COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.652   0.352  -1.298  1.00  0.00           O  
HETATM    2  O   UNL     1       5.325  -3.605   0.257  1.00  0.00           O  
HETATM    3  C   UNL     1      -1.630  -2.087  -2.279  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.360  -1.323  -1.313  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.586  -1.787  -0.831  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.281  -1.048   0.103  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.769   0.152   0.567  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.557   0.622   0.099  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.845  -0.107  -0.841  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.242   1.582  -0.888  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.513   2.698  -1.662  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.100   3.948  -1.242  1.00  0.00           C  
HETATM   13  C   UNL     1       0.585   4.089  -0.048  1.00  0.00           C  
HETATM   14  C   UNL     1       0.859   2.978   0.730  1.00  0.00           C  
HETATM   15  C   UNL     1       3.949  -1.724   0.049  1.00  0.00           C  
HETATM   16  C   UNL     1       3.702  -0.541  -0.627  1.00  0.00           C  
HETATM   17  C   UNL     1       2.621   0.247  -0.285  1.00  0.00           C  
HETATM   18  C   UNL     1       1.774  -0.143   0.742  1.00  0.00           C  
HETATM   19  C   UNL     1       0.447   1.722   0.314  1.00  0.00           C  
HETATM   20  C   UNL     1       3.118  -2.127   1.072  1.00  0.00           C  
HETATM   21  C   UNL     1       2.021  -1.340   1.429  1.00  0.00           C  
HETATM   22  C   UNL     1       1.153  -1.752   2.491  1.00  0.00           C  
HETATM   23  N   UNL     1       5.108  -2.562  -0.332  1.00  0.00           N1+
HETATM   24  O   UNL     1       5.844  -2.208  -1.236  1.00  0.00           O1-
HETATM   25  N   UNL     1       0.465  -2.080   3.334  1.00  0.00           N  
HETATM   26  O   UNL     1       0.711   0.630   1.080  1.00  0.00           O  
HETATM   27 CL   UNL     1       1.102   5.662   0.474  1.00  0.00          Cl  
HETATM   28  N   UNL     1      -5.581  -1.541   0.613  1.00  0.00           N1+
HETATM   29  O   UNL     1      -6.197  -0.891   1.438  1.00  0.00           O  
HETATM   30  O   UNL     1      -6.033  -2.597   0.207  1.00  0.00           O1-
HETATM   31  N   UNL     1      -1.051  -2.694  -3.045  1.00  0.00           N  
HETATM   32  H   UNL     1      -3.989  -2.722  -1.190  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.321   0.724   1.298  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.165   1.559   0.465  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.048   2.591  -2.595  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.312   4.818  -1.847  1.00  0.00           H  
HETATM   37  H   UNL     1       1.393   3.090   1.662  1.00  0.00           H  
HETATM   38  H   UNL     1       4.358  -0.232  -1.428  1.00  0.00           H  
HETATM   39  H   UNL     1       2.434   1.168  -0.817  1.00  0.00           H  
HETATM   40  H   UNL     1       3.315  -3.050   1.596  1.00  0.00           H  
CONECT    1   10    9                                                 
CONECT    2   23   23                                                 
CONECT    3    4   31   31   31                                       
CONECT    4    5    5    9    3                                       
CONECT    5    6    4    4   32                                       
CONECT    6   28    7    7    5                                       
CONECT    7    6    6    8   33                                       
CONECT    8    7    9    9   34                                       
CONECT    9    8    8    4    1                                       
CONECT   10   11   11   19    1                                       
CONECT   11   12   10   10   35                                       
CONECT   12   13   13   11   36                                       
CONECT   13   27   12   12   14                                       
CONECT   14   13   19   19   37                                       
CONECT   15   16   23   20   20                                       
CONECT   16   17   17   15   38                                       
CONECT   17   16   16   18   39                                       
CONECT   18   17   26   21   21                                       
CONECT   19   14   14   10   26                                       
CONECT   20   15   15   21   40                                       
CONECT   21   18   18   20   22                                       
CONECT   22   21   25   25   25                                       
CONECT   23    2    2   15   24                                       
CONECT   24   23                                                      
CONECT   25   22   22   22                                            
CONECT   26   19   18                                                 
CONECT   27   13                                                      
CONECT   28   30    6   29   29                                       
CONECT   29   28   28                                                 
CONECT   30   28                                                      
CONECT   31    3    3    3                                            
CONECT   32    5                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   14                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   20                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
