COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.973  -0.565   0.246  1.00  0.00           C  
HETATM    2  C   UNL     1       4.659  -1.167  -0.181  1.00  0.00           C  
HETATM    3  O   UNL     1       4.613  -1.901  -1.145  1.00  0.00           O  
HETATM    4  C   UNL     1       7.081  -1.037  -0.697  1.00  0.00           C  
HETATM    5  C   UNL     1       8.415  -0.426  -0.264  1.00  0.00           C  
HETATM    6  C   UNL     1       9.523  -0.898  -1.207  1.00  0.00           C  
HETATM    7  C   UNL     1      10.857  -0.286  -0.774  1.00  0.00           C  
HETATM    8  N   UNL     1       3.535  -0.889   0.509  1.00  0.00           N  
HETATM    9  C   UNL     1       2.257  -1.474   0.093  1.00  0.00           C  
HETATM   10  C   UNL     1       1.126  -0.598   0.567  1.00  0.00           C  
HETATM   11  O   UNL     1       1.272   0.105   1.544  1.00  0.00           O  
HETATM   12  C   UNL     1       2.113  -2.869   0.705  1.00  0.00           C  
HETATM   13  C   UNL     1       0.789  -3.490   0.253  1.00  0.00           C  
HETATM   14  C   UNL     1       2.131  -2.761   2.231  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.467  -0.410  -0.079  1.00  0.00           C  
HETATM   16  C   UNL     1       0.306   3.699   0.019  1.00  0.00           C  
HETATM   17  C   UNL     1       0.191   2.279   0.512  1.00  0.00           C  
HETATM   18  N   UNL     1      -0.048  -0.597  -0.096  1.00  0.00           N  
HETATM   19  O   UNL     1      -0.529   4.147  -0.738  1.00  0.00           O  
HETATM   20  N   UNL     1       1.334   4.471   0.423  1.00  0.00           N  
HETATM   21  C   UNL     1       1.442   5.853  -0.052  1.00  0.00           C  
HETATM   22  C   UNL     1       2.342   3.929   1.337  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.174   0.189   0.412  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.058   1.630  -0.088  1.00  0.00           C  
HETATM   25  O   UNL     1      -2.449  -1.396  -0.784  1.00  0.00           O  
HETATM   26  N   UNL     1      -3.643   0.151   0.265  1.00  0.00           N  
HETATM   27  C   UNL     1      -4.900  -0.432  -0.212  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.216   0.112  -1.607  1.00  0.00           C  
HETATM   29  O   UNL     1      -4.160  -0.235  -2.504  1.00  0.00           O  
HETATM   30  C   UNL     1      -6.509  -0.488  -2.098  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.602  -1.969  -2.359  1.00  0.00           C  
HETATM   32  C   UNL     1      -7.552   0.279  -2.298  1.00  0.00           C  
HETATM   33  C   UNL     1      -6.031  -0.061   0.749  1.00  0.00           C  
HETATM   34  C   UNL     1      -5.760  -0.682   2.121  1.00  0.00           C  
HETATM   35  C   UNL     1      -6.822  -0.208   3.114  1.00  0.00           C  
HETATM   36  C   UNL     1      -5.809  -2.207   2.010  1.00  0.00           C  
HETATM   37  H   UNL     1       5.903   0.523   0.210  1.00  0.00           H  
HETATM   38  H   UNL     1       6.203  -0.880   1.264  1.00  0.00           H  
HETATM   39  H   UNL     1       7.150  -2.124  -0.661  1.00  0.00           H  
HETATM   40  H   UNL     1       6.850  -0.721  -1.715  1.00  0.00           H  
HETATM   41  H   UNL     1       8.345   0.662  -0.300  1.00  0.00           H  
HETATM   42  H   UNL     1       8.645  -0.741   0.754  1.00  0.00           H  
HETATM   43  H   UNL     1       9.592  -1.985  -1.171  1.00  0.00           H  
HETATM   44  H   UNL     1       9.292  -0.582  -2.225  1.00  0.00           H  
HETATM   45  H   UNL     1      10.787   0.801  -0.810  1.00  0.00           H  
HETATM   46  H   UNL     1      11.087  -0.602   0.244  1.00  0.00           H  
HETATM   47  H   UNL     1      11.646  -0.623  -1.446  1.00  0.00           H  
HETATM   48  H   UNL     1       3.571  -0.302   1.280  1.00  0.00           H  
HETATM   49  H   UNL     1       2.228  -1.549  -0.994  1.00  0.00           H  
HETATM   50  H   UNL     1       2.940  -3.498   0.375  1.00  0.00           H  
HETATM   51  H   UNL     1       0.688  -4.485   0.685  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.038  -2.863   0.586  1.00  0.00           H  
HETATM   53  H   UNL     1       0.775  -3.562  -0.835  1.00  0.00           H  
HETATM   54  H   UNL     1       1.303  -2.133   2.560  1.00  0.00           H  
HETATM   55  H   UNL     1       2.027  -3.755   2.667  1.00  0.00           H  
HETATM   56  H   UNL     1       3.073  -2.319   2.553  1.00  0.00           H  
HETATM   57  H   UNL     1       1.074   1.717   0.208  1.00  0.00           H  
HETATM   58  H   UNL     1       0.115   2.277   1.599  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.146  -1.116  -0.909  1.00  0.00           H  
HETATM   60  H   UNL     1       0.608   6.075  -0.718  1.00  0.00           H  
HETATM   61  H   UNL     1       1.418   6.533   0.800  1.00  0.00           H  
HETATM   62  H   UNL     1       2.381   5.979  -0.591  1.00  0.00           H  
HETATM   63  H   UNL     1       2.037   4.114   2.366  1.00  0.00           H  
HETATM   64  H   UNL     1       2.441   2.856   1.174  1.00  0.00           H  
HETATM   65  H   UNL     1       3.300   4.415   1.149  1.00  0.00           H  
HETATM   66  H   UNL     1      -1.161   0.181   1.502  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.941   2.193   0.215  1.00  0.00           H  
HETATM   68  H   UNL     1      -0.982   1.632  -1.176  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.658   0.940   0.829  1.00  0.00           H  
HETATM   70  H   UNL     1      -4.803  -1.517  -0.258  1.00  0.00           H  
HETATM   71  H   UNL     1      -5.313   1.196  -1.561  1.00  0.00           H  
HETATM   72  H   UNL     1      -3.296   0.118  -2.250  1.00  0.00           H  
HETATM   73  H   UNL     1      -7.605  -2.215  -2.706  1.00  0.00           H  
HETATM   74  H   UNL     1      -5.875  -2.250  -3.122  1.00  0.00           H  
HETATM   75  H   UNL     1      -6.391  -2.514  -1.439  1.00  0.00           H  
HETATM   76  H   UNL     1      -8.479  -0.150  -2.650  1.00  0.00           H  
HETATM   77  H   UNL     1      -7.486   1.341  -2.111  1.00  0.00           H  
HETATM   78  H   UNL     1      -6.086   1.023   0.845  1.00  0.00           H  
HETATM   79  H   UNL     1      -6.977  -0.440   0.360  1.00  0.00           H  
