COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.363   1.659   0.034  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.036   2.271  -0.224  1.00  0.00           C  
HETATM    3  C   UNL     1       3.023   1.145  -0.482  1.00  0.00           C  
HETATM    4  C   UNL     1       5.155   0.158   1.290  1.00  0.00           C  
HETATM    5  C   UNL     1       6.371  -0.558  -0.676  1.00  0.00           C  
HETATM    6  C   UNL     1       0.608   3.773  -0.356  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.684   3.615   0.006  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.106   0.842   1.184  1.00  0.00           C  
HETATM    9  O   UNL     1      -6.062  -0.036   0.757  1.00  0.00           O  
HETATM   10  C   UNL     1      -4.845   0.521   0.519  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.782  -0.279   0.111  1.00  0.00           C  
HETATM   12  O   UNL     1      -3.960  -1.618  -0.049  1.00  0.00           O  
HETATM   13  C   UNL     1      -2.865  -2.358  -0.591  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.367  -3.657  -1.256  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.321  -4.742  -0.947  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.220  -4.065  -0.104  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.927  -2.846   0.541  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.545   0.288  -0.136  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.428   2.454   0.454  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.662   1.885   0.694  1.00  0.00           C  
HETATM   21  N   UNL     1       0.022   1.652  -0.704  1.00  0.00           N  
HETATM   22  N   UNL     1       1.067   2.580  -0.791  1.00  0.00           N  
HETATM   23  C   UNL     1       2.422   2.306  -1.276  1.00  0.00           C  
HETATM   24  O   UNL     1       2.279  -0.047  -0.744  1.00  0.00           O  
HETATM   25  C   UNL     1       4.480   0.939  -0.901  1.00  0.00           C  
HETATM   26  N   UNL     1       5.057  -0.176  -0.139  1.00  0.00           N  
HETATM   27  C   UNL     1       5.703  -1.049   2.055  1.00  0.00           C  
HETATM   28  O   UNL     1       6.966  -1.426   1.500  1.00  0.00           O  
HETATM   29  C   UNL     1       6.908  -1.759   0.110  1.00  0.00           C  
HETATM   30  H   UNL     1       2.980   1.372   0.584  1.00  0.00           H  
HETATM   31  H   UNL     1       5.826   1.007   1.420  1.00  0.00           H  
HETATM   32  H   UNL     1       4.167   0.414   1.673  1.00  0.00           H  
HETATM   33  H   UNL     1       6.270  -0.826  -1.728  1.00  0.00           H  
HETATM   34  H   UNL     1       7.062   0.280  -0.577  1.00  0.00           H  
HETATM   35  H   UNL     1       1.175   4.690  -0.301  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.332   4.383   0.402  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.021   0.271   1.338  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.816   1.323   2.119  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.276   1.602   0.422  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.313  -1.751  -1.309  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.334  -3.940  -0.840  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.452  -3.516  -2.334  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.782  -5.551  -0.379  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.898  -5.129  -1.873  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.855  -4.747   0.665  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.401  -3.735  -0.742  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.203  -2.075   0.806  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.505  -3.151   1.413  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.721  -0.330  -0.462  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.287   3.516   0.591  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.489   2.503   1.011  1.00  0.00           H  
HETATM   52  H   UNL     1       3.041   3.194  -1.146  1.00  0.00           H  
HETATM   53  H   UNL     1       2.383   2.041  -2.333  1.00  0.00           H  
HETATM   54  H   UNL     1       2.274  -0.311  -1.674  1.00  0.00           H  
HETATM   55  H   UNL     1       4.522   0.711  -1.966  1.00  0.00           H  
HETATM   56  H   UNL     1       5.047   1.848  -0.701  1.00  0.00           H  
HETATM   57  H   UNL     1       5.831  -0.787   3.105  1.00  0.00           H  
HETATM   58  H   UNL     1       5.005  -1.882   1.970  1.00  0.00           H  
HETATM   59  H   UNL     1       6.245  -2.612  -0.031  1.00  0.00           H  
HETATM   60  H   UNL     1       7.907  -2.010  -0.247  1.00  0.00           H  
CONECT    1    2   18   18   19                                       
CONECT    2   21   21    7    1                                       
CONECT    3   24   23   25   30                                       
CONECT    4   26   27   31   32                                       
CONECT    5   26   29   33   34                                       
CONECT    6   22    7    7   35                                       
CONECT    7    6    6    2   36                                       
CONECT    8    9   37   38   39                                       
CONECT    9   10    8                                                 
CONECT   10   11   11    9   20                                       
CONECT   11   12   18   10   10                                       
CONECT   12   13   11                                                 
CONECT   13   17   14   12   40                                       
CONECT   14   15   13   41   42                                       
CONECT   15   16   14   43   44                                       
CONECT   16   15   17   45   46                                       
CONECT   17   16   13   47   48                                       
CONECT   18    1    1   11   49                                       
CONECT   19    1   20   20   50                                       
CONECT   20   19   19   10   51                                       
CONECT   21   22    2    2                                            
CONECT   22   23   21    6                                            
CONECT   23    3   22   52   53                                       
CONECT   24    3   54                                                 
CONECT   25    3   26   55   56                                       
CONECT   26    5   25    4                                            
CONECT   27   28    4   57   58                                       
CONECT   28   29   27                                                 
CONECT   29   28    5   59   60                                       
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38    8                                                      
CONECT   39    8                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   20                                                      
CONECT   52   23                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   25                                                      
CONECT   57   27                                                      
CONECT   58   27                                                      
CONECT   59   29                                                      
CONECT   60   29                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
