COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.859  -2.509   1.172  1.00  0.00           C  
HETATM    2  C   UNL     1       5.036  -3.794   0.344  1.00  0.00           C  
HETATM    3  C   UNL     1       5.752  -2.928  -0.706  1.00  0.00           C  
HETATM    4  C   UNL     1       4.955  -1.742  -0.152  1.00  0.00           C  
HETATM    5  C   UNL     1       3.605  -1.535  -0.840  1.00  0.00           C  
HETATM    6  O   UNL     1       5.700  -0.532  -0.067  1.00  0.00           O  
HETATM    7  C   UNL     1       5.035   0.589   0.323  1.00  0.00           C  
HETATM    8  C   UNL     1       5.783   1.703   0.692  1.00  0.00           C  
HETATM    9  C   UNL     1       5.152   2.864   1.087  1.00  0.00           C  
HETATM   10  C   UNL     1       3.771   2.922   1.117  1.00  0.00           C  
HETATM   11  C   UNL     1       3.079   4.191   1.545  1.00  0.00           C  
HETATM   12  C   UNL     1       2.834   5.076   0.321  1.00  0.00           C  
HETATM   13  C   UNL     1       3.026   1.818   0.755  1.00  0.00           C  
HETATM   14  C   UNL     1       3.653   0.646   0.359  1.00  0.00           C  
HETATM   15  C   UNL     1       2.794  -0.536  -0.009  1.00  0.00           C  
HETATM   16  N   UNL     1       1.640  -0.074  -0.793  1.00  0.00           N  
HETATM   17  C   UNL     1       0.512  -1.007  -0.668  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.623  -0.561  -1.592  1.00  0.00           C  
HETATM   19  O   UNL     1      -0.197  -0.664  -2.952  1.00  0.00           O  
HETATM   20  C   UNL     1      -1.843  -1.458  -1.371  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.976  -1.012  -2.296  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.451   0.358  -1.887  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.385   0.493  -0.876  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.955   1.481  -2.523  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.393   2.738  -2.149  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.327   2.872  -1.139  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.822   1.750  -0.502  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.838   1.897   0.601  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.273   1.308   1.896  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.942  -0.040   2.176  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.997  -0.916   3.001  1.00  0.00           C  
HETATM   32  C   UNL     1      -4.672  -2.191   2.219  1.00  0.00           C  
HETATM   33  C   UNL     1      -3.154  -2.350   2.114  1.00  0.00           C  
HETATM   34  C   UNL     1      -2.755  -2.441   0.664  1.00  0.00           C  
HETATM   35  O   UNL     1      -2.865  -3.494   0.071  1.00  0.00           O  
HETATM   36  N   UNL     1      -2.276  -1.356   0.024  1.00  0.00           N  
HETATM   37  H   UNL     1       3.884  -2.429   1.653  1.00  0.00           H  
HETATM   38  H   UNL     1       5.686  -2.310   1.853  1.00  0.00           H  
HETATM   39  H   UNL     1       5.684  -4.531   0.817  1.00  0.00           H  
HETATM   40  H   UNL     1       4.096  -4.219  -0.008  1.00  0.00           H  
HETATM   41  H   UNL     1       6.827  -2.845  -0.546  1.00  0.00           H  
HETATM   42  H   UNL     1       5.495  -3.186  -1.734  1.00  0.00           H  
HETATM   43  H   UNL     1       3.760  -1.139  -1.843  1.00  0.00           H  
HETATM   44  H   UNL     1       3.072  -2.484  -0.897  1.00  0.00           H  
HETATM   45  H   UNL     1       6.862   1.658   0.668  1.00  0.00           H  
HETATM   46  H   UNL     1       5.736   3.726   1.374  1.00  0.00           H  
HETATM   47  H   UNL     1       2.125   3.944   2.012  1.00  0.00           H  
HETATM   48  H   UNL     1       3.707   4.724   2.259  1.00  0.00           H  
HETATM   49  H   UNL     1       2.207   4.543  -0.393  1.00  0.00           H  
HETATM   50  H   UNL     1       2.334   5.993   0.631  1.00  0.00           H  
HETATM   51  H   UNL     1       3.788   5.322  -0.146  1.00  0.00           H  
HETATM   52  H   UNL     1       1.947   1.867   0.779  1.00  0.00           H  
HETATM   53  H   UNL     1       2.441  -1.023   0.899  1.00  0.00           H  
HETATM   54  H   UNL     1       1.370   0.859  -0.522  1.00  0.00           H  
HETATM   55  H   UNL     1       0.836  -2.009  -0.947  1.00  0.00           H  
HETATM   56  H   UNL     1       0.159  -1.013   0.364  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.887   0.473  -1.371  1.00  0.00           H  
HETATM   58  H   UNL     1       0.055  -1.558  -3.220  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.578  -2.491  -1.594  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.615  -0.979  -3.323  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.803  -1.719  -2.224  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.772  -0.384  -0.379  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.224   1.376  -3.312  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.005   3.615  -2.647  1.00  0.00           H  
HETATM   65  H   UNL     1      -4.670   3.854  -0.848  1.00  0.00           H  
HETATM   66  H   UNL     1      -6.063   2.953   0.750  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.750   1.366   0.328  1.00  0.00           H  
HETATM   68  H   UNL     1      -4.198   1.165   1.791  1.00  0.00           H  
HETATM   69  H   UNL     1      -5.471   1.991   2.722  1.00  0.00           H  
HETATM   70  H   UNL     1      -6.865   0.122   2.732  1.00  0.00           H  
HETATM   71  H   UNL     1      -6.167  -0.537   1.233  1.00  0.00           H  
