COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.150   1.962  -0.532  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.414  -0.062  -1.692  1.00  0.00           C  
HETATM    3  N   UNL     1      -3.219   0.945  -1.536  1.00  0.00           N  
HETATM    4  C   UNL     1      -3.599  -1.439  -0.192  1.00  0.00           C  
HETATM    5  N   UNL     1       2.248  -1.805   0.441  1.00  0.00           N  
HETATM    6  C   UNL     1       0.605  -3.274  -0.606  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.603  -0.401   0.892  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.221   1.853   0.329  1.00  0.00           C  
HETATM    9  N   UNL     1      -2.565  -1.246  -1.044  1.00  0.00           N  
HETATM   10  C   UNL     1      -0.455  -2.220  -0.280  1.00  0.00           C  
HETATM   11  O   UNL     1      -0.951  -2.435   1.043  1.00  0.00           O  
HETATM   12  C   UNL     1      -1.608  -2.330  -1.280  1.00  0.00           C  
HETATM   13  C   UNL     1       1.741  -3.184   0.418  1.00  0.00           C  
HETATM   14  C   UNL     1       3.560  -1.553   0.262  1.00  0.00           C  
HETATM   15  C   UNL     1       4.065  -0.133   0.288  1.00  0.00           C  
HETATM   16  C   UNL     1       5.578  -0.126   0.062  1.00  0.00           C  
HETATM   17  C   UNL     1       6.272  -0.824   1.233  1.00  0.00           C  
HETATM   18  C   UNL     1       6.065   1.297  -0.035  1.00  0.00           C  
HETATM   19  C   UNL     1       6.694   1.735  -1.185  1.00  0.00           C  
HETATM   20  C   UNL     1       7.141   3.041  -1.273  1.00  0.00           C  
HETATM   21  C   UNL     1       6.958   3.907  -0.212  1.00  0.00           C  
HETATM   22  C   UNL     1       6.328   3.469   0.938  1.00  0.00           C  
HETATM   23  C   UNL     1       5.877   2.165   1.024  1.00  0.00           C  
HETATM   24  C   UNL     1       1.297  -0.706   0.656  1.00  0.00           C  
HETATM   25  C   UNL     1       0.166  -0.824  -0.371  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.522  -0.314   0.018  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.447   0.678   1.037  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.285   0.880  -0.700  1.00  0.00           C  
HETATM   29  O   UNL     1      -3.747  -2.495   0.394  1.00  0.00           O  
HETATM   30  O   UNL     1       4.334  -2.469   0.080  1.00  0.00           O  
HETATM   31 CL   UNL     1      -7.300   3.198   0.532  1.00  0.00          Cl  
HETATM   32  H   UNL     1      -4.984   2.880  -1.077  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.582   0.048  -2.372  1.00  0.00           H  
HETATM   34  H   UNL     1       0.156  -4.267  -0.564  1.00  0.00           H  
HETATM   35  H   UNL     1       1.000  -3.096  -1.605  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.787  -1.312   1.441  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.628  -1.802   1.317  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.108  -3.290  -1.154  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.217  -2.255  -2.295  1.00  0.00           H  
HETATM   40  H   UNL     1       2.544  -3.864   0.134  1.00  0.00           H  
HETATM   41  H   UNL     1       1.365  -3.451   1.406  1.00  0.00           H  
HETATM   42  H   UNL     1       3.577   0.440  -0.500  1.00  0.00           H  
HETATM   43  H   UNL     1       3.840   0.315   1.256  1.00  0.00           H  
HETATM   44  H   UNL     1       5.809  -0.653  -0.864  1.00  0.00           H  
HETATM   45  H   UNL     1       6.041  -0.298   2.159  1.00  0.00           H  
HETATM   46  H   UNL     1       5.920  -1.854   1.303  1.00  0.00           H  
HETATM   47  H   UNL     1       7.350  -0.819   1.072  1.00  0.00           H  
HETATM   48  H   UNL     1       6.837   1.058  -2.014  1.00  0.00           H  
HETATM   49  H   UNL     1       7.633   3.383  -2.172  1.00  0.00           H  
HETATM   50  H   UNL     1       7.307   4.927  -0.281  1.00  0.00           H  
HETATM   51  H   UNL     1       6.186   4.146   1.767  1.00  0.00           H  
HETATM   52  H   UNL     1       5.385   1.822   1.923  1.00  0.00           H  
HETATM   53  H   UNL     1       0.885  -0.771   1.663  1.00  0.00           H  
HETATM   54  H   UNL     1       1.808   0.249   0.529  1.00  0.00           H  
HETATM   55  H   UNL     1       0.567  -0.669  -1.372  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.595  -0.073  -0.162  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.292   0.611   1.707  1.00  0.00           H  
CONECT    1   28   28    8   32                                       
CONECT    2    3    3    9   33                                       
CONECT    3    2    2   28                                            
CONECT    4    9   26   29   29                                       
CONECT    5   14   13   24                                            
CONECT    6   13   10   34   35                                       
CONECT    7   26   26   27   36                                       
CONECT    8    1   31   27   27                                       
CONECT    9    2   12    4                                            
CONECT   10    6   25   12   11                                       
CONECT   11   10   37                                                 
CONECT   12   10    9   38   39                                       
CONECT   13    5    6   40   41                                       
CONECT   14   30   30   15    5                                       
CONECT   15   16   14   42   43                                       
CONECT   16   17   18   15   44                                       
CONECT   17   16   45   46   47                                       
CONECT   18   23   16   19   19                                       
CONECT   19   18   18   20   48                                       
CONECT   20   21   21   19   49                                       
CONECT   21   22   20   20   50                                       
CONECT   22   23   23   21   51                                       
CONECT   23   22   22   18   52                                       
CONECT   24    5   25   53   54                                       
CONECT   25   24   10   55   56                                       
CONECT   26   28    4    7    7                                       
CONECT   27    8    8    7   57                                       
CONECT   28    3    1    1   26                                       
CONECT   29    4    4                                                 
CONECT   30   14   14                                                 
CONECT   31    8                                                      
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   17                                                      
CONECT   47   17                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   22                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   25                                                      
CONECT   57   27                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
