COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.103   0.924  -0.152  1.00  0.00           C  
HETATM    2  O   UNL     1       1.806  -0.076  -0.129  1.00  0.00           O  
HETATM    3  O   UNL     1      -0.053   1.029  -0.852  1.00  0.00           O  
HETATM    4  C   UNL     1       1.397   2.203   0.584  1.00  0.00           C  
HETATM    5  O   UNL     1       1.381   3.204  -0.434  1.00  0.00           O  
HETATM    6  C   UNL     1       2.362   2.944  -1.424  1.00  0.00           C  
HETATM    7  C   UNL     1       0.290   2.556   1.574  1.00  0.00           C  
HETATM    8  C   UNL     1       0.313   1.659   2.807  1.00  0.00           C  
HETATM    9  O   UNL     1      -0.610   2.191   3.755  1.00  0.00           O  
HETATM   10  C   UNL     1       1.719   1.606   3.411  1.00  0.00           C  
HETATM   11  N   UNL     1       1.761   0.640   4.486  1.00  0.00           N  
HETATM   12  C   UNL     1       2.042   0.978   5.795  1.00  0.00           C  
HETATM   13  O   UNL     1       2.287   2.101   6.221  1.00  0.00           O  
HETATM   14  C   UNL     1       2.030  -0.179   6.738  1.00  0.00           C  
HETATM   15  C   UNL     1       2.761   1.277   2.330  1.00  0.00           C  
HETATM   16  O   UNL     1       2.660   2.184   1.225  1.00  0.00           O  
HETATM   17  C   UNL     1       4.188   1.393   2.859  1.00  0.00           C  
HETATM   18  O   UNL     1       4.348   2.704   3.406  1.00  0.00           O  
HETATM   19  C   UNL     1       5.265   1.176   1.787  1.00  0.00           C  
HETATM   20  O   UNL     1       5.047  -0.097   1.170  1.00  0.00           O  
HETATM   21  C   UNL     1       6.707   1.208   2.292  1.00  0.00           C  
HETATM   22  N   UNL     1       6.986   0.181   3.260  1.00  0.00           N  
HETATM   23  C   UNL     1       7.408   0.464   4.553  1.00  0.00           C  
HETATM   24  O   UNL     1       7.584   1.595   4.998  1.00  0.00           O  
HETATM   25  C   UNL     1       7.680  -0.709   5.423  1.00  0.00           C  
HETATM   26  C   UNL     1       8.591  -0.579   6.450  1.00  0.00           C  
HETATM   27  C   UNL     1       8.847  -1.680   7.267  1.00  0.00           C  
HETATM   28  C   UNL     1       7.012  -1.891   5.176  1.00  0.00           C  
HETATM   29  C   UNL     1       7.268  -2.992   5.993  1.00  0.00           C  
HETATM   30  C   UNL     1       8.185  -2.887   7.038  1.00  0.00           C  
HETATM   31  C   UNL     1       8.450  -4.028   7.887  1.00  0.00           C  
HETATM   32  C   UNL     1       9.466  -4.924   7.554  1.00  0.00           C  
HETATM   33  C   UNL     1       7.690  -4.232   9.039  1.00  0.00           C  
HETATM   34  C   UNL     1       9.721  -6.025   8.372  1.00  0.00           C  
HETATM   35  C   UNL     1       7.946  -5.332   9.857  1.00  0.00           C  
HETATM   36  C   UNL     1       8.961  -6.228   9.524  1.00  0.00           C  
HETATM   37  H   UNL     1      -0.261   0.204  -1.341  1.00  0.00           H  
HETATM   38  H   UNL     1       3.186   3.653  -1.318  1.00  0.00           H  
HETATM   39  H   UNL     1       1.912   3.037  -2.416  1.00  0.00           H  
HETATM   40  H   UNL     1       2.740   1.927  -1.292  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.698   2.515   1.097  1.00  0.00           H  
HETATM   42  H   UNL     1       0.405   3.602   1.892  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.032   0.652   2.546  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.820   3.091   3.461  1.00  0.00           H  
HETATM   45  H   UNL     1       1.947   2.578   3.869  1.00  0.00           H  
HETATM   46  H   UNL     1       1.575  -0.334   4.267  1.00  0.00           H  
HETATM   47  H   UNL     1       2.997  -0.316   7.249  1.00  0.00           H  
HETATM   48  H   UNL     1       1.289  -0.057   7.544  1.00  0.00           H  
HETATM   49  H   UNL     1       1.803  -1.156   6.282  1.00  0.00           H  
HETATM   50  H   UNL     1       2.626   0.252   1.963  1.00  0.00           H  
HETATM   51  H   UNL     1       4.328   0.696   3.691  1.00  0.00           H  
HETATM   52  H   UNL     1       5.289   2.799   3.613  1.00  0.00           H  
HETATM   53  H   UNL     1       5.156   1.924   0.992  1.00  0.00           H  
HETATM   54  H   UNL     1       4.231  -0.012   0.657  1.00  0.00           H  
HETATM   55  H   UNL     1       7.404   1.046   1.463  1.00  0.00           H  
HETATM   56  H   UNL     1       6.944   2.171   2.755  1.00  0.00           H  
