           O  
HETATM   23  O   UNL     1      -1.490  -3.093   1.662  1.00  0.00           O  
HETATM   24  C   UNL     1      -2.076  -1.067  -0.189  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.874  -0.190   0.778  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.811  -1.053   1.583  1.00  0.00           C  
HETATM   27  O   UNL     1      -3.838  -2.248   1.402  1.00  0.00           O  
HETATM   28  O   UNL     1      -4.616  -0.495   2.501  1.00  0.00           O  
HETATM   29  C   UNL     1      -3.671   0.822  -0.004  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.462   2.173   0.201  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.608   0.400  -0.929  1.00  0.00           C  
HETATM   32  C   UNL     1      -5.339   1.329  -1.646  1.00  0.00           C  
HETATM   33  C   UNL     1      -5.134   2.680  -1.437  1.00  0.00           C  
HETATM   34  C   UNL     1      -4.193   3.102  -0.516  1.00  0.00           C  
HETATM   35  C   UNL     1      -3.966   4.575  -0.293  1.00  0.00           C  
HETATM   36  N   UNL     1      -2.922   5.054  -1.210  1.00  0.00           N  
HETATM   37  H   UNL     1       4.308   3.146   2.123  1.00  0.00           H  
HETATM   38  H   UNL     1       4.476   5.594   2.302  1.00  0.00           H  
HETATM   39  H   UNL     1       3.741   7.021   0.437  1.00  0.00           H  
HETATM   40  H   UNL     1       2.832   6.009  -1.612  1.00  0.00           H  
HETATM   41  H   UNL     1       2.654   3.563  -1.807  1.00  0.00           H  
HETATM   42  H   UNL     1       4.167   1.348   1.992  1.00  0.00           H  
HETATM   43  H   UNL     1       3.990  -1.098   1.798  1.00  0.00           H  
HETATM   44  H   UNL     1       2.526   1.764  -1.944  1.00  0.00           H  
HETATM   45  H   UNL     1       2.355  -0.684  -2.121  1.00  0.00           H  
HETATM   46  H   UNL     1       1.474  -3.757   1.069  1.00  0.00           H  
HETATM   47  H   UNL     1       0.613  -2.082  -1.228  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.709  -4.660  -0.271  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.201  -2.760  -2.603  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.925  -4.381  -2.482  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.313  -3.140  -1.266  1.00  0.00           H  
HETATM   52  H   UNL     1       1.475  -5.115  -1.330  1.00  0.00           H  
HETATM   53  H   UNL     1       0.147  -5.611  -2.407  1.00  0.00           H  
HETATM   54  H   UNL     1       1.026  -4.095  -2.717  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.007  -3.747   1.171  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.604  -0.439  -0.944  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.747  -1.777  -0.674  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.189   0.327   1.449  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.199  -1.089   2.993  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.728   2.503   0.920  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.768  -0.655  -1.092  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.069   0.999  -2.369  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.704   3.406  -1.997  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.891   5.119  -0.481  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.649   4.742   0.736  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.162   4.852  -2.169  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.751   6.039  -1.080  1.00  0.00           H  
CONECT    1    6    6    2   37                                       
CONECT    2    1    3    3   38                                       
CONECT    3    2    2    4   39                                       
CONECT    4    3    5    5   40                                       
CONECT    5    4    4    6   41                                       
CONECT    6    1    1    5    7                                       
CONECT    7    6   10   10    8                                       
CONECT    8    7    9    9   42                                       
CONECT    9    8    8   12   43                                       
CONECT   10    7    7   11   44                                       
CONECT   11   10   12   12   45                                       
CONECT   12    9   11   11   13                                       
CONECT   13   12   16   14   14                                       
CONECT   13   15   15                                                 
CONECT   14   13   13                                                 
CONECT   15   13   13                                                 
CONECT   16   13   17   46                                            
CONECT   17   16   18   21   47                                       
CONECT   18   17   19   20   48                                       
CONECT   19   18   49   50   51                                       
CONECT   20   18   52   53   54                                       
CONECT   21   17   22   22   24                                       
CONECT   21   23                                                      
CONECT   22   21   21                                                 
CONECT   23   21   55                                                 
CONECT   24   21   25   56   57                                       
CONECT   25   24   29   26   58                                       
CONECT   26   25   27   27   28                                       
CONECT   27   26   26                                                 
CONECT   28   26   59                                                 
CONECT   29   25   30   30   31                                       
CONECT   30   29   29   34   60                                       
CONECT   31   29   32   32   61                                       
CONECT   32   31   31   33   62                                       
CONECT   33   32   34   34   63                                       
CONECT   34   30   33   33   35                                       
CONECT   35   34   36   64   65                                       
CONECT   36   35   66   67                                            
CONECT   37    1                                                      
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   18                                                      
CONECT   49   19                                                      
CONECT   50   19                                                      
CONECT   51   19                                                      
CONECT   52   20                                                      
CONECT   53   20                                                      
CONECT   54   20                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   24                                                      
CONECT   58   25                                                      
CONECT   59   28                                                      
CONECT   60   30                                                      
CONECT   61   31                                                      
CONECT   62   32                                                      
CONECT   63   33                                                      
CONECT   64   35                                                      
CONECT   65   35                                                      
CONECT   66   36                                                      
CONECT   67   36                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
