COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.040   1.340  -0.079  1.00  0.00           C  
HETATM    2  O   UNL     1      -2.774   0.350   0.917  1.00  0.00           O  
HETATM    3  C   UNL     1      -3.764   2.525   0.562  1.00  0.00           C  
HETATM    4  N   UNL     1      -2.909   3.122   1.597  1.00  0.00           N  
HETATM    5  C   UNL     1      -5.068   2.032   1.196  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.873   1.274   0.135  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.990   0.182  -0.475  1.00  0.00           C  
HETATM    8  O   UNL     1      -3.855   0.774  -1.104  1.00  0.00           O  
HETATM    9  C   UNL     1      -5.796  -0.601  -1.513  1.00  0.00           C  
HETATM   10  N   UNL     1      -4.994  -1.728  -2.007  1.00  0.00           N  
HETATM   11  C   UNL     1       0.398  -2.442   0.687  1.00  0.00           C  
HETATM   12  N   UNL     1       1.385  -3.367   0.114  1.00  0.00           N  
HETATM   13  C   UNL     1      -1.012  -2.916   0.331  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.040  -1.952   0.928  1.00  0.00           C  
HETATM   15  N   UNL     1      -3.394  -2.407   0.587  1.00  0.00           N  
HETATM   16  C   UNL     1      -1.814  -0.550   0.360  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.404  -0.076   0.715  1.00  0.00           C  
HETATM   18  O   UNL     1      -0.193   1.234   0.184  1.00  0.00           O  
HETATM   19  C   UNL     1       0.624  -1.040   0.118  1.00  0.00           C  
HETATM   20  O   UNL     1       1.941  -0.597   0.451  1.00  0.00           O  
HETATM   21  C   UNL     1       2.789  -0.970  -0.637  1.00  0.00           C  
HETATM   22  C   UNL     1       4.252  -0.863  -0.202  1.00  0.00           C  
HETATM   23  O   UNL     1       4.495  -1.754   0.888  1.00  0.00           O  
HETATM   24  C   UNL     1       4.538   0.577   0.239  1.00  0.00           C  
HETATM   25  N   UNL     1       5.973   0.734   0.511  1.00  0.00           N  
HETATM   26  C   UNL     1       4.120   1.530  -0.886  1.00  0.00           C  
HETATM   27  O   UNL     1       4.967   1.325  -2.019  1.00  0.00           O  
HETATM   28  C   UNL     1       2.668   1.239  -1.273  1.00  0.00           C  
HETATM   29  O   UNL     1       2.549  -0.102  -1.743  1.00  0.00           O  
HETATM   30  C   UNL     1       4.243   2.979  -0.409  1.00  0.00           C  
HETATM   31  C   UNL     1       6.190   0.302   1.898  1.00  0.00           C  
HETATM   32  H   UNL     1      -2.099   1.680  -0.511  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.989   3.271  -0.200  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.428   3.891   1.994  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.812   2.432   2.326  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.646   2.884   1.554  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.841   1.366   2.028  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.189   1.966  -0.646  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.749   0.819   0.597  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.657  -0.495   0.312  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.710  -0.979  -1.054  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.052   0.055  -2.345  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.870  -2.358  -1.229  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.563  -2.213  -2.685  1.00  0.00           H  
HETATM   45  H   UNL     1       0.510  -2.417   1.771  1.00  0.00           H  
HETATM   46  H   UNL     1       1.199  -4.274   0.515  1.00  0.00           H  
HETATM   47  H   UNL     1       1.178  -3.438  -0.871  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.125  -2.941  -0.753  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.173  -3.915   0.736  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.928  -1.927   2.012  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.458  -3.372   0.876  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.031  -1.887   1.171  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.927  -0.575  -0.724  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.292  -0.051   1.799  1.00  0.00           H  
HETATM   55  H   UNL     1       0.647   1.550   0.544  1.00  0.00           H  
HETATM   56  H   UNL     1       0.511  -1.065  -0.965  1.00  0.00           H  
HETATM   57  H   UNL     1       2.572  -1.998  -0.930  1.00  0.00           H  
HETATM   58  H   UNL     1       4.901  -1.124  -1.038  1.00  0.00           H  
HETATM   59  H   UNL     1       4.304  -2.646   0.568  1.00  0.00           H  
HETATM   60  H   UNL     1       3.968   0.803   1.140  1.00  0.00           H  
HETATM   61  H   UNL     1       6.167   1.723   0.482  1.00  0.00           H  
HETATM   62  H   UNL     1       4.666   1.935  -2.707  1.00  0.00           H  
HETATM   63  H   UNL     1       2.357   1.928  -2.058  1.00  0.00           H  
HETATM   64  H   UNL     1       2.029   1.375  -0.400  1.00  0.00           H  
HETATM   65  H   UNL     1       3.599   3.131   0.457  1.00  0.00           H  
HETATM   66  H   UNL     1       5.277   3.185  -0.135  1.00  0.00           H  
HETATM   67  H   UNL     1       3.939   3.652  -1.211  1.00  0.00           H  
HETATM   68  H   UNL     1       7.246   0.400   2.149  1.00  0.00           H  
HETATM   69  H   UNL     1       5.598   0.924   2.569  1.00  0.00           H  
HETATM   70  H   UNL     1       5.886  -0.740   2.006  1.00  0.00           H  
CONECT    1    2    3    8   32                                       
CONECT    2    1   16                                                 
CONECT    3    1    4    5   33                                       
CONECT    4    3   34   35                                            
CONECT    5    3    6   36   37                                       
CONECT    6    5    7   38   39                                       
CONECT    7    6    8    9   40                                       
CONECT    8    1    7                                                 
CONECT    9    7   10   41   42                                       
CONECT   10    9   43   44                                            
CONECT   11   12   13   19   45                                       
CONECT   12   11   46   47                                            
CONECT   13   11   14   48   49                                       
CONECT   14   13   15   16   50                                       
CONECT   15   14   51   52                                            
CONECT   16    2   14   17   53                                       
CONECT   17   16   18   19   54                                       
CONECT   18   17   55                                                 
CONECT   19   11   17   20   56                                       
CONECT   20   19   21                                                 
CONECT   21   20   22   29   57                                       
CONECT   22   21   23   24   58                                       
CONECT   23   22   59                                                 
CONECT   24   22   25   26   60                                       
CONECT   25   24   31   61                                            
CONECT   26   24   27   28   30                                       
CONECT   27   26   62                                                 
CONECT   28   26   29   63   64                                       
CONECT   29   21   28                                                 
CONECT   30   26   65   66   67                                       
CONECT   31   25   68   69   70                                       
CONECT   32    1                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    9                                                      
CONECT   42    9                                                      
CONECT   43   10                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   12                                                      
CONECT   48   13                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   15                                                      
CONECT   53   16                                                      
CONECT   54   17                                                      
CONECT   55   18                                                      
CONECT   56   19                                                      
CONECT   57   21                                                      
CONECT   58   22                                                      
CONECT   59   23                                                      
CONECT   60   24                                                      
CONECT   61   25                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   28                                                      
CONECT   65   30                                                      
CONECT   66   30                                                      
CONECT   67   30                                                      
CONECT   68   31                                                      
CONECT   69   31                                                      
CONECT   70   31                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
