COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -7.635   2.365  -1.191  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.889   1.195  -0.600  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.817   0.447  -1.029  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.503   0.911   0.621  1.00  0.00           C  
HETATM    5  C   UNL     1      -8.611   1.866   0.816  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.167  -1.411  -0.719  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.794  -1.439  -0.586  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.821  -2.592  -1.357  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.642  -3.225  -1.704  1.00  0.00           C  
HETATM   10  C   UNL     1       0.569  -2.714  -1.286  1.00  0.00           C  
HETATM   11  C   UNL     1       0.606  -1.555  -0.511  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.582  -0.915  -0.166  1.00  0.00           C  
HETATM   13  C   UNL     1       1.907  -1.003  -0.059  1.00  0.00           C  
HETATM   14  C   UNL     1       4.245   1.620   0.788  1.00  0.00           C  
HETATM   15  C   UNL     1       5.297   1.424   1.912  1.00  0.00           C  
HETATM   16  C   UNL     1       6.347   2.510   1.596  1.00  0.00           C  
HETATM   17  C   UNL     1       5.141   2.017  -0.412  1.00  0.00           C  
HETATM   18  C   UNL     1       7.992   4.563   0.239  1.00  0.00           C  
HETATM   19  C   UNL     1       2.204  -4.031   0.926  1.00  0.00           C  
HETATM   20  C   UNL     1       4.245  -3.869  -0.326  1.00  0.00           C  
HETATM   21  O   UNL     1       6.728   3.978  -1.666  1.00  0.00           O  
HETATM   22  C   UNL     1       6.931   3.777  -0.487  1.00  0.00           C  
HETATM   23  C   UNL     1       8.660   5.538  -0.733  1.00  0.00           C  
HETATM   24  N   UNL     1       6.207   2.852   0.173  1.00  0.00           N  
HETATM   25  N   UNL     1       3.527   0.373   0.518  1.00  0.00           N  
HETATM   26  C   UNL     1       4.029  -0.871   0.654  1.00  0.00           C  
HETATM   27  C   UNL     1       3.053  -1.756   0.303  1.00  0.00           C  
HETATM   28  C   UNL     1       3.169  -3.234   0.301  1.00  0.00           C  
HETATM   29  C   UNL     1       4.314  -5.246  -0.304  1.00  0.00           C  
HETATM   30  N   UNL     1       3.379  -5.962   0.292  1.00  0.00           N  
HETATM   31  C   UNL     1       2.350  -5.402   0.900  1.00  0.00           C  
HETATM   32  N   UNL     1       2.204   0.270   0.070  1.00  0.00           N  
HETATM   33  O   UNL     1      -2.955  -0.820  -0.247  1.00  0.00           O  
HETATM   34  C   UNL     1      -5.342  -0.593  -0.248  1.00  0.00           C  
HETATM   35  C   UNL     1      -5.943  -0.883   0.964  1.00  0.00           C  
HETATM   36  C   UNL     1      -7.019  -0.140   1.404  1.00  0.00           C  
HETATM   37  O   UNL     1      -9.346   1.889   1.783  1.00  0.00           O  
HETATM   38  N   UNL     1      -8.689   2.707  -0.230  1.00  0.00           N  
HETATM   39  C   UNL     1      -9.666   3.788  -0.384  1.00  0.00           C  
HETATM   40  H   UNL     1      -6.960   3.211  -1.324  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.076   2.085  -2.148  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.345   0.671  -1.975  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.157  -1.439  -1.808  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.252  -2.426  -0.330  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.767  -2.997  -1.686  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.670  -4.122  -2.305  1.00  0.00           H  
HETATM   47  H   UNL     1       1.488  -3.211  -1.558  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.558  -0.017   0.434  1.00  0.00           H  
HETATM   49  H   UNL     1       3.551   2.422   1.039  1.00  0.00           H  
HETATM   50  H   UNL     1       4.851   1.593   2.892  1.00  0.00           H  
HETATM   51  H   UNL     1       5.739   0.429   1.858  1.00  0.00           H  
HETATM   52  H   UNL     1       6.165   3.392   2.209  1.00  0.00           H  
HETATM   53  H   UNL     1       7.348   2.124   1.787  1.00  0.00           H  
HETATM   54  H   UNL     1       5.569   1.128  -0.876  1.00  0.00           H  
HETATM   55  H   UNL     1       4.567   2.587  -1.142  1.00  0.00           H  
HETATM   56  H   UNL     1       7.536   5.120   1.057  1.00  0.00           H  
HETATM   57  H   UNL     1       8.741   3.879   0.638  1.00  0.00           H  
HETATM   58  H   UNL     1       1.360  -3.579   1.425  1.00  0.00           H  
HETATM   59  H   UNL     1       5.013  -3.290  -0.816  1.00  0.00           H  
HETATM   60  H   UNL     1       9.427   6.106  -0.208  1.00  0.00           H  
HETATM   61  H   UNL     1       9.116   4.981  -1.551  1.00  0.00           H  
HETATM   62  H   UNL     1       7.911   6.222  -1.133  1.00  0.00           H  
HETATM   63  H   UNL     1       5.027  -1.121   0.981  1.00  0.00           H  
