COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.936   0.119  -3.838  1.00  0.00           C  
HETATM    2  C   UNL     1       5.935  -0.340  -2.425  1.00  0.00           C  
HETATM    3  C   UNL     1       4.529   1.444  -2.684  1.00  0.00           C  
HETATM    4  C   UNL     1       5.090   0.444  -1.736  1.00  0.00           C  
HETATM    5  C   UNL     1       4.714   0.422  -0.368  1.00  0.00           C  
HETATM    6  C   UNL     1       3.396   0.322   0.172  1.00  0.00           C  
HETATM    7  C   UNL     1       5.583   0.561   0.689  1.00  0.00           C  
HETATM    8  N   UNL     1       4.852   0.540   1.851  1.00  0.00           N  
HETATM    9  C   UNL     1       6.719  -1.451  -2.019  1.00  0.00           C  
HETATM   10  C   UNL     1       6.422  -2.756  -2.343  1.00  0.00           C  
HETATM   11  C   UNL     1       8.423  -2.774  -1.301  1.00  0.00           C  
HETATM   12  C   UNL     1       2.110   0.165  -0.394  1.00  0.00           C  
HETATM   13  C   UNL     1       0.987   0.120   0.438  1.00  0.00           C  
HETATM   14  C   UNL     1       2.382   0.384   2.404  1.00  0.00           C  
HETATM   15  C   UNL     1       1.123   0.231   1.817  1.00  0.00           C  
HETATM   16  C   UNL     1      10.028  -0.777  -0.229  1.00  0.00           C  
HETATM   17  C   UNL     1      10.442  -2.103  -0.180  1.00  0.00           C  
HETATM   18  O   UNL     1       6.595  -0.370  -4.740  1.00  0.00           O  
HETATM   19  C   UNL     1       7.550  -5.983  -1.251  1.00  0.00           C  
HETATM   20  C   UNL     1       4.739  -4.692   0.954  1.00  0.00           C  
HETATM   21  C   UNL     1       4.567  -3.996   2.148  1.00  0.00           C  
HETATM   22  C   UNL     1       6.875  -4.293   2.598  1.00  0.00           C  
HETATM   23  C   UNL     1       5.649  -3.785   3.004  1.00  0.00           C  
HETATM   24  C   UNL     1       5.460   0.644   3.171  1.00  0.00           C  
HETATM   25  C   UNL     1       6.051  -0.686   3.644  1.00  0.00           C  
HETATM   26  C   UNL     1       5.489  -3.078   4.324  1.00  0.00           C  
HETATM   27  C   UNL     1       4.981  -1.640   4.187  1.00  0.00           C  
HETATM   28  C   UNL     1       8.310  -5.163   4.428  1.00  0.00           C  
HETATM   29  C   UNL     1       7.977  -1.445  -1.349  1.00  0.00           C  
HETATM   30  C   UNL     1       8.808  -0.434  -0.820  1.00  0.00           C  
HETATM   31  C   UNL     1       9.655  -3.121  -0.723  1.00  0.00           C  
HETATM   32  N   UNL     1       7.473  -3.544  -1.943  1.00  0.00           N  
HETATM   33  C   UNL     1       7.636  -4.926  -2.354  1.00  0.00           C  
HETATM   34  C   UNL     1       6.183  -6.068  -0.563  1.00  0.00           C  
HETATM   35  C   UNL     1       6.006  -5.171   0.637  1.00  0.00           C  
HETATM   36  N   UNL     1       7.074  -4.981   1.450  1.00  0.00           N  
HETATM   37  N   UNL     1       8.000  -4.148   3.444  1.00  0.00           N  
HETATM   38  C   UNL     1       8.858  -2.989   3.322  1.00  0.00           C  
HETATM   39  O   UNL     1       3.747   2.335  -2.395  1.00  0.00           O  
HETATM   40  N   UNL     1       5.074   1.172  -3.902  1.00  0.00           N  
HETATM   41  C   UNL     1       3.508   0.421   1.566  1.00  0.00           C  
HETATM   42  H   UNL     1       6.655   0.689   0.724  1.00  0.00           H  
HETATM   43  H   UNL     1       5.584  -3.180  -2.883  1.00  0.00           H  
HETATM   44  H   UNL     1       1.984   0.078  -1.469  1.00  0.00           H  
HETATM   45  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   46  H   UNL     1       2.474   0.462   3.482  1.00  0.00           H  
HETATM   47  H   UNL     1       0.239   0.196   2.449  1.00  0.00           H  
HETATM   48  H   UNL     1      10.661   0.003   0.186  1.00  0.00           H  
HETATM   49  H   UNL     1      11.397  -2.351   0.275  1.00  0.00           H  
HETATM   50  H   UNL     1       8.360  -5.856  -0.526  1.00  0.00           H  
HETATM   51  H   UNL     1       7.732  -6.951  -1.736  1.00  0.00           H  
HETATM   52  H   UNL     1       3.887  -4.877   0.308  1.00  0.00           H  
HETATM   53  H   UNL     1       3.574  -3.641   2.412  1.00  0.00           H  
HETATM   54  H   UNL     1       4.720   1.037   3.875  1.00  0.00           H  
HETATM   55  H   UNL     1       6.255   1.394   3.087  1.00  0.00           H  
HETATM   56  H   UNL     1       6.772  -0.486   4.446  1.00  0.00           H  
HETATM   57  H   UNL     1       6.612  -1.153   2.827  1.00  0.00           H  
HETATM   58  H   UNL     1       4.779  -3.655   4.930  1.00  0.00           H  
HETATM   59  H   UNL     1       6.438  -3.084   4.874  1.00  0.00           H  
HETATM   60  H   UNL     1       4.087  -1.623   3.560  1.00  0.00           H  
HETATM   61  H   UNL     1       4.671  -1.280   5.176  1.00  0.00           H  
HETATM   62  H   UNL     1       8.358  -6.145   3.951  1.00  0.00           H  
HETATM   63  H   UNL     1       7.539  -5.185   5.203  1.00  0.00           H  
HETATM   64  H   UNL     1       9.274  -4.952   4.898  1.00  0.00           H  
HETATM   65  H   UNL     1       8.511   0.610  -0.867  1.00  0.00           H  
HETATM   66  H   UNL     1      10.002  -4.148  -0.701  1.00  0.00           H  
HETATM   67  H   UNL     1       8.614  -4.992  -2.847  1.00  0.00           H  
