COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -7.193   1.754   0.189  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.080   1.937  -0.261  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.399  -0.478  -0.529  1.00  0.00           C  
HETATM    4  N   UNL     1      -9.304   0.807   0.597  1.00  0.00           N  
HETATM    5  C   UNL     1      -3.709  -0.375  -1.902  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.314  -1.341  -1.565  1.00  0.00           C  
HETATM    7  N   UNL     1      -7.511  -0.581   0.146  1.00  0.00           N  
HETATM    8  C   UNL     1      -0.253  -1.577  -0.565  1.00  0.00           C  
HETATM    9  C   UNL     1       1.096  -1.406   2.711  1.00  0.00           C  
HETATM   10  C   UNL     1       1.635  -2.180   0.400  1.00  0.00           C  
HETATM   11  C   UNL     1       3.014  -2.716   0.685  1.00  0.00           C  
HETATM   12  N   UNL     1      -6.160   2.612   0.009  1.00  0.00           N  
HETATM   13  C   UNL     1       5.303  -2.051   1.115  1.00  0.00           C  
HETATM   14  C   UNL     1       6.267  -0.863   1.098  1.00  0.00           C  
HETATM   15  C   UNL     1       7.351   0.754  -0.344  1.00  0.00           C  
HETATM   16  N   UNL     1      -5.353   0.602  -0.267  1.00  0.00           N  
HETATM   17  O   UNL     1      -1.145  -1.676  -2.721  1.00  0.00           O  
HETATM   18  N   UNL     1      -2.470  -0.754  -1.196  1.00  0.00           N  
HETATM   19  C   UNL     1      -3.006  -0.235   0.080  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.688   0.455   0.017  1.00  0.00           C  
HETATM   21  C   UNL     1      -8.785  -0.395   0.421  1.00  0.00           C  
HETATM   22  C   UNL     1      -9.680  -1.599   0.558  1.00  0.00           C  
HETATM   23  C   UNL     1      -8.557   1.901   0.493  1.00  0.00           C  
HETATM   24  N   UNL     1      -9.110   3.156   0.680  1.00  0.00           N  
HETATM   25  C   UNL     1       1.006  -2.178  -0.799  1.00  0.00           C  
HETATM   26  N   UNL     1       0.799  -1.605   1.291  1.00  0.00           N  
HETATM   27  N   UNL     1      -0.297  -1.262   0.714  1.00  0.00           N  
HETATM   28  N   UNL     1       3.990  -1.621   0.613  1.00  0.00           N  
HETATM   29  C   UNL     1       4.097  -1.100  -0.757  1.00  0.00           C  
HETATM   30  C   UNL     1       5.062   0.088  -0.774  1.00  0.00           C  
HETATM   31  N   UNL     1       6.375  -0.342  -0.272  1.00  0.00           N  
HETATM   32  C   UNL     1       8.764   0.209  -0.052  1.00  0.00           C  
HETATM   33  C   UNL     1       9.812   1.093  -0.540  1.00  0.00           C  
HETATM   34  C   UNL     1       9.774   2.479   0.136  1.00  0.00           C  
HETATM   35  C   UNL     1       8.703   3.305  -0.525  1.00  0.00           C  
HETATM   36  C   UNL     1       7.355   3.223   0.216  1.00  0.00           C  
HETATM   37  C   UNL     1       7.018   1.796   0.689  1.00  0.00           C  
HETATM   38  H   UNL     1      -4.109   2.372  -0.452  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.806  -1.466  -0.315  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.050  -1.119  -2.622  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.692   0.635  -2.310  1.00  0.00           H  
HETATM   42  H   UNL     1       0.769  -2.278   3.277  1.00  0.00           H  
HETATM   43  H   UNL     1       2.170  -1.269   2.842  1.00  0.00           H  
HETATM   44  H   UNL     1       0.571  -0.521   3.072  1.00  0.00           H  
HETATM   45  H   UNL     1       3.034  -3.155   1.683  1.00  0.00           H  
HETATM   46  H   UNL     1       3.267  -3.478  -0.052  1.00  0.00           H  
HETATM   47  H   UNL     1       5.693  -2.845   0.478  1.00  0.00           H  
HETATM   48  H   UNL     1       5.199  -2.421   2.135  1.00  0.00           H  
HETATM   49  H   UNL     1       5.891  -0.080   1.756  1.00  0.00           H  
HETATM   50  H   UNL     1       7.249  -1.187   1.443  1.00  0.00           H  
HETATM   51  H   UNL     1       7.329   1.199  -1.339  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.780   0.816   0.256  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.786  -0.869   0.940  1.00  0.00           H  
HETATM   54  H   UNL     1      -9.686  -1.932   1.596  1.00  0.00           H  
HETATM   55  H   UNL     1     -10.694  -1.334   0.257  1.00  0.00           H  
HETATM   56  H   UNL     1      -9.309  -2.402  -0.079  1.00  0.00           H  
HETATM   57  H   UNL     1      -8.555   3.947   0.601  1.00  0.00           H  
HETATM   58  H   UNL     1     -10.053   3.244   0.889  1.00  0.00           H  
HETATM   59  H   UNL     1       1.386  -2.556  -1.737  1.00  0.00           H  
HETATM   60  H   UNL     1       4.474  -1.883  -1.415  1.00  0.00           H  
HETATM   61  H   UNL     1       3.115  -0.777  -1.101  1.00  0.00           H  
HETATM   62  H   UNL     1       5.166   0.458  -1.794  1.00  0.00           H  
HETATM   63  H   UNL     1       4.671   0.882  -0.137  1.00  0.00           H  
HETATM   64  H   UNL     1       8.880   0.086   1.025  1.00  0.00           H  
HETATM   65  H   UNL     1       8.873  -0.764  -0.532  1.00  0.00           H  
HETATM   66  H   UNL     1      10.781   0.633  -0.348  1.00  0.00           H  
HETATM   67  H   UNL     1       9.691   1.224  -1.616  1.00  0.00           H  
