COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.123  -1.524   0.108  1.00  0.00           C  
HETATM    2  C   UNL     1       2.082   0.423   0.202  1.00  0.00           C  
HETATM    3  C   UNL     1       0.370  -0.793  -1.144  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.116  -2.619   1.148  1.00  0.00           C  
HETATM    5  C   UNL     1       3.948   1.995   0.281  1.00  0.00           C  
HETATM    6  C   UNL     1       2.960  -2.466   1.755  1.00  0.00           C1-
HETATM    7  C   UNL     1      -3.560  -0.428  -0.952  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.174   0.823  -0.994  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.686   1.954  -0.354  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.504   1.807   0.370  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.917   0.537   0.385  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.408  -0.604  -0.254  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.614   1.860   1.604  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.694   0.606   1.188  1.00  0.00           C  
HETATM   15  C   UNL     1       0.128  -0.646   1.342  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.609  -1.861  -0.081  1.00  0.00           C  
HETATM   17  C   UNL     1       1.608  -0.304   1.461  1.00  0.00           C  
HETATM   18  C   UNL     1       1.861  -0.483  -1.013  1.00  0.00           C  
HETATM   19  C   UNL     1       3.548   0.748   0.329  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.775  -2.739  -1.322  1.00  0.00           C  
HETATM   21  C   UNL     1       1.284   1.717   0.027  1.00  0.00           C  
HETATM   22  N   UNL     1      -1.689   2.595   1.124  1.00  0.00           N  
HETATM   23  N   UNL     1       2.361  -1.509   1.625  1.00  0.00           N1+
HETATM   24 CL   UNL     1       2.435   0.356  -2.502  1.00  0.00          Cl  
HETATM   25  H   UNL     1       0.432  -2.455   0.216  1.00  0.00           H  
HETATM   26  H   UNL     1       0.207  -1.423  -2.019  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.185   0.138  -1.262  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.168  -2.872   1.010  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.537  -3.533   1.276  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.006  -1.992   2.033  1.00  0.00           H  
HETATM   31  H   UNL     1       4.999   2.228   0.372  1.00  0.00           H  
HETATM   32  H   UNL     1       3.228   2.789   0.150  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.003  -1.262  -1.476  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.089   0.918  -1.561  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.198   2.904  -0.415  1.00  0.00           H  
HETATM   36  H   UNL     1       0.174   2.255   2.227  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.190  -1.180   2.237  1.00  0.00           H  
HETATM   38  H   UNL     1       1.763   0.337   2.329  1.00  0.00           H  
HETATM   39  H   UNL     1       2.415  -1.411  -0.881  1.00  0.00           H  
HETATM   40  H   UNL     1       4.268  -0.046   0.460  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.829  -2.985  -1.455  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.414  -2.201  -2.199  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.201  -3.658  -1.198  1.00  0.00           H  
HETATM   44  H   UNL     1       1.747   2.327  -0.748  1.00  0.00           H  
HETATM   45  H   UNL     1       0.261   1.476  -0.262  1.00  0.00           H  
HETATM   46  H   UNL     1       1.276   2.268   0.967  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.838   3.537   1.302  1.00  0.00           H  
CONECT    1   16    3   15   25                                       
CONECT    2   18   17   21   19                                       
CONECT    3    1   18   26   27                                       
CONECT    4   16   28   29   30                                       
CONECT    5   19   19   31   32                                       
CONECT    6   23   23   23                                            
CONECT    7    8    8   12   33                                       
CONECT    8    7    7    9   34                                       
CONECT    9    8   10   10   35                                       
CONECT   10    9    9   11   22                                       
CONECT   11   12   12   10   14                                       
CONECT   12    7   16   11   11                                       
CONECT   13   14   14   22   36                                       
CONECT   14   11   15   13   13                                       
CONECT   15    1   14   17   37                                       
CONECT   16   20    4   12    1                                       
CONECT   17   15   23    2   38                                       
CONECT   18    3   24    2   39                                       
CONECT   19    2    5    5   40                                       
CONECT   20   16   41   42   43                                       
CONECT   21    2   44   45   46                                       
CONECT   22   10   13   47                                            
CONECT   23    6    6    6   17                                       
CONECT   24   18                                                      
CONECT   25    1                                                      
CONECT   26    3                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36   13                                                      
CONECT   37   15                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