HETATM   68  H   UNL     1       6.887  -5.137  -3.127  1.00  0.00           H  
HETATM   69  H   UNL     1       6.042  -7.095  -0.203  1.00  0.00           H  
HETATM   70  H   UNL     1       5.390  -5.881  -1.298  1.00  0.00           H  
HETATM   71  H   UNL     1       8.720  -2.520   2.344  1.00  0.00           H  
HETATM   72  H   UNL     1       9.907  -3.282   3.426  1.00  0.00           H  
HETATM   73  H   UNL     1       8.620  -2.258   4.100  1.00  0.00           H  
HETATM   74  H   UNL     1       4.874   1.696  -4.747  1.00  0.00           H  
CONECT    1    2   40   18   18                                       
CONECT    2    1    9    4    4                                       
CONECT    3    4   39   39   40                                       
CONECT    4    2    2    3    5                                       
CONECT    5    4    6    7    7                                       
CONECT    6    5   41   41   12                                       
CONECT    7    5    5    8   42                                       
CONECT    8    7   24   41                                            
CONECT    9    2   10   10   29                                       
CONECT   10    9    9   32   43                                       
CONECT   11   32   31   31   29                                       
CONECT   12    6   13   13   44                                       
CONECT   13   12   12   15   45                                       
CONECT   14   15   15   41   46                                       
CONECT   15   13   14   14   47                                       
CONECT   16   17   17   30   48                                       
CONECT   17   16   16   31   49                                       
CONECT   18    1    1                                                 
CONECT   19   34   33   50   51                                       
CONECT   20   35   35   21   52                                       
CONECT   21   20   23   23   53                                       
CONECT   22   37   36   36   23                                       
CONECT   23   21   21   22   26                                       
CONECT   24    8   25   54   55                                       
CONECT   25   24   27   56   57                                       
CONECT   26   23   27   58   59                                       
CONECT   27   25   26   60   61                                       
CONECT   28   37   62   63   64                                       
CONECT   29    9   11   30   30                                       
CONECT   30   16   29   29   65                                       
CONECT   31   11   11   17   66                                       
CONECT   32   10   11   33                                            
CONECT   33   19   32   67   68                                       
CONECT   34   19   35   69   70                                       
CONECT   35   20   20   34   36                                       
CONECT   36   22   22   35                                            
CONECT   37   22   28   38                                            
CONECT   38   37   71   72   73                                       
CONECT   39    3    3                                                 
CONECT   40    1    3   74                                            
CONECT   41    6    6    8   14                                       
CONECT   42    7                                                      
CONECT   43   10                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   19                                                      
CONECT   51   19                                                      
CONECT   52   20                                                      
CONECT   53   21                                                      
CONECT   54   24                                                      
CONECT   55   24                                                      
CONECT   56   25                                                      
CONECT   57   25                                                      
CONECT   58   26                                                      
CONECT   59   26                                                      
CONECT   60   27                                                      
CONECT   61   27                                                      
CONECT   62   28                                                      
CONECT   63   28                                                      
CONECT   64   28                                                      
CONECT   65   30                                                      
CONECT   66   31                                                      
CONECT   67   33                                                      
CONECT   68   33                                                      
CONECT   69   34                                                      
CONECT   70   34                                                      
CONECT   71   38                                                      
CONECT   72   38                                                      
CONECT   73   38                                                      
CONECT   74   40                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
