COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -2.581   1.544   0.462  1.00  0.00           N  
HETATM    2  C   UNL     1      -1.847   3.796   0.737  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.860   4.721   0.591  1.00  0.00           C  
HETATM    4  C   UNL     1       0.373   4.376   0.041  1.00  0.00           C  
HETATM    5  C   UNL     1       0.624   3.101  -0.366  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.145   0.789  -0.645  1.00  0.00           C  
HETATM    7  N   UNL     1       1.071   0.409  -1.198  1.00  0.00           N  
HETATM    8  N   UNL     1      -1.270  -1.485  -0.776  1.00  0.00           N  
HETATM    9  C   UNL     1      -3.096  -3.226  -0.512  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.387  -3.427  -0.073  1.00  0.00           C  
HETATM   11  C   UNL     1       1.948  -0.189  -0.182  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.122  -2.379   0.461  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.567  -1.122   0.560  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.394   0.289   0.084  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.263  -0.904   0.120  1.00  0.00           C  
HETATM   16  C   UNL     1       3.322  -0.468  -0.795  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.626   2.467   0.328  1.00  0.00           C  
HETATM   18  N   UNL     1       4.199  -1.066   0.221  1.00  0.00           N  
HETATM   19  C   UNL     1       3.716  -2.396   0.617  1.00  0.00           C  
HETATM   20  C   UNL     1       5.587  -1.130  -0.254  1.00  0.00           C  
HETATM   21  C   UNL     1       4.396  -2.818   1.921  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.371   2.120  -0.232  1.00  0.00           C  
HETATM   23  C   UNL     1       6.205   0.269  -0.214  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.175  -0.132  -0.480  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.519  -1.962  -0.421  1.00  0.00           C  
HETATM   26  H   UNL     1      -2.796   4.080   1.166  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.034   5.739   0.908  1.00  0.00           H  
HETATM   28  H   UNL     1       1.140   5.129  -0.064  1.00  0.00           H  
HETATM   29  H   UNL     1       1.583   2.846  -0.793  1.00  0.00           H  
HETATM   30  H   UNL     1       0.934  -0.222  -1.974  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.564  -2.017  -1.174  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.533  -4.049  -0.926  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.830  -4.409  -0.145  1.00  0.00           H  
HETATM   34  H   UNL     1       2.057   0.500   0.655  1.00  0.00           H  
HETATM   35  H   UNL     1       3.213  -1.158  -1.632  1.00  0.00           H  
HETATM   36  H   UNL     1       2.636  -2.361   0.765  1.00  0.00           H  
HETATM   37  H   UNL     1       3.963  -3.756   2.270  1.00  0.00           H  
HETATM   38  H   UNL     1       1.511  -1.123   0.171  1.00  0.00           H  
HETATM   39  H   UNL     1       3.759   0.466  -1.148  1.00  0.00           H  
HETATM   40  H   UNL     1       3.952  -3.116  -0.166  1.00  0.00           H  
HETATM   41  H   UNL     1       5.463  -2.954   1.746  1.00  0.00           H  
HETATM   42  H   UNL     1       4.247  -2.046   2.675  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.133  -2.550   0.802  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.142  -0.307   0.976  1.00  0.00           H  
HETATM   45  H   UNL     1       6.161  -1.799   0.388  1.00  0.00           H  
HETATM   46  H   UNL     1       7.249   0.214  -0.522  1.00  0.00           H  
HETATM   47  H   UNL     1       5.604  -1.506  -1.277  1.00  0.00           H  
HETATM   48  H   UNL     1       5.661   0.926  -0.893  1.00  0.00           H  
HETATM   49  H   UNL     1       6.146   0.664   0.800  1.00  0.00           H  
CONECT    1   14   14   17                                            
CONECT    2    3    3   17   26                                       
CONECT    3    2    2    4   27                                       
CONECT    4    3    5    5   28                                       
CONECT    5    4    4   22   29                                       
CONECT    6    7   22   24   24                                       
CONECT    7    6   11   30                                            
CONECT    8   24   25   31                                            
CONECT    9   10   10   25   32                                       
CONECT   10    9    9   12   33                                       
CONECT   11    7   16   34   38                                       
CONECT   12   10   13   13   43                                       
CONECT   13   12   12   15   44                                       
CONECT   14    1    1   15   24                                       
CONECT   15   13   14   25   25                                       
CONECT   16   11   18   35   39                                       
CONECT   17    1    2   22   22                                       
CONECT   18   16   19   20                                            
CONECT   19   18   21   36   40                                       
CONECT   20   18   23   45   47                                       
CONECT   21   19   37   41   42                                       
CONECT   22    5    6   17   17                                       
CONECT   23   20   46   48   49                                       
CONECT   24    6    6    8   14                                       
CONECT   25    8    9   15   15                                       
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   16                                                      
CONECT   36   19                                                      
CONECT   37   21                                                      
CONECT   38   11                                                      
CONECT   39   16                                                      
CONECT   40   19                                                      
CONECT   41   21                                                      
CONECT   42   21                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   20                                                      
CONECT   46   23                                                      
CONECT   47   20                                                      
CONECT   48   23                                                      
CONECT   49   23                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
