COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.009  -4.081  -0.844  1.00  0.00           C  
HETATM    2  N   UNL     1       3.090  -4.068  -0.023  1.00  0.00           N  
HETATM    3  C   UNL     1       3.596  -2.895   0.423  1.00  0.00           C  
HETATM    4  C   UNL     1       2.933  -1.711   0.094  1.00  0.00           C  
HETATM    5  C   UNL     1       1.807  -1.788  -0.721  1.00  0.00           C  
HETATM    6  N   UNL     1       1.378  -2.974  -1.161  1.00  0.00           N  
HETATM    7  N   UNL     1       3.349  -0.447   0.545  1.00  0.00           N  
HETATM    8  C   UNL     1       2.941   0.713  -0.138  1.00  0.00           C  
HETATM    9  C   UNL     1       1.819   0.612  -0.965  1.00  0.00           C  
HETATM   10  N   UNL     1       1.153  -0.618  -1.080  1.00  0.00           N  
HETATM   11  C   UNL     1       3.631   1.913   0.011  1.00  0.00           C  
HETATM   12  C   UNL     1       3.129   3.030  -0.637  1.00  0.00           C  
HETATM   13  C   UNL     1       2.022   2.929  -1.469  1.00  0.00           C  
HETATM   14  C   UNL     1       1.370   1.725  -1.648  1.00  0.00           C  
HETATM   15  C   UNL     1       4.178  -0.276   1.741  1.00  0.00           C  
HETATM   16  C   UNL     1       5.362   0.582   1.301  1.00  0.00           C  
HETATM   17  C   UNL     1       4.888   1.964   0.837  1.00  0.00           C  
HETATM   18  O   UNL     1       1.565  -5.258  -1.334  1.00  0.00           O  
HETATM   19  C   UNL     1       1.528   4.163  -2.184  1.00  0.00           C  
HETATM   20  C   UNL     1       3.686   4.425  -0.480  1.00  0.00           C  
HETATM   21  O   UNL     1       3.425   0.358   2.774  1.00  0.00           O  
HETATM   22  C   UNL     1       4.705   2.854   2.067  1.00  0.00           C  
HETATM   23  C   UNL     1       6.044   2.526  -0.013  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.229  -0.687  -1.561  1.00  0.00           C  
HETATM   25  O   UNL     1       4.626  -2.900   1.079  1.00  0.00           O  
HETATM   26  C   UNL     1      -1.188  -0.435  -0.396  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.618  -0.324  -0.929  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.578  -0.072   0.236  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.008   0.040  -0.296  1.00  0.00           C  
HETATM   30  O   UNL     1      -1.108  -1.521   0.530  1.00  0.00           O  
HETATM   31  O   UNL     1      -2.698   0.762  -1.855  1.00  0.00           O  
HETATM   32  O   UNL     1      -3.498  -1.157   1.162  1.00  0.00           O  
HETATM   33  O   UNL     1      -5.888   0.391   0.773  1.00  0.00           O  
HETATM   34  P   UNL     1      -7.473   0.593   0.574  1.00  0.00           P  
HETATM   35  O   UNL     1      -7.712   1.595  -0.489  1.00  0.00           O  
HETATM   36  O   UNL     1      -8.144  -0.808   0.152  1.00  0.00           O  
HETATM   37  O   UNL     1      -8.126   1.107   1.953  1.00  0.00           O  
HETATM   38  H   UNL     1       3.504  -4.903   0.248  1.00  0.00           H  
HETATM   39  H   UNL     1       0.531   1.674  -2.325  1.00  0.00           H  
HETATM   40  H   UNL     1       4.534  -1.239   2.104  1.00  0.00           H  
HETATM   41  H   UNL     1       6.057   0.705   2.136  1.00  0.00           H  
HETATM   42  H   UNL     1       5.886   0.089   0.477  1.00  0.00           H  
HETATM   43  H   UNL     1       2.026   4.246  -3.150  1.00  0.00           H  
HETATM   44  H   UNL     1       0.451   4.088  -2.335  1.00  0.00           H  
HETATM   45  H   UNL     1       1.751   5.044  -1.583  1.00  0.00           H  
HETATM   46  H   UNL     1       3.220   4.908   0.379  1.00  0.00           H  
HETATM   47  H   UNL     1       4.764   4.370  -0.325  1.00  0.00           H  
HETATM   48  H   UNL     1       3.478   5.003  -1.380  1.00  0.00           H  
HETATM   49  H   UNL     1       2.639  -0.136   3.047  1.00  0.00           H  
HETATM   50  H   UNL     1       4.589   3.891   1.751  1.00  0.00           H  
HETATM   51  H   UNL     1       3.816   2.539   2.614  1.00  0.00           H  
HETATM   52  H   UNL     1       5.579   2.766   2.712  1.00  0.00           H  
HETATM   53  H   UNL     1       5.999   3.615  -0.013  1.00  0.00           H  
HETATM   54  H   UNL     1       6.996   2.202   0.408  1.00  0.00           H  
