COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.081   5.925  -0.189  1.00  0.00           C  
HETATM    2  N   UNL     1      -0.176   4.493  -0.395  1.00  0.00           N  
HETATM    3  C   UNL     1       0.866   3.674   0.240  1.00  0.00           C  
HETATM    4  C   UNL     1       0.517   3.458   1.714  1.00  0.00           C  
HETATM    5  C   UNL     1       0.952   2.341  -0.457  1.00  0.00           C  
HETATM    6  O   UNL     1       0.218   2.097  -1.391  1.00  0.00           O  
HETATM    7  N   UNL     1       1.845   1.420  -0.043  1.00  0.00           N  
HETATM    8  C   UNL     1       1.928   0.124  -0.720  1.00  0.00           C  
HETATM    9  C   UNL     1       0.580  -0.546  -0.682  1.00  0.00           C  
HETATM   10  O   UNL     1      -0.045  -0.668  -1.715  1.00  0.00           O  
HETATM   11  N   UNL     1       0.051  -1.011   0.448  1.00  0.00           N  
HETATM   12  C   UNL     1       2.974  -0.746  -0.021  1.00  0.00           C  
HETATM   13  C   UNL     1       4.341  -0.519  -0.670  1.00  0.00           C  
HETATM   14  N   UNL     1       5.319  -1.438  -0.082  1.00  0.00           N  
HETATM   15  C   UNL     1       6.599  -1.417  -0.502  1.00  0.00           C  
HETATM   16  O   UNL     1       6.942  -0.638  -1.366  1.00  0.00           O  
HETATM   17  C   UNL     1       7.606  -2.363   0.102  1.00  0.00           C  
HETATM   18  C   UNL     1       8.973  -2.135  -0.546  1.00  0.00           C  
HETATM   19  C   UNL     1       3.046  -0.377   1.465  1.00  0.00           C  
HETATM   20  C   UNL     1       1.663   0.042   1.961  1.00  0.00           C  
HETATM   21  C   UNL     1       0.696  -1.122   1.763  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.420  -1.080   2.774  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.566  -1.263   2.167  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.322  -1.483   0.690  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.302  -0.680  -0.126  1.00  0.00           C  
HETATM   26  O   UNL     1      -1.904   0.209  -0.849  1.00  0.00           O  
HETATM   27  N   UNL     1      -3.621  -0.950  -0.054  1.00  0.00           N  
HETATM   28  C   UNL     1      -4.573  -0.169  -0.847  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.971  -0.667  -0.586  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.723  -0.115   0.434  1.00  0.00           C  
HETATM   31  C   UNL     1      -8.005  -0.572   0.673  1.00  0.00           C  
HETATM   32  C   UNL     1      -8.536  -1.582  -0.107  1.00  0.00           C  
HETATM   33  C   UNL     1      -7.785  -2.134  -1.128  1.00  0.00           C  
HETATM   34  C   UNL     1      -6.504  -1.673  -1.371  1.00  0.00           C  
HETATM   35  H   UNL     1       0.093   6.141   0.879  1.00  0.00           H  
HETATM   36  H   UNL     1       1.046   6.187  -0.624  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.705   6.508  -0.669  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.256   4.278  -1.377  1.00  0.00           H  
HETATM   39  H   UNL     1       1.826   4.186   0.166  1.00  0.00           H  
HETATM   40  H   UNL     1       0.455   4.422   2.218  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.443   2.947   1.789  1.00  0.00           H  
HETATM   42  H   UNL     1       1.290   2.851   2.185  1.00  0.00           H  
HETATM   43  H   UNL     1       2.432   1.616   0.704  1.00  0.00           H  
HETATM   44  H   UNL     1       2.222   0.278  -1.758  1.00  0.00           H  
HETATM   45  H   UNL     1       2.697  -1.796  -0.121  1.00  0.00           H  
HETATM   46  H   UNL     1       4.269  -0.701  -1.742  1.00  0.00           H  
HETATM   47  H   UNL     1       4.658   0.509  -0.496  1.00  0.00           H  
HETATM   48  H   UNL     1       5.045  -2.061   0.609  1.00  0.00           H  
HETATM   49  H   UNL     1       7.677  -2.180   1.175  1.00  0.00           H  
HETATM   50  H   UNL     1       7.288  -3.391  -0.071  1.00  0.00           H  
HETATM   51  H   UNL     1       8.901  -2.317  -1.618  1.00  0.00           H  
HETATM   52  H   UNL     1       9.290  -1.107  -0.373  1.00  0.00           H  
HETATM   53  H   UNL     1       9.700  -2.819  -0.109  1.00  0.00           H  
HETATM   54  H   UNL     1       3.390  -1.239   2.037  1.00  0.00           H  
HETATM   55  H   UNL     1       3.745   0.449   1.600  1.00  0.00           H  
HETATM   56  H   UNL     1       1.716   0.297   3.019  1.00  0.00           H  
HETATM   57  H   UNL     1       1.318   0.907   1.393  1.00  0.00           H  
HETATM   58  H   UNL     1       1.227  -2.070   1.836  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.294  -0.924   3.836  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.534  -1.259   2.646  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.406  -2.542   0.447  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.939  -1.661   0.524  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.503   0.882  -0.567  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.340  -0.279  -1.906  1.00  0.00           H  
HETATM   65  H   UNL     1      -6.308   0.674   1.044  1.00  0.00           H  
HETATM   66  H   UNL     1      -8.592  -0.140   1.471  1.00  0.00           H  
HETATM   67  H   UNL     1      -9.538  -1.939   0.080  1.00  0.00           H  
HETATM   68  H   UNL     1      -8.199  -2.923  -1.737  1.00  0.00           H  
HETATM   69  H   UNL     1      -5.917  -2.104  -2.168  1.00  0.00           H  
CONECT    1    2   35   36   37                                       
CONECT    2    3    1   38                                            
CONECT    3    4    2    5   39                                       
CONECT    4    3   40   41   42                                       
CONECT    5    3    7    6    6                                       
CONECT    6    5    5                                                 
CONECT    7    5    8   43                                            
CONECT    8    9    7   12   44                                       
CONECT    9   10   10   11    8                                       
CONECT   10    9    9                                                 
CONECT   11   24    9   21                                            
CONECT   12    8   19   13   45                                       
CONECT   13   12   14   46   47                                       
CONECT   14   13   15   48                                            
CONECT   15   16   16   14   17                                       
CONECT   16   15   15                                                 
CONECT   17   15   18   49   50                                       
CONECT   18   17   51   52   53                                       
CONECT   19   12   20   54   55                                       
CONECT   20   21   19   56   57                                       
CONECT   21   11   22   20   58                                       
CONECT   22   23   23   21   59                                       
CONECT   23   24   22   22   60                                       
CONECT   24   25   11   23   61                                       
CONECT   25   27   26   26   24                                       
CONECT   26   25   25                                                 
CONECT   27   28   25   62                                            
CONECT   28   29   27   63   64                                       
CONECT   29   30   30   34   28                                       
CONECT   30   31   29   29   65                                       
CONECT   31   32   32   30   66                                       
CONECT   32   31   31   33   67                                       
CONECT   33   32   34   34   68                                       
CONECT   34   33   33   29   69                                       
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42    4                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   13                                                      
CONECT   48   14                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   23                                                      
CONECT   61   24                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   28                                                      
CONECT   65   30                                                      
CONECT   66   31                                                      
CONECT   67   32                                                      
CONECT   68   33                                                      
CONECT   69   34                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
