COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.650   1.648  -2.549  1.00  0.00           C  
HETATM    2  N   UNL     1      -1.199  -1.509  -1.041  1.00  0.00           N  
HETATM    3  O   UNL     1      -3.527   0.196  -0.828  1.00  0.00           O  
HETATM    4  C   UNL     1      -2.320   0.623  -1.462  1.00  0.00           C  
HETATM    5  N   UNL     1      -1.250  -3.161   0.385  1.00  0.00           N  
HETATM    6  C   UNL     1      -1.622  -0.583  -2.094  1.00  0.00           C  
HETATM    7  N   UNL     1       1.092  -0.741  -0.466  1.00  0.00           N  
HETATM    8  C   UNL     1      -1.930  -2.539  -0.533  1.00  0.00           C  
HETATM    9  N   UNL     1       6.688   0.364   1.612  1.00  0.00           N  
HETATM   10  C   UNL     1      -3.325  -2.906  -0.972  1.00  0.00           C  
HETATM   11  N   UNL     1       5.537   1.547  -0.057  1.00  0.00           N  
HETATM   12  C   UNL     1      -0.037  -2.572   0.528  1.00  0.00           C  
HETATM   13  N   UNL     1       4.512   2.823  -1.739  1.00  0.00           N  
HETATM   14  C   UNL     1       1.069  -2.819   1.350  1.00  0.00           C  
HETATM   15  C   UNL     1       2.163  -2.004   1.231  1.00  0.00           C  
HETATM   16  C   UNL     1       2.149  -0.960   0.303  1.00  0.00           C  
HETATM   17  C   UNL     1       0.014  -1.502  -0.385  1.00  0.00           C  
HETATM   18  C   UNL     1       3.337  -0.081   0.177  1.00  0.00           C  
HETATM   19  C   UNL     1       4.466  -0.285   0.973  1.00  0.00           C  
HETATM   20  C   UNL     1       5.558   0.559   0.825  1.00  0.00           C  
HETATM   21  C   UNL     1       4.484   1.773  -0.829  1.00  0.00           C  
HETATM   22  C   UNL     1       3.353   0.972  -0.740  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.999   0.970   0.185  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.103   0.558   0.917  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.580   1.346   1.947  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.959   2.544   2.247  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.859   2.957   1.518  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.374   2.170   0.492  1.00  0.00           C  
HETATM   29  H   UNL     1      -3.308   1.194  -3.290  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.147   2.507  -2.099  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.729   1.974  -3.033  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.662   1.078  -0.722  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.748  -0.245  -2.653  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.311  -1.090  -2.769  1.00  0.00           H  
HETATM   35  H   UNL     1       6.709  -0.358   2.259  1.00  0.00           H  
HETATM   36  H   UNL     1       7.454   0.951   1.513  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.271  -3.623  -1.791  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.863  -3.351  -0.135  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.848  -2.011  -1.306  1.00  0.00           H  
HETATM   40  H   UNL     1       5.299   3.385  -1.807  1.00  0.00           H  
HETATM   41  H   UNL     1       3.744   2.993  -2.307  1.00  0.00           H  
HETATM   42  H   UNL     1       1.059  -3.632   2.060  1.00  0.00           H  
HETATM   43  H   UNL     1       3.033  -2.168   1.850  1.00  0.00           H  
HETATM   44  H   UNL     1       4.490  -1.089   1.694  1.00  0.00           H  
HETATM   45  H   UNL     1       2.499   1.161  -1.373  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.588  -0.378   0.683  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.440   1.026   2.517  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.334   3.159   3.052  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.373   3.891   1.757  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.515   2.493  -0.077  1.00  0.00           H  
CONECT    1    4   29   30   31                                       
CONECT    2    6    8   17                                            
CONECT    3    4   23                                                 
CONECT    4    6    1    3   32                                       
CONECT    5    8    8   12                                            
CONECT    6    4    2   33   34                                       
CONECT    7   17   17   16                                            
CONECT    8   10    2    5    5                                       
CONECT    9   20   35   36                                            
CONECT   10    8   37   38   39                                       
CONECT   11   20   21   21                                            
CONECT   12   17    5   14   14                                       
CONECT   13   21   40   41                                            
CONECT   14   12   12   15   42                                       
CONECT   15   16   16   14   43                                       
CONECT   16    7   18   15   15                                       
CONECT   17    2    7    7   12                                       
CONECT   18   19   16   22   22                                       
CONECT   19   20   20   18   44                                       
CONECT   20    9   19   19   11                                       
CONECT   21   11   11   22   13                                       
CONECT   22   18   18   21   45                                       
CONECT   23   28    3   24   24                                       
CONECT   24   23   23   25   46                                       
CONECT   25   26   26   24   47                                       
CONECT   26   27   25   25   48                                       
CONECT   27   28   28   26   49                                       
CONECT   28   27   27   23   50                                       
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    4                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   19                                                      
CONECT   45   22                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
