COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.901   2.480  -0.220  1.00  0.00           C  
HETATM    2  N   UNL     1      -3.030   3.227  -0.335  1.00  0.00           N  
HETATM    3  O   UNL     1       2.106   3.221   0.685  1.00  0.00           O  
HETATM    4  C   UNL     1      -2.265   1.145  -0.480  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.031   2.458  -0.646  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.454   0.009  -1.071  1.00  0.00           C  
HETATM    7  C   UNL     1       1.776   2.075   0.452  1.00  0.00           C  
HETATM    8  N   UNL     1       2.693   1.088   0.491  1.00  0.00           N  
HETATM    9  C   UNL     1       4.089   1.398   0.813  1.00  0.00           C  
HETATM   10  C   UNL     1       4.902   0.129   0.791  1.00  0.00           C  
HETATM   11  C   UNL     1       5.040  -0.624   1.942  1.00  0.00           C  
HETATM   12  C   UNL     1       5.786  -1.788   1.921  1.00  0.00           C  
HETATM   13  C   UNL     1       6.395  -2.198   0.751  1.00  0.00           C  
HETATM   14  C   UNL     1       6.258  -1.444  -0.401  1.00  0.00           C  
HETATM   15 CL   UNL     1       7.023  -1.959  -1.872  1.00  0.00          Cl  
HETATM   16  C   UNL     1       5.506  -0.283  -0.382  1.00  0.00           C  
HETATM   17  C   UNL     1       0.369   1.763   0.128  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.576   2.783   0.088  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.009   0.440  -0.138  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.307   0.139  -0.435  1.00  0.00           C  
HETATM   21  N   UNL     1      -3.617   1.165  -0.743  1.00  0.00           N  
HETATM   22  C   UNL     1      -4.919  -0.668   0.220  1.00  0.00           C  
HETATM   23  N   UNL     1      -5.758  -1.828  -0.109  1.00  0.00           N  
HETATM   24  C   UNL     1      -6.029  -2.642   1.090  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.562  -2.739   1.240  1.00  0.00           C  
HETATM   26  C   UNL     1      -8.073  -2.453  -0.197  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.049  -1.400  -0.689  1.00  0.00           C  
HETATM   28  H   UNL     1      -5.046   2.795  -0.799  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.323   0.339  -1.641  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.878  -0.700  -1.665  1.00  0.00           H  
HETATM   31  H   UNL     1       2.430   0.173   0.306  1.00  0.00           H  
HETATM   32  H   UNL     1       4.485   2.097   0.078  1.00  0.00           H  
HETATM   33  H   UNL     1       4.141   1.845   1.806  1.00  0.00           H  
HETATM   34  H   UNL     1       4.564  -0.304   2.857  1.00  0.00           H  
HETATM   35  H   UNL     1       5.893  -2.376   2.821  1.00  0.00           H  
HETATM   36  H   UNL     1       6.979  -3.107   0.735  1.00  0.00           H  
HETATM   37  H   UNL     1       5.396   0.304  -1.282  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.285   3.803   0.294  1.00  0.00           H  
HETATM   39  H   UNL     1       0.730  -0.346  -0.105  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.590  -0.884  -0.635  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.051  -0.998   0.790  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.496   0.041   0.814  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.605  -3.638   0.965  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.597  -2.162   1.969  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.855  -3.738   1.562  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.929  -1.987   1.939  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.033  -3.353  -0.811  1.00  0.00           H  
HETATM   48  H   UNL     1      -9.081  -2.039  -0.178  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.319  -0.409  -0.324  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.996  -1.403  -1.778  1.00  0.00           H  
CONECT    1    4    2   18   18                                       
CONECT    2    5    5    1                                            
CONECT    3    7    7                                                 
CONECT    4   20   20   21    1                                       
CONECT    5   21    2    2   28                                       
CONECT    6   22   21   29   30                                       
CONECT    7    3    3   17    8                                       
CONECT    8    7    9   31                                            
CONECT    9    8   10   32   33                                       
CONECT   10    9   16   16   11                                       
CONECT   11   10   12   12   34                                       
CONECT   12   11   11   13   35                                       
CONECT   13   14   14   12   36                                       
CONECT   14   16   15   13   13                                       
CONECT   15   14                                                      
CONECT   16   10   10   14   37                                       
CONECT   17   19   19   18    7                                       
CONECT   18    1    1   17   38                                       
CONECT   19   20   17   17   39                                       
CONECT   20    4    4   19   40                                       
CONECT   21    6    4    5                                            
CONECT   22   23    6   41   42                                       
CONECT   23   27   24   22                                            
CONECT   24   25   23   43   44                                       
CONECT   25   26   24   45   46                                       
CONECT   26   25   27   47   48                                       
CONECT   27   26   23   49   50                                       
CONECT   28    5                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33    9                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   16                                                      
CONECT   38   18                                                      
CONECT   39   19                                                      
CONECT   40   20                                                      
CONECT   41   22                                                      
CONECT   42   22                                                      
CONECT   43   24                                                      
CONECT   44   24                                                      
CONECT   45   25                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
CONECT   50   27                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