HETATM   64  H   UNL     1       5.141  -5.746  -0.786  1.00  0.00           H  
HETATM   65  H   UNL     1       1.613  -6.025   1.383  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.569  -1.696   1.569  1.00  0.00           H  
HETATM   67  H   UNL     1      -7.485  -0.369   2.350  1.00  0.00           H  
HETATM   68  H   UNL     1     -10.551   3.408  -0.896  1.00  0.00           H  
HETATM   69  H   UNL     1      -9.949   4.165   0.599  1.00  0.00           H  
HETATM   70  H   UNL     1      -9.226   4.595  -0.970  1.00  0.00           H  
CONECT    1    2   38   40   41                                       
CONECT    2    3    1    4    4                                       
CONECT    3   34   34    2   42                                       
CONECT    4    2    2   36    5                                       
CONECT    5    4   38   37   37                                       
CONECT    6   33   34   43   44                                       
CONECT    7    8    8   12   33                                       
CONECT    8    9    7    7   45                                       
CONECT    9   10   10    8   46                                       
CONECT   10    9    9   11   47                                       
CONECT   11   10   13   12   12                                       
CONECT   12   11   11    7   48                                       
CONECT   13   27   32   32   11                                       
CONECT   14   15   17   25   49                                       
CONECT   15   16   14   50   51                                       
CONECT   16   24   15   52   53                                       
CONECT   17   24   14   54   55                                       
CONECT   18   22   23   56   57                                       
CONECT   19   28   28   31   58                                       
CONECT   20   29   29   28   59                                       
CONECT   21   22   22                                                 
CONECT   22   21   21   18   24                                       
CONECT   23   18   60   61   62                                       
CONECT   24   22   16   17                                            
CONECT   25   26   14   32                                            
CONECT   26   25   27   27   63                                       
CONECT   27   26   26   28   13                                       
CONECT   28   20   27   19   19                                       
CONECT   29   20   20   30   64                                       
CONECT   30   29   31   31                                            
CONECT   31   30   30   19   65                                       
CONECT   32   25   13   13                                            
CONECT   33    7    6                                                 
CONECT   34    6    3    3   35                                       
CONECT   35   34   36   36   66                                       
CONECT   36   35   35    4   67                                       
CONECT   37    5    5                                                 
CONECT   38    1    5   39                                            
CONECT   39   38   68   69   70                                       
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    3                                                      
CONECT   43    6                                                      
CONECT   44    6                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47   10                                                      
CONECT   48   12                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   16                                                      
CONECT   54   17                                                      
CONECT   55   17                                                      
CONECT   56   18                                                      
CONECT   57   18                                                      
CONECT   58   19                                                      
CONECT   59   20                                                      
CONECT   60   23                                                      
CONECT   61   23                                                      
CONECT   62   23                                                      
CONECT   63   26                                                      
CONECT   64   29                                                      
CONECT   65   31                                                      
CONECT   66   35                                                      
CONECT   67   36                                                      
CONECT   68   39                                                      
CONECT   69   39                                                      
CONECT   70   39                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
