COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.798  -0.097  -0.327  1.00  0.00           N  
HETATM    2  C   UNL     1       4.394   0.074   0.898  1.00  0.00           C  
HETATM    3  C   UNL     1       4.268   1.446   0.809  1.00  0.00           C  
HETATM    4  C   UNL     1       3.207   1.996   0.113  1.00  0.00           C  
HETATM    5  C   UNL     1       2.277   1.169  -0.488  1.00  0.00           C  
HETATM    6  C   UNL     1       2.401  -0.209  -0.397  1.00  0.00           C  
HETATM    7  C   UNL     1       0.113  -1.084  -0.208  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.289  -0.320   1.918  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.581   0.747   0.122  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.444   1.381  -1.894  1.00  0.00           C  
HETATM   11  O   UNL     1      -0.068  -1.984   0.584  1.00  0.00           O  
HETATM   12  C   UNL     1       1.356  -1.068  -1.059  1.00  0.00           C  
HETATM   13 CL   UNL     1       3.044   3.720  -0.004  1.00  0.00          Cl  
HETATM   14  C   UNL     1       3.465  -0.756   0.289  1.00  0.00           C  
HETATM   15  C   UNL     1       3.649  -2.247   0.404  1.00  0.00           C  
HETATM   16  C   UNL     1       2.341  -2.962   0.063  1.00  0.00           C  
HETATM   17  N   UNL     1       1.848  -2.440  -1.223  1.00  0.00           N  
HETATM   18  C   UNL     1       0.804  -3.310  -1.781  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.989  -0.156   0.399  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.193   0.344  -0.146  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.253   0.916  -1.423  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.603   1.296  -1.124  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.371   0.257   0.640  1.00  0.00           C  
HETATM   24  N   UNL     1      -3.140  -0.766   2.368  1.00  0.00           N  
HETATM   25  C   UNL     1      -2.019  -0.703   1.665  1.00  0.00           C  
HETATM   26  H   UNL     1      -0.624   0.655  -0.915  1.00  0.00           H  
HETATM   27  H   UNL     1       5.223  -0.356   1.441  1.00  0.00           H  
HETATM   28  H   UNL     1       4.997   2.088   1.282  1.00  0.00           H  
HETATM   29  H   UNL     1       1.448   1.599  -1.031  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.173  -0.392   2.534  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.486   0.689   0.707  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.491   1.822  -2.878  1.00  0.00           H  
HETATM   33  H   UNL     1       1.117  -0.653  -2.038  1.00  0.00           H  
HETATM   34  H   UNL     1       4.428  -2.570  -0.287  1.00  0.00           H  
HETATM   35  H   UNL     1       3.942  -2.498   1.423  1.00  0.00           H  
HETATM   36  H   UNL     1       2.520  -4.034  -0.023  1.00  0.00           H  
HETATM   37  H   UNL     1       1.607  -2.776   0.847  1.00  0.00           H  
HETATM   38  H   UNL     1       0.432  -2.881  -2.711  1.00  0.00           H  
HETATM   39  H   UNL     1       1.221  -4.298  -1.978  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.015  -3.397  -1.067  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.363   0.988  -2.029  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.534   1.673  -1.522  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.105  -1.089   2.093  1.00  0.00           H  
CONECT    1   19    7   26                                            
CONECT    2   14   14    3   27                                       
CONECT    3    4    4    2   28                                       
CONECT    4    5   13    3    3                                       
CONECT    5    6    6    4   29                                       
CONECT    6   12    5    5   14                                       
CONECT    7    1   12   11   11                                       
CONECT    8   23   23   24   30                                       
CONECT    9   22   22   23   31                                       
CONECT   10   22   21   21   32                                       
CONECT   11    7    7                                                 
CONECT   12   17    7    6   33                                       
CONECT   13    4                                                      
CONECT   14    6   15    2    2                                       
CONECT   15   16   14   34   35                                       
CONECT   16   17   15   36   37                                       
CONECT   17   18   12   16                                            
CONECT   18   17   38   39   40                                       
CONECT   19   20   20   25    1                                       
CONECT   20   23   21   19   19                                       
CONECT   21   10   10   20   41                                       
CONECT   22    9    9   10   42                                       
CONECT   23    9    8    8   20                                       
CONECT   24    8   25   25                                            
CONECT   25   24   24   19   43                                       
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    5                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32   10                                                      
CONECT   33   12                                                      
CONECT   34   15                                                      
CONECT   35   15                                                      
CONECT   36   16                                                      
CONECT   37   16                                                      
CONECT   38   18                                                      
CONECT   39   18                                                      
CONECT   40   18                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   25                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