HETATM   80  H   UNL     1      -4.773  -0.375   2.469  1.00  0.00           H  
HETATM   81  H   UNL     1      -7.798  -0.585   2.810  1.00  0.00           H  
HETATM   82  H   UNL     1      -6.582  -0.582   4.109  1.00  0.00           H  
HETATM   83  H   UNL     1      -6.843   0.882   3.132  1.00  0.00           H  
HETATM   84  H   UNL     1      -5.052  -2.544   1.302  1.00  0.00           H  
HETATM   85  H   UNL     1      -5.615  -2.649   2.987  1.00  0.00           H  
HETATM   86  H   UNL     1      -6.795  -2.514   1.661  1.00  0.00           H  
CONECT    1    2    4   37   38                                       
CONECT    2    1    8    3    3                                       
CONECT    3    2    2                                                 
CONECT    4    1    5   39   40                                       
CONECT    5    6    4   41   42                                       
CONECT    6    7    5   43   44                                       
CONECT    7    6   45   46   47                                       
CONECT    8    2    9   48                                            
CONECT    9    8   12   10   49                                       
CONECT   10    9   11   11   18                                       
CONECT   11   10   10                                                 
CONECT   12   13    9   14   50                                       
CONECT   13   12   51   52   53                                       
CONECT   14   12   54   55   56                                       
CONECT   15   23   25   25   26                                       
CONECT   16   17   20   19   19                                       
CONECT   17   16   24   57   58                                       
CONECT   18   10   23   59                                            
CONECT   19   16   16                                                 
CONECT   20   22   21   16                                            
CONECT   21   20   60   61   62                                       
CONECT   22   20   63   64   65                                       
CONECT   23   18   24   15   66                                       
CONECT   24   17   23   67   68                                       
CONECT   25   15   15                                                 
CONECT   26   15   27   69                                            
CONECT   27   26   33   28   70                                       
CONECT   28   27   30   29   71                                       
CONECT   29   28   72                                                 
CONECT   30   31   32   32   28                                       
CONECT   31   30   73   74   75                                       
CONECT   32   30   30   76   77                                       
CONECT   33   27   34   78   79                                       
CONECT   34   35   36   33   80                                       
CONECT   35   34   81   82   83                                       
CONECT   36   34   84   85   86                                       
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    4                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44    6                                                      
CONECT   45    7                                                      
CONECT   46    7                                                      
CONECT   47    7                                                      
CONECT   48    8                                                      
CONECT   49    9                                                      
CONECT   50   12                                                      
CONECT   51   13                                                      
CONECT   52   13                                                      
CONECT   53   13                                                      
CONECT   54   14                                                      
CONECT   55   14                                                      
CONECT   56   14                                                      
CONECT   57   17                                                      
CONECT   58   17                                                      
CONECT   59   18                                                      
CONECT   60   21                                                      
CONECT   61   21                                                      
CONECT   62   21                                                      
CONECT   63   22                                                      
CONECT   64   22                                                      
CONECT   65   22                                                      
CONECT   66   23                                                      
CONECT   67   24                                                      
CONECT   68   24                                                      
CONECT   69   26                                                      
CONECT   70   27                                                      
CONECT   71   28                                                      
CONECT   72   29                                                      
CONECT   73   31                                                      
CONECT   74   31                                                      
CONECT   75   31                                                      
CONECT   76   32                                                      
CONECT   77   32                                                      
CONECT   78   33                                                      
CONECT   79   33                                                      
CONECT   80   34                                                      
CONECT   81   35                                                      
CONECT   82   35                                                      
CONECT   83   35                                                      
CONECT   84   36                                                      
CONECT   85   36                                                      
CONECT   86   36                                                      
MASTER        0    0    0    0    0    0    0    0   86    0   86    0
END
