COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.597   2.774  -1.397  1.00  0.00           C  
HETATM    2  N   UNL     1      -2.285   1.477  -1.342  1.00  0.00           N  
HETATM    3  C   UNL     1      -1.519   0.444  -2.052  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.546   1.078   0.047  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.820   0.275   0.107  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.558   0.236   1.276  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.726  -0.501   1.332  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.157  -1.198   0.219  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.420  -1.159  -0.950  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.254  -0.418  -1.007  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.383   0.228   0.560  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.661  -0.199   2.003  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.146   1.012   0.512  1.00  0.00           N  
HETATM   14  C   UNL     1       1.072   0.375   0.326  1.00  0.00           C  
HETATM   15  C   UNL     1       2.310   1.164   0.284  1.00  0.00           C  
HETATM   16  C   UNL     1       2.300   2.551   0.427  1.00  0.00           C  
HETATM   17  C   UNL     1       3.487   3.249   0.381  1.00  0.00           C  
HETATM   18  C   UNL     1       4.693   2.586   0.192  1.00  0.00           C  
HETATM   19  C   UNL     1       4.726   1.217   0.048  1.00  0.00           C  
HETATM   20  C   UNL     1       3.537   0.491   0.093  1.00  0.00           C  
HETATM   21  C   UNL     1       3.510  -0.968  -0.055  1.00  0.00           C  
HETATM   22  N   UNL     1       2.306  -1.619  -0.002  1.00  0.00           N  
HETATM   23  N   UNL     1       1.114  -0.923   0.193  1.00  0.00           N  
HETATM   24  N   UNL     1       4.440  -1.883  -0.242  1.00  0.00           N  
HETATM   25  N   UNL     1       3.887  -3.043  -0.306  1.00  0.00           N  
HETATM   26  C   UNL     1       2.591  -2.933  -0.166  1.00  0.00           C  
HETATM   27  C   UNL     1       1.595  -4.063  -0.183  1.00  0.00           C  
HETATM   28  H   UNL     1      -1.464   3.071  -2.437  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.194   3.524  -0.878  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.623   2.689  -0.915  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.491   0.441  -1.689  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.971  -0.531  -1.873  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.526   0.657  -3.121  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.648   1.968   0.668  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.221   0.780   2.146  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.302  -0.532   2.245  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.070  -1.774   0.262  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.757  -1.704  -1.819  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.681  -0.384  -1.922  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.276  -0.658  -0.066  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.831  -0.804   2.369  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.768   0.687   2.630  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.580  -0.782   2.039  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.180   1.977   0.611  1.00  0.00           H  
HETATM   45  H   UNL     1       1.368   3.076   0.573  1.00  0.00           H  
HETATM   46  H   UNL     1       3.480   4.323   0.492  1.00  0.00           H  
HETATM   47  H   UNL     1       5.613   3.150   0.158  1.00  0.00           H  
HETATM   48  H   UNL     1       5.668   0.708  -0.098  1.00  0.00           H  
HETATM   49  H   UNL     1       1.253  -4.231  -1.204  1.00  0.00           H  
HETATM   50  H   UNL     1       2.067  -4.970   0.196  1.00  0.00           H  
HETATM   51  H   UNL     1       0.743  -3.807   0.448  1.00  0.00           H  
CONECT    1    2   28   29   30                                       
CONECT    2    4    1    3                                            
CONECT    3    2   31   32   33                                       
CONECT    4   11    2    5   34                                       
CONECT    5    4   10   10    6                                       
CONECT    6    5    7    7   35                                       
CONECT    7    6    6    8   36                                       
CONECT    8    9    9    7   37                                       
CONECT    9   10    8    8   38                                       
CONECT   10    5    5    9   39                                       
CONECT   11   13   12    4   40                                       
CONECT   12   11   41   42   43                                       
CONECT   13   14   11   44                                            
CONECT   14   15   13   23   23                                       
CONECT   15   16   16   20   14                                       
CONECT   16   17   15   15   45                                       
CONECT   17   18   18   16   46                                       
CONECT   18   17   17   19   47                                       
CONECT   19   18   20   20   48                                       
CONECT   20   19   19   15   21                                       
CONECT   21   20   24   24   22                                       
CONECT   22   21   23   26                                            
CONECT   23   14   14   22                                            
CONECT   24   21   21   25                                            
CONECT   25   24   26   26                                            
CONECT   26   22   25   25   27                                       
CONECT   27   26   49   50   51                                       
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49   27                                                      
CONECT   50   27                                                      
CONECT   51   27                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
