COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK     1       4.200  -0.495   0.037  1.00  0.00           C  
HETATM    2  C   UNK     1       6.601  -0.969   0.093  1.00  0.00           C  
HETATM    3  C   UNK     1       6.319  -2.298   0.210  1.00  0.00           C  
HETATM    4  C   UNK     1       5.001  -2.735   0.247  1.00  0.00           C  
HETATM    5  C   UNK     1      -7.946  -0.412  -0.163  1.00  0.00           C  
HETATM    6  C   UNK     1      -6.751   0.506  -0.114  1.00  0.00           C  
HETATM    7  C   UNK     1      -5.471  -0.328  -0.033  1.00  0.00           C  
HETATM    8  C   UNK     1      -4.255   0.597  -0.108  1.00  0.00           C  
HETATM    9  C   UNK     1      -2.974  -0.236  -0.027  1.00  0.00           C  
HETATM   10  C   UNK     1      -1.758   0.689  -0.102  1.00  0.00           C  
HETATM   11  C   UNK     1       0.671   0.497  -0.072  1.00  0.00           C  
HETATM   12  C   UNK     1       3.058   0.483  -0.057  1.00  0.00           C  
HETATM   13  C   UNK     1       5.540  -0.032   0.003  1.00  0.00           C  
HETATM   14  C   UNK     1       3.951  -1.830   0.160  1.00  0.00           C  
HETATM   15  N   UNK     1      -6.848   1.372   1.069  1.00  0.00           N  
HETATM   16  N   UNK     1      -0.532  -0.109  -0.024  1.00  0.00           N  
HETATM   17  N   UNK     1       5.798   1.262  -0.112  1.00  0.00           N  
HETATM   18  N   UNK     1       6.863   1.623  -0.138  1.00  0.00           N1+
HETATM   19  N   UNK     1       7.927   1.984  -0.165  1.00  0.00           N1-
HETATM   20  O   UNK     1      -8.294  -0.999  -1.319  1.00  0.00           O  
HETATM   21  O   UNK     1      -8.590  -0.620   0.837  1.00  0.00           O  
HETATM   22  O   UNK     1       0.739   1.705  -0.179  1.00  0.00           O  
HETATM   23  O   UNK     1       1.798  -0.236   0.000  1.00  0.00           O  
HETATM   24  H   UNK     1       7.627  -0.632   0.069  1.00  0.00           H  
HETATM   25  H   UNK     1       7.125  -3.014   0.279  1.00  0.00           H  
HETATM   26  H   UNK     1       4.791  -3.791   0.340  1.00  0.00           H  
HETATM   27  H   UNK     1      -6.728   1.120  -1.014  1.00  0.00           H  
HETATM   28  H   UNK     1      -5.453  -0.876   0.910  1.00  0.00           H  
HETATM   29  H   UNK     1      -5.443  -1.033  -0.863  1.00  0.00           H  
HETATM   30  H   UNK     1      -4.272   1.145  -1.051  1.00  0.00           H  
HETATM   31  H   UNK     1      -4.282   1.302   0.722  1.00  0.00           H  
HETATM   32  H   UNK     1      -2.956  -0.784   0.915  1.00  0.00           H  
HETATM   33  H   UNK     1      -2.946  -0.942  -0.857  1.00  0.00           H  
HETATM   34  H   UNK     1      -1.776   1.236  -1.045  1.00  0.00           H  
HETATM   35  H   UNK     1      -1.786   1.394   0.728  1.00  0.00           H  
HETATM   36  H   UNK     1       3.112   1.186   0.774  1.00  0.00           H  
HETATM   37  H   UNK     1       3.122   1.028  -0.998  1.00  0.00           H  
HETATM   38  H   UNK     1       2.931  -2.186   0.190  1.00  0.00           H  
HETATM   39  H   UNK     1      -6.871   0.825   1.916  1.00  0.00           H  
HETATM   40  H   UNK     1      -6.092   2.040   1.090  1.00  0.00           H  
HETATM   41  H   UNK     1      -0.586  -1.074   0.061  1.00  0.00           H  
HETATM   42  H   UNK     1      -9.067  -1.579  -1.302  1.00  0.00           H  
CONECT    1   14   14   13   12                                       
CONECT    2    3   13   13   24                                       
CONECT    3    4    4    2   25                                       
CONECT    4    3    3   14   26                                       
CONECT    5   21   21    6   20                                       
CONECT    6    7    5   15   27                                       
CONECT    7    8    6   28   29                                       
CONECT    8    9    7   30   31                                       
CONECT    9   10    8   32   33                                       
CONECT   10   16    9   34   35                                       
CONECT   11   22   22   16   23                                       
CONECT   12    1   23   36   37                                       
CONECT   13    2    2    1   17                                       
CONECT   14    4    1    1   38                                       
CONECT   15    6   39   40                                            
CONECT   16   11   10   41                                            
CONECT   17   13   18   18                                            
CONECT   18   19   19   17   17                                       
CONECT   19   18   18                                                 
CONECT   20    5   42                                                 
CONECT   21    5    5                                                 
CONECT   22   11   11                                                 
CONECT   23   12   11                                                 
CONECT   24    2                                                      
CONECT   25    3                                                      
CONECT   26    4                                                      
CONECT   27    6                                                      
CONECT   28    7                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   10                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   20                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
