COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.718   0.369  -0.012  1.00  0.00           C  
HETATM    2  C   UNL     1       1.442   1.659  -0.008  1.00  0.00           C  
HETATM    3  C   UNL     1       2.912   3.216   1.080  1.00  0.00           C  
HETATM    4  C   UNL     1       2.000   3.736  -1.078  1.00  0.00           C  
HETATM    5  C   UNL     1       1.326   2.532  -1.091  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.465   1.576   0.016  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.213  -1.589   1.241  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.740  -1.489   1.285  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.329  -2.198   0.063  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.758  -1.565  -1.209  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.231  -1.664  -1.181  1.00  0.00           C  
HETATM   12  C   UNL     1       3.464  -2.102  -0.045  1.00  0.00           C  
HETATM   13  C   UNL     1       2.745  -3.296  -0.043  1.00  0.00           C  
HETATM   14  C   UNL     1       1.383  -3.294  -0.032  1.00  0.00           C  
HETATM   15  C   UNL     1       0.686  -2.074  -0.021  1.00  0.00           C  
HETATM   16  C   UNL     1       1.419  -0.864  -0.023  1.00  0.00           C  
HETATM   17  C   UNL     1       2.819  -0.900  -0.035  1.00  0.00           C  
HETATM   18  N   UNL     1      -0.654  -2.053  -0.010  1.00  0.00           N  
HETATM   19  C   UNL     1      -1.332  -0.926  -0.005  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.680   0.326  -0.001  1.00  0.00           C  
HETATM   21  C   UNL     1       2.239   2.011   1.082  1.00  0.00           C  
HETATM   22  C   UNL     1       2.797   4.074   0.001  1.00  0.00           C  
HETATM   23  N   UNL     1      -2.716  -0.969   0.006  1.00  0.00           N  
HETATM   24 CL   UNL     1       5.199  -2.145  -0.060  1.00  0.00          Cl  
HETATM   25  N   UNL     1      -2.820   1.685  -0.090  1.00  0.00           N  
HETATM   26  N   UNL     1      -3.083   3.064  -0.015  1.00  0.00           N  
HETATM   27  N   UNL     1      -1.947   3.656   0.123  1.00  0.00           N  
HETATM   28  N   UNL     1      -0.991   2.799   0.142  1.00  0.00           N  
HETATM   29  H   UNL     1       3.529   3.490   1.923  1.00  0.00           H  
HETATM   30  H   UNL     1       1.914   4.410  -1.918  1.00  0.00           H  
HETATM   31  H   UNL     1       0.711   2.265  -1.938  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.790  -1.073   2.102  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.918  -2.638   1.265  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.109  -1.963   2.194  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.036  -0.440   1.275  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.065  -3.256   0.093  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.413  -2.093   0.068  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.141  -2.094  -2.082  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.055  -0.518  -1.259  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.935  -2.712  -1.145  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.820  -1.201  -2.079  1.00  0.00           H  
HETATM   42  H   UNL     1       3.276  -4.236  -0.051  1.00  0.00           H  
HETATM   43  H   UNL     1       0.841  -4.228  -0.031  1.00  0.00           H  
HETATM   44  H   UNL     1       3.386   0.020  -0.036  1.00  0.00           H  
HETATM   45  H   UNL     1       2.329   1.343   1.926  1.00  0.00           H  
HETATM   46  H   UNL     1       3.322   5.018   0.006  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.463   0.967  -0.195  1.00  0.00           H  
CONECT    1   16    2   20   20                                       
CONECT    2    5    5   21    1                                       
CONECT    3   22   21   21   29                                       
CONECT    4   22   22    5   30                                       
CONECT    5    4    2    2   31                                       
CONECT    6   20   25   28   28                                       
CONECT    7   23    8   32   33                                       
CONECT    8    7    9   34   35                                       
CONECT    9   10    8   36   37                                       
CONECT   10   11    9   38   39                                       
CONECT   11   23   10   40   41                                       
CONECT   12   24   17   17   13                                       
CONECT   13   12   14   14   42                                       
CONECT   14   13   13   15   43                                       
CONECT   15   14   16   16   18                                       
CONECT   16   17   15   15    1                                       
CONECT   17   12   12   16   44                                       
CONECT   18   15   19   19                                            
CONECT   19   18   18   20   23                                       
CONECT   20    1    1   19    6                                       
CONECT   21    3    3    2   45                                       
CONECT   22    4    4    3   46                                       
CONECT   23   19   11    7                                            
CONECT   24   12                                                      
CONECT   25    6   26   47                                            
CONECT   26   25   27   27                                            
CONECT   27   28   26   26                                            
CONECT   28    6    6   27                                            
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   11                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   17                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   25                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