HETATM   57  H   UNL     1       6.925  -0.786   2.947  1.00  0.00           H  
HETATM   58  H   UNL     1       9.112   0.356   6.637  1.00  0.00           H  
HETATM   59  H   UNL     1       9.565  -1.582   8.078  1.00  0.00           H  
HETATM   60  H   UNL     1       6.295  -1.984   4.364  1.00  0.00           H  
HETATM   61  H   UNL     1       6.743  -3.925   5.803  1.00  0.00           H  
HETATM   62  H   UNL     1      10.067  -4.778   6.660  1.00  0.00           H  
HETATM   63  H   UNL     1       6.895  -3.542   9.312  1.00  0.00           H  
HETATM   64  H   UNL     1      10.512  -6.722   8.113  1.00  0.00           H  
HETATM   65  H   UNL     1       7.354  -5.491  10.754  1.00  0.00           H  
HETATM   66  H   UNL     1       9.160  -7.085  10.161  1.00  0.00           H  
CONECT    1    2    2    3    4                                       
CONECT    2    1    1                                                 
CONECT    3    1   37                                                 
CONECT    4    1    5    7   16                                       
CONECT    5    4    6                                                 
CONECT    6    5   38   39   40                                       
CONECT    7    4    8   41   42                                       
CONECT    8    7    9   10   43                                       
CONECT    9    8   44                                                 
CONECT   10    8   11   15   45                                       
CONECT   11   10   12   46                                            
CONECT   12   11   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14   12   47   48   49                                       
CONECT   15   10   16   17   50                                       
CONECT   16    4   15                                                 
CONECT   17   15   18   19   51                                       
CONECT   18   17   52                                                 
CONECT   19   17   20   21   53                                       
CONECT   20   19   54                                                 
CONECT   21   19   22   55   56                                       
CONECT   22   21   23   57                                            
CONECT   23   22   24   24   25                                       
CONECT   24   23   23                                                 
CONECT   25   23   26   26   28                                       
CONECT   26   25   25   27   58                                       
CONECT   27   26   30   30   59                                       
CONECT   28   25   29   29   60                                       
CONECT   29   28   28   30   61                                       
CONECT   30   27   27   29   31                                       
CONECT   31   30   32   32   33                                       
CONECT   32   31   31   34   62                                       
CONECT   33   31   35   35   63                                       
CONECT   34   32   36   36   64                                       
CONECT   35   33   33   36   65                                       
CONECT   36   34   34   35   66                                       
CONECT   37    3                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    7                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   14                                                      
CONECT   48   14                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   17                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   20                                                      
CONECT   55   21                                                      
CONECT   56   21                                                      
CONECT   57   22                                                      
CONECT   58   26                                                      
CONECT   59   27                                                      
CONECT   60   28                                                      
CONECT   61   29                                                      
CONECT   62   32                                                      
CONECT   63   33                                                      
CONECT   64   34                                                      
CONECT   65   35                                                      
CONECT   66   36                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
