COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 OS   UNL     1      -0.001   0.001  -0.172  1.00  0.00          Os2+
HETATM    2  N   UNL     1       1.893  -0.867  -0.034  1.00  0.00           N  
HETATM    3  C   UNL     1       2.296  -2.056  -0.479  1.00  0.00           C  
HETATM    4  C   UNL     1       3.594  -2.489  -0.314  1.00  0.00           C  
HETATM    5  C   UNL     1       4.492  -1.657   0.333  1.00  0.00           C  
HETATM    6  C   UNL     1       4.049  -0.435   0.782  1.00  0.00           C  
HETATM    7  C   UNL     1       2.700  -0.040   0.588  1.00  0.00           C  
HETATM    8  C   UNL     1       2.172   1.262   1.080  1.00  0.00           C  
HETATM    9  C   UNL     1       2.986   2.206   1.758  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.545  -0.933  -3.076  1.00  0.00           C  
HETATM   11  C   UNL     1       2.453   3.389   2.213  1.00  0.00           C  
HETATM   12  C   UNL     1       1.107   3.634   2.001  1.00  0.00           C  
HETATM   13  C   UNL     1       0.364   2.688   1.330  1.00  0.00           C  
HETATM   14  N   UNL     1       0.907   1.556   0.890  1.00  0.00           N  
HETATM   15  N   UNL     1      -0.913  -1.568   0.864  1.00  0.00           N  
HETATM   16  C   UNL     1      -0.372  -2.711   1.281  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.117  -3.665   1.941  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.457  -3.411   2.176  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.987  -2.218   1.743  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.175  -1.273   1.064  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.702   0.036   0.589  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.048   0.434   0.796  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.495   1.652   0.341  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.604   2.478  -0.322  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.307   2.045  -0.492  1.00  0.00           C  
HETATM   26  N   UNL     1      -1.898   0.862  -0.040  1.00  0.00           N  
HETATM   27  N   UNL     1       0.008   0.013  -2.257  1.00  0.00           N  
HETATM   28  C   UNL     1      -0.313  -0.536  -4.342  1.00  0.00           C  
HETATM   29  C   UNL     1       0.559   0.956  -3.050  1.00  0.00           C  
HETATM   30  N   UNL     1       0.359   0.624  -4.296  1.00  0.00           N  
HETATM   31  H   UNL     1       1.584  -2.698  -0.985  1.00  0.00           H  
HETATM   32  H   UNL     1       3.901  -3.454  -0.682  1.00  0.00           H  
HETATM   33  H   UNL     1       5.515  -1.959   0.485  1.00  0.00           H  
HETATM   34  H   UNL     1       4.734   0.230   1.290  1.00  0.00           H  
HETATM   35  H   UNL     1       4.034   1.992   1.918  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.064  -1.829  -2.768  1.00  0.00           H  
HETATM   37  H   UNL     1       3.072   4.108   2.723  1.00  0.00           H  
HETATM   38  H   UNL     1       0.650   4.546   2.348  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.690   2.870   1.154  1.00  0.00           H  
HETATM   40  H   UNL     1       0.678  -2.898   1.089  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.663  -4.587   2.264  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.075  -4.133   2.683  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.030  -1.998   1.922  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.726  -0.226   1.320  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.517   1.954   0.502  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.917   3.438  -0.697  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.600   2.685  -1.008  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.613  -1.061  -5.237  1.00  0.00           H  
HETATM   49  H   UNL     1       1.076   1.842  -2.710  1.00  0.00           H  
CONECT    1   14   26   27    2                                       
CONECT    1   15                                                      
CONECT    2    1    7    3    3                                       
CONECT    3    2    2    4   31                                       
CONECT    4    3    5    5   32                                       
CONECT    5    4    4    6   33                                       
CONECT    6    5    7    7   34                                       
CONECT    7    2    6    6    8                                       
CONECT    8    7    9    9   14                                       
CONECT    9    8    8   11   35                                       
CONECT   10   28   28   27   36                                       
CONECT   11    9   12   12   37                                       
CONECT   12   11   11   13   38                                       
CONECT   13   12   14   14   39                                       
CONECT   14    1    8   13   13                                       
CONECT   15    1   20   16   16                                       
CONECT   16   15   15   17   40                                       
CONECT   17   16   18   18   41                                       
CONECT   18   17   17   19   42                                       
CONECT   19   18   20   20   43                                       
CONECT   20   15   19   19   21                                       
CONECT   21   20   26   26   22                                       
CONECT   22   21   23   23   44                                       
CONECT   23   22   22   24   45                                       
CONECT   24   23   25   25   46                                       
CONECT   25   24   24   26   47                                       
CONECT   26    1   21   21   25                                       
CONECT   27    1   10   29                                            
CONECT   28   10   10   30   48                                       
CONECT   29   27   30   30   49                                       
CONECT   30   29   29   28                                            
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   18                                                      
CONECT   43   19                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   28                                                      
CONECT   49   29                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
