COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.568   0.400  -0.500  1.00  0.00           C  
HETATM    2  C   UNL     1       4.404  -0.256  -1.722  1.00  0.00           C  
HETATM    3  C   UNL     1       3.137  -0.523  -2.186  1.00  0.00           C  
HETATM    4  C   UNL     1       2.021  -0.141  -1.442  1.00  0.00           C  
HETATM    5  C   UNL     1       2.175   0.508  -0.227  1.00  0.00           C  
HETATM    6  C   UNL     1       3.450   0.779   0.241  1.00  0.00           C  
HETATM    7  C   UNL     1       5.926   0.687   0.010  1.00  0.00           C  
HETATM    8  N   UNL     1       6.077   1.295   1.153  1.00  0.00           N  
HETATM    9  N   UNL     1       7.031   0.312  -0.723  1.00  0.00           N  
HETATM   10  N   UNL     1       0.753  -0.417  -1.941  1.00  0.00           N  
HETATM   11  C   UNL     1      -0.418  -0.339  -1.083  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.339   0.791  -0.092  1.00  0.00           C  
HETATM   13  C   UNL     1       1.007   0.934   0.617  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.526   2.162  -0.776  1.00  0.00           C  
HETATM   15  C   UNL     1       0.248   3.119   0.090  1.00  0.00           C  
HETATM   16  C   UNL     1       1.131   2.411   0.900  1.00  0.00           C  
HETATM   17  C   UNL     1       0.168   4.501   0.149  1.00  0.00           C  
HETATM   18  C   UNL     1       1.004   5.144   1.052  1.00  0.00           C  
HETATM   19  C   UNL     1       1.877   4.442   1.857  1.00  0.00           C  
HETATM   20  C   UNL     1       1.962   3.057   1.800  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.556  -1.637  -0.330  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.788  -2.001   0.212  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.914  -3.203   0.908  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.816  -4.030   1.059  1.00  0.00           C  
HETATM   25  C   UNL     1       0.413  -3.661   0.515  1.00  0.00           C  
HETATM   26  C   UNL     1       0.535  -2.468  -0.181  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.962  -1.112   0.049  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.382  -0.738  -1.229  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.472   0.087  -1.382  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.160   0.552  -0.257  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.739   0.177   1.022  1.00  0.00           C  
HETATM   32  C   UNL     1      -3.651  -0.653   1.172  1.00  0.00           C  
HETATM   33  C   UNL     1      -6.328   1.438  -0.420  1.00  0.00           C  
HETATM   34  O   UNL     1      -6.991   1.885   0.665  1.00  0.00           O  
HETATM   35  O   UNL     1      -6.693   1.764  -1.532  1.00  0.00           O  
HETATM   36  O   UNL     1       1.492  -4.474   0.664  1.00  0.00           O  
HETATM   37  C   UNL     1       2.721  -4.034   0.082  1.00  0.00           C  
HETATM   38  O   UNL     1      -0.935  -5.202   1.737  1.00  0.00           O  
HETATM   39  H   UNL     1       5.268  -0.552  -2.299  1.00  0.00           H  
HETATM   40  H   UNL     1       3.005  -1.030  -3.131  1.00  0.00           H  
HETATM   41  H   UNL     1       3.578   1.283   1.187  1.00  0.00           H  
HETATM   42  H   UNL     1       6.968   1.483   1.488  1.00  0.00           H  
HETATM   43  H   UNL     1       6.918  -0.140  -1.574  1.00  0.00           H  
HETATM   44  H   UNL     1       7.922   0.501  -0.388  1.00  0.00           H  
HETATM   45  H   UNL     1       0.649  -0.664  -2.873  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.302  -0.200  -1.705  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.114   0.661   0.663  1.00  0.00           H  
HETATM   48  H   UNL     1       0.997   0.369   1.549  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.115   2.144  -1.785  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.581   2.436  -0.798  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.515   5.054  -0.479  1.00  0.00           H  
HETATM   52  H   UNL     1       0.971   6.221   1.127  1.00  0.00           H  
HETATM   53  H   UNL     1       2.510   4.982   2.546  1.00  0.00           H  
HETATM   54  H   UNL     1       2.646   2.508   2.430  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.867  -3.488   1.329  1.00  0.00           H  
HETATM   56  H   UNL     1       1.489  -2.185  -0.601  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.850  -1.097  -2.098  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.796   0.377  -2.371  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.269   0.535   1.892  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.326  -0.943   2.160  1.00  0.00           H  
HETATM   61  H   UNL     1      -7.750   2.463   0.508  1.00  0.00           H  
HETATM   62  H   UNL     1       3.010  -3.080   0.522  1.00  0.00           H  
HETATM   63  H   UNL     1       3.499  -4.773   0.274  1.00  0.00           H  
HETATM   64  H   UNL     1       2.591  -3.914  -0.994  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.178  -5.955   1.182  1.00  0.00           H  
CONECT    1    2    2    6    7                                       
CONECT    2    3    1    1   39                                       
CONECT    3    4    4    2   40                                       
CONECT    4   10    3    3    5                                       
CONECT    5    4   13    6    6                                       
CONECT    6    5    5    1   41                                       
CONECT    7    1    8    8    9                                       
CONECT    8    7    7   42                                            
CONECT    9    7   43   44                                            
CONECT   10   11    4   45                                            
CONECT   11   21   10   12   46                                       
CONECT   12   11   14   13   47                                       
CONECT   13   12    5   16   48                                       
CONECT   14   12   15   49   50                                       
CONECT   15   14   17   17   16                                       
CONECT   16   13   15   20   20                                       
CONECT   17   15   15   18   51                                       
CONECT   18   17   19   19   52                                       
CONECT   19   18   18   20   53                                       
CONECT   20   16   16   19   54                                       
CONECT   21   22   22   26   11                                       
CONECT   22   23   27   21   21                                       
CONECT   23   24   24   22   55                                       
CONECT   24   38   23   23   25                                       
CONECT   25   24   36   26   26                                       
CONECT   26   25   25   21   56                                       
CONECT   27   32   22   28   28                                       
CONECT   28   27   27   29   57                                       
CONECT   29   30   30   28   58                                       
CONECT   30   31   33   29   29                                       
CONECT   31   32   32   30   59                                       
CONECT   32   31   31   27   60                                       
CONECT   33   35   35   30   34                                       
CONECT   34   33   61                                                 
CONECT   35   33   33                                                 
CONECT   36   25   37                                                 
CONECT   37   36   62   63   64                                       
CONECT   38   24   65                                                 
CONECT   39    2                                                      
CONECT   40    3                                                      
CONECT   41    6                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   12                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   14                                                      
CONECT   51   17                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   20                                                      
CONECT   55   23                                                      
CONECT   56   26                                                      
CONECT   57   28                                                      
CONECT   58   29                                                      
CONECT   59   31                                                      
CONECT   60   32                                                      
CONECT   61   34                                                      
CONECT   62   37                                                      
CONECT   63   37                                                      
CONECT   64   37                                                      
CONECT   65   38                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
