COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.796   1.570   0.517  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.108   1.923   1.664  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.782   1.567   1.812  1.00  0.00           C  
HETATM    4  C   UNL     1       1.344  -2.288   0.189  1.00  0.00           C  
HETATM    5  C   UNL     1       3.123  -1.072   0.703  1.00  0.00           C  
HETATM    6  C   UNL     1       4.552  -0.652   0.933  1.00  0.00           C  
HETATM    7  C   UNL     1       4.846   0.589   0.131  1.00  0.00           C  
HETATM    8  C   UNL     1       4.633   1.837   0.685  1.00  0.00           C  
HETATM    9  C   UNL     1       4.902   2.976  -0.052  1.00  0.00           C  
HETATM   10  C   UNL     1       5.385   2.866  -1.342  1.00  0.00           C  
HETATM   11  C   UNL     1       5.599   1.618  -1.896  1.00  0.00           C  
HETATM   12  C   UNL     1       5.335   0.479  -1.158  1.00  0.00           C  
HETATM   13 CL   UNL     1      -5.026   0.422  -1.923  1.00  0.00          Cl  
HETATM   14  C   UNL     1      -4.158   0.861  -0.485  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.245   1.955   0.362  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.831   0.502  -0.343  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.138   0.855   0.808  1.00  0.00           C  
HETATM   18  N   UNL     1      -0.796   0.494   0.955  1.00  0.00           N  
HETATM   19  C   UNL     1      -0.371  -0.769   0.571  1.00  0.00           C  
HETATM   20  N   UNL     1       0.936  -1.073   0.558  1.00  0.00           N1+
HETATM   21  N   UNL     1       0.475  -3.228  -0.169  1.00  0.00           N  
HETATM   22  C   UNL     1      -0.824  -2.989  -0.178  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.791  -4.069  -0.588  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.292  -1.737   0.192  1.00  0.00           C  
HETATM   25  N   UNL     1       2.074  -0.321   0.878  1.00  0.00           N  
HETATM   26  N   UNL     1       2.717  -2.299   0.276  1.00  0.00           N  
HETATM   27  H   UNL     1      -4.608   2.476   2.445  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.245   1.843   2.708  1.00  0.00           H  
HETATM   29  H   UNL     1       4.703  -0.444   1.993  1.00  0.00           H  
HETATM   30  H   UNL     1       5.221  -1.454   0.622  1.00  0.00           H  
HETATM   31  H   UNL     1       4.255   1.923   1.693  1.00  0.00           H  
HETATM   32  H   UNL     1       4.735   3.951   0.381  1.00  0.00           H  
HETATM   33  H   UNL     1       5.595   3.755  -1.918  1.00  0.00           H  
HETATM   34  H   UNL     1       5.976   1.532  -2.904  1.00  0.00           H  
HETATM   35  H   UNL     1       5.502  -0.496  -1.590  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.876   1.165   0.770  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.434   2.884   0.899  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.473   2.093  -0.695  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.333  -0.052  -1.125  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.161   1.128   1.326  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.089  -4.642   0.290  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.673  -3.615  -1.041  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.312  -4.732  -1.309  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.350  -1.521   0.192  1.00  0.00           H  
HETATM   45  H   UNL     1       3.294  -3.051   0.069  1.00  0.00           H  
CONECT    1   15   14   14    2                                       
CONECT    2    1    3    3   27                                       
CONECT    3    2    2   17   28                                       
CONECT    4   20   20   21   26                                       
CONECT    5   25   25   26    6                                       
CONECT    6    7    5   29   30                                       
CONECT    7    8    8   12    6                                       
CONECT    8    9    7    7   31                                       
CONECT    9   10   10    8   32                                       
CONECT   10    9    9   11   33                                       
CONECT   11   10   12   12   34                                       
CONECT   12   11   11    7   35                                       
CONECT   13   14                                                      
CONECT   14   13    1    1   16                                       
CONECT   15    1   36   37   38                                       
CONECT   16   14   17   17   39                                       
CONECT   17   16   16    3   18                                       
CONECT   18   17   19   40                                            
CONECT   19   18   24   24   20                                       
CONECT   20   19   25    4    4                                       
CONECT   21   22   22    4                                            
CONECT   22   24   23   21   21                                       
CONECT   23   22   41   42   43                                       
CONECT   24   19   19   22   44                                       
CONECT   25   20    5    5                                            
CONECT   26    4    5   45                                            
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   15                                                      
CONECT   37   15                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   18                                                      
CONECT   41   23                                                      
CONECT   42   23                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
CONECT   45   26                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