HETATM   68  H   UNL     1       9.545   2.363   1.196  1.00  0.00           H  
HETATM   69  H   UNL     1      10.741   2.969   0.022  1.00  0.00           H  
HETATM   70  H   UNL     1       9.027   4.345  -0.553  1.00  0.00           H  
HETATM   71  H   UNL     1       8.566   2.951  -1.546  1.00  0.00           H  
HETATM   72  H   UNL     1       7.390   3.882   1.084  1.00  0.00           H  
HETATM   73  H   UNL     1       6.565   3.568  -0.452  1.00  0.00           H  
HETATM   74  H   UNL     1       5.953   1.741   0.914  1.00  0.00           H  
HETATM   75  H   UNL     1       7.580   1.584   1.598  1.00  0.00           H  
CONECT    1   12   20   20   23                                       
CONECT    2   16   12   12   38                                       
CONECT    3    5   19   16   39                                       
CONECT    4   23   23   21                                            
CONECT    5   18    3   40   41                                       
CONECT    6    8   17   17   18                                       
CONECT    7   20   21   21                                            
CONECT    8   27   27   25    6                                       
CONECT    9   26   42   43   44                                       
CONECT   10   26   11   25   25                                       
CONECT   11   28   10   45   46                                       
CONECT   12    2    2    1                                            
CONECT   13   14   28   47   48                                       
CONECT   14   31   13   49   50                                       
CONECT   15   37   32   31   51                                       
CONECT   16    3    2   20                                            
CONECT   17    6    6                                                 
CONECT   18    6    5   19                                            
CONECT   19   18    3   52   53                                       
CONECT   20   16    1    1    7                                       
CONECT   21    7    7    4   22                                       
CONECT   22   21   54   55   56                                       
CONECT   23    1   24    4    4                                       
CONECT   24   23   57   58                                            
CONECT   25   10   10    8   59                                       
CONECT   26    9   27   10                                            
CONECT   27   26    8    8                                            
CONECT   28   29   13   11                                            
CONECT   29   30   28   60   61                                       
CONECT   30   31   29   62   63                                       
CONECT   31   15   30   14                                            
CONECT   32   33   15   64   65                                       
CONECT   33   34   32   66   67                                       
CONECT   34   35   33   68   69                                       
CONECT   35   36   34   70   71                                       
CONECT   36   35   37   72   73                                       
CONECT   37   36   15   74   75                                       
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    5                                                      
CONECT   41    5                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   11                                                      
CONECT   46   11                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   19                                                      
CONECT   53   19                                                      
CONECT   54   22                                                      
CONECT   55   22                                                      
CONECT   56   22                                                      
CONECT   57   24                                                      
CONECT   58   24                                                      
CONECT   59   25                                                      
CONECT   60   29                                                      
CONECT   61   29                                                      
CONECT   62   30                                                      
CONECT   63   30                                                      
CONECT   64   32                                                      
CONECT   65   32                                                      
CONECT   66   33                                                      
CONECT   67   33                                                      
CONECT   68   34                                                      
CONECT   69   34                                                      
CONECT   70   35                                                      
CONECT   71   35                                                      
CONECT   72   36                                                      
CONECT   73   36                                                      
CONECT   74   37                                                      
CONECT   75   37                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