HETATM   55  H   UNL     1       5.955   2.159  -1.035  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.384   0.070  -2.330  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.418  -1.675  -1.981  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.914   0.492   0.106  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.892  -1.251  -1.431  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.303   0.856   0.739  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.049   0.809  -1.068  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.314  -0.916  -0.720  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.278  -2.387   0.136  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.467   1.621  -1.475  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.729  -2.016   0.783  1.00  0.00           H  
HETATM   66  H   UNL     1      -8.026  -1.513   0.804  1.00  0.00           H  
HETATM   67  H   UNL     1      -9.081   1.251   1.907  1.00  0.00           H  
HETATM   68  H   UNL     1       0.792  -5.177  -1.910  1.00  0.00           H  
CONECT    1    6    6    2   18                                       
CONECT    2    3    1   38                                            
CONECT    3    4   25   25    2                                       
CONECT    4    7    5    5    3                                       
CONECT    5   10    4    4    6                                       
CONECT    6    5    1    1                                            
CONECT    7    8   15    4                                            
CONECT    8   11   11    9    7                                       
CONECT    9   14   14    8   10                                       
CONECT   10    9   24    5                                            
CONECT   11   12   17    8    8                                       
CONECT   12   20   13   13   11                                       
CONECT   13   19   12   12   14                                       
CONECT   14   13    9    9   39                                       
CONECT   15   16    7   21   40                                       
CONECT   16   17   15   41   42                                       
CONECT   17   22   23   11   16                                       
CONECT   18    1   68                                                 
CONECT   19   13   43   44   45                                       
CONECT   20   12   46   47   48                                       
CONECT   21   15   49                                                 
CONECT   22   17   50   51   52                                       
CONECT   23   17   53   54   55                                       
CONECT   24   10   26   56   57                                       
CONECT   25    3    3                                                 
CONECT   26   30   24   27   58                                       
CONECT   27   26   28   31   59                                       
CONECT   28   27   32   29   60                                       
CONECT   29   28   33   61   62                                       
CONECT   30   26   63                                                 
CONECT   31   27   64                                                 
CONECT   32   28   65                                                 
CONECT   33   29   34                                                 
CONECT   34   33   35   35   36                                       
CONECT   34   37                                                      
CONECT   35   34   34                                                 
CONECT   36   34   66                                                 
CONECT   37   34   67                                                 
CONECT   38    2                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   19                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
CONECT   52   22                                                      
CONECT   53   23                                                      
CONECT   54   23                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   24                                                      
CONECT   58   26                                                      
CONECT   59   27                                                      
CONECT   60   28                                                      
CONECT   61   29                                                      
CONECT   62   29                                                      
CONECT   63   30                                                      
CONECT   64   31                                                      
CONECT   65   32                                                      
CONECT   66   36                                                      
CONECT   67   37                                                      
CONECT   68   18                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
