COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.220   1.848   0.933  1.00  0.00           C  
HETATM    2  C   UNL     1       5.044   0.648   0.544  1.00  0.00           C  
HETATM    3  C   UNL     1       4.799  -0.595   1.149  1.00  0.00           C  
HETATM    4  C   UNL     1       7.786  -0.458  -1.654  1.00  0.00           C  
HETATM    5  C   UNL     1       6.012   0.772  -0.388  1.00  0.00           C  
HETATM    6  C   UNL     1       1.855   1.226   0.619  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.149   0.449   0.820  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.565   0.113   0.571  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.189   0.540  -0.605  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.509   0.226  -0.836  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.225  -0.517   0.104  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.603  -0.943   1.278  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.281  -0.636   1.508  1.00  0.00           C  
HETATM   14  C   UNL     1      -7.415  -2.476  -0.241  1.00  0.00           C  
HETATM   15  C   UNL     1      -8.306  -1.481  -0.601  1.00  0.00           C  
HETATM   16  C   UNL     1      -7.874  -0.174  -0.736  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.550   0.146  -0.510  1.00  0.00           C  
HETATM   18 CL   UNL     1      -6.010   1.787  -0.679  1.00  0.00          Cl  
HETATM   19  C   UNL     1      -6.089  -2.168  -0.007  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.647  -0.854  -0.146  1.00  0.00           C  
HETATM   21  N   UNL     1       0.556   0.110   1.872  1.00  0.00           N  
HETATM   22  N   UNL     1       1.750   0.573   1.753  1.00  0.00           N  
HETATM   23  O   UNL     1       0.659   1.163   0.005  1.00  0.00           O  
HETATM   24  N   UNL     1       2.984   1.866   0.147  1.00  0.00           N  
HETATM   25  C   UNL     1       2.945   2.564  -1.141  1.00  0.00           C  
HETATM   26  N   UNL     1       6.765  -0.305  -0.756  1.00  0.00           N  
HETATM   27  C   UNL     1       8.165  -1.754  -1.610  1.00  0.00           C  
HETATM   28  N   UNL     1       7.406  -2.391  -0.715  1.00  0.00           N  
HETATM   29  C   UNL     1       6.548  -1.532  -0.183  1.00  0.00           C  
HETATM   30  C   UNL     1       5.545  -1.676   0.796  1.00  0.00           C  
HETATM   31  H   UNL     1       3.975   1.792   1.994  1.00  0.00           H  
HETATM   32  H   UNL     1       4.787   2.758   0.738  1.00  0.00           H  
HETATM   33  H   UNL     1       4.021  -0.693   1.892  1.00  0.00           H  
HETATM   34  H   UNL     1       8.210   0.313  -2.280  1.00  0.00           H  
HETATM   35  H   UNL     1       6.193   1.733  -0.847  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.635   1.116  -1.332  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.991   0.556  -1.744  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.158  -1.518   2.004  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.799  -0.970   2.414  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.757  -3.494  -0.137  1.00  0.00           H  
HETATM   41  H   UNL     1      -9.342  -1.727  -0.779  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.575   0.599  -1.018  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.395  -2.945   0.275  1.00  0.00           H  
HETATM   44  H   UNL     1       3.225   1.874  -1.937  1.00  0.00           H  
HETATM   45  H   UNL     1       1.937   2.937  -1.322  1.00  0.00           H  
HETATM   46  H   UNL     1       3.644   3.400  -1.122  1.00  0.00           H  
HETATM   47  H   UNL     1       8.951  -2.201  -2.201  1.00  0.00           H  
HETATM   48  H   UNL     1       5.365  -2.637   1.255  1.00  0.00           H  
CONECT    1    2   24   31   32                                       
CONECT    2    5    5    3    1                                       
CONECT    3   30   30    2   33                                       
CONECT    4   27   27   26   34                                       
CONECT    5   26    2    2   35                                       
CONECT    6   24   23   22   22                                       
CONECT    7   23   21   21    8                                       
CONECT    8    7    9    9   13                                       
CONECT    9    8    8   10   36                                       
CONECT   10    9   11   11   37                                       
CONECT   11   10   10   12   20                                       
CONECT   12   13   13   11   38                                       
CONECT   13    8   12   12   39                                       
CONECT   14   19   15   15   40                                       
CONECT   15   14   14   16   41                                       
CONECT   16   17   17   15   42                                       
CONECT   17   20   18   16   16                                       
CONECT   18   17                                                      
CONECT   19   20   20   14   43                                       
CONECT   20   11   19   19   17                                       
CONECT   21   22    7    7                                            
CONECT   22    6    6   21                                            
CONECT   23    6    7                                                 
CONECT   24   25    1    6                                            
CONECT   25   24   44   45   46                                       
CONECT   26    4   29    5                                            
CONECT   27    4    4   28   47                                       
CONECT   28   27   29   29                                            
CONECT   29   28   28   26   30                                       
CONECT   30   29    3    3   48                                       
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   19                                                      
CONECT   44   25                                                      
CONECT   45   25                                                      
CONECT   46   25                                                      
CONECT   47   27                                                      
CONECT   48   30                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