HETATM   72  H   UNL     1      -4.076  -0.368   3.203  1.00  0.00           H  
HETATM   73  H   UNL     1      -5.476  -1.180   3.943  1.00  0.00           H  
HETATM   74  H   UNL     1      -5.092  -3.052   2.737  1.00  0.00           H  
HETATM   75  H   UNL     1      -5.100  -2.123   1.219  1.00  0.00           H  
HETATM   76  H   UNL     1      -2.666  -1.489   2.570  1.00  0.00           H  
HETATM   77  H   UNL     1      -2.847  -3.258   2.632  1.00  0.00           H  
HETATM   78  H   UNL     1      -2.218  -0.506   0.489  1.00  0.00           H  
CONECT    1    2    4   37   38                                       
CONECT    2    1    3   39   40                                       
CONECT    3    2    4   41   42                                       
CONECT    4    6    1    3    5                                       
CONECT    5    4   15   43   44                                       
CONECT    6    7    4                                                 
CONECT    7    8    6   14   14                                       
CONECT    8    9    9    7   45                                       
CONECT    9    8    8   10   46                                       
CONECT   10    9   11   13   13                                       
CONECT   11   12   10   47   48                                       
CONECT   12   11   49   50   51                                       
CONECT   13   10   10   14   52                                       
CONECT   14    7    7   13   15                                       
CONECT   15   14    5   16   53                                       
CONECT   16   15   17   54                                            
CONECT   17   16   18   55   56                                       
CONECT   18   19   17   20   57                                       
CONECT   19   18   58                                                 
CONECT   20   18   21   36   59                                       
CONECT   21   20   22   60   61                                       
CONECT   22   24   21   23   23                                       
CONECT   23   22   22   27   62                                       
CONECT   24   25   25   22   63                                       
CONECT   25   24   24   26   64                                       
CONECT   26   25   27   27   65                                       
CONECT   27   26   26   23   28                                       
CONECT   28   27   29   66   67                                       
CONECT   29   30   28   68   69                                       
CONECT   30   31   29   70   71                                       
CONECT   31   32   30   72   73                                       
CONECT   32   33   31   74   75                                       
CONECT   33   34   32   76   77                                       
CONECT   34   35   35   36   33                                       
CONECT   35   34   34                                                 
CONECT   36   20   34   78                                            
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    2                                                      
CONECT   41    3                                                      
CONECT   42    3                                                      
CONECT   43    5                                                      
CONECT   44    5                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47   11                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   12                                                      
CONECT   51   12                                                      
CONECT   52   13                                                      
CONECT   53   15                                                      
CONECT   54   16                                                      
CONECT   55   17                                                      
CONECT   56   17                                                      
CONECT   57   18                                                      
CONECT   58   19                                                      
CONECT   59   20                                                      
CONECT   60   21                                                      
CONECT   61   21                                                      
CONECT   62   23                                                      
CONECT   63   24                                                      
CONECT   64   25                                                      
CONECT   65   26                                                      
CONECT   66   28                                                      
CONECT   67   28                                                      
CONECT   68   29                                                      
CONECT   69   29                                                      
CONECT   70   30                                                      
CONECT   71   30                                                      
CONECT   72   31                                                      
CONECT   73   31                                                      
CONECT   74   32                                                      
CONECT   75   32                                                      
CONECT   76   33                                                      
CONECT   77   33                                                      
CONECT   78   36                                                      
MASTER        0    0    0    0    0    0    0    0   78    0   78    0
END
