COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.272  -1.128   6.043  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.776  -1.931   3.815  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.093  -1.488   2.385  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.690   0.463   2.679  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.373   0.019   4.109  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.182  -0.360   0.525  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.221   0.372  -0.159  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.457   0.726  -1.483  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.217   1.426  -1.852  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.221   2.317  -2.550  1.00  0.00           C  
HETATM   11  C   UNL     1       0.677   2.838  -0.991  1.00  0.00           C  
HETATM   12  C   UNL     1       1.916   2.359  -0.713  1.00  0.00           C  
HETATM   13  C   UNL     1       2.863   2.880   0.302  1.00  0.00           C  
HETATM   14  C   UNL     1       3.153   4.245   0.350  1.00  0.00           C  
HETATM   15  C   UNL     1       4.033   4.736   1.291  1.00  0.00           C  
HETATM   16  C   UNL     1       4.340   6.211   1.335  1.00  0.00           C  
HETATM   17  C   UNL     1       4.636   3.877   2.199  1.00  0.00           C  
HETATM   18  C   UNL     1       4.351   2.505   2.159  1.00  0.00           C  
HETATM   19  C   UNL     1       3.457   2.010   1.209  1.00  0.00           C  
HETATM   20  C   UNL     1       4.972   1.615   3.094  1.00  0.00           C  
HETATM   21  C   UNL     1       2.131   1.222  -1.615  1.00  0.00           C  
HETATM   22  C   UNL     1       3.189   0.311  -1.829  1.00  0.00           C  
HETATM   23  C   UNL     1       4.100  -1.605  -3.034  1.00  0.00           C  
HETATM   24  C   UNL     1       3.915  -2.783  -2.171  1.00  0.00           C  
HETATM   25  C   UNL     1       3.768  -3.723  -1.484  1.00  0.00           C  
HETATM   26  C   UNL     1       3.588  -4.869  -0.644  1.00  0.00           C  
HETATM   27  C   UNL     1       2.467  -5.725  -0.631  1.00  0.00           C  
HETATM   28  C   UNL     1       4.537  -7.247   1.906  1.00  0.00           C  
HETATM   29  C   UNL     1       4.473  -5.337   0.286  1.00  0.00           C  
HETATM   30  C   UNL     1       1.877  -0.701  -3.495  1.00  0.00           C  
HETATM   31  C   UNL     1       0.969   1.107  -2.386  1.00  0.00           C  
HETATM   32  C   UNL     1      -5.659   0.326  -2.072  1.00  0.00           C  
HETATM   33  C   UNL     1      -6.564  -0.401  -1.328  1.00  0.00           C  
HETATM   34  N   UNL     1      -5.507  -0.748   4.644  1.00  0.00           N  
HETATM   35  N   UNL     1      -4.960  -0.720   1.850  1.00  0.00           N  
HETATM   36  N   UNL     1      -3.517   1.462  -2.205  1.00  0.00           N  
HETATM   37  N   UNL     1       0.113   2.092  -1.989  1.00  0.00           N  
HETATM   38  N   UNL     1       5.464   0.909   3.836  1.00  0.00           N  
HETATM   39  N   UNL     1       3.029  -0.639  -2.779  1.00  0.00           N  
HETATM   40  N   UNL     1       2.675  -6.651   0.267  1.00  0.00           N  
HETATM   41  N   UNL     1       3.925  -6.429   0.855  1.00  0.00           N  
HETATM   42  N   UNL     1       0.894   0.132  -3.309  1.00  0.00           N  
HETATM   43  N   UNL     1      -6.311  -0.716  -0.070  1.00  0.00           N  
HETATM   44  O   UNL     1      -1.848   0.677  -0.973  1.00  0.00           O  
HETATM   45  O   UNL     1       5.501   4.365   3.124  1.00  0.00           O  
HETATM   46  O   UNL     1       4.217   0.379  -1.178  1.00  0.00           O  
HETATM   47 CL   UNL     1      -6.008   0.738  -3.722  1.00  0.00          Cl  
HETATM   48  H   UNL     1      -4.413  -1.797   6.098  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.075  -0.234   6.634  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.154  -1.636   6.434  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.627  -2.476   4.223  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.899  -2.578   3.809  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.265  -2.365   1.761  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.986  -0.863   2.387  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.568   1.110   2.685  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.840   1.008   2.270  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.480  -0.606   4.106  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.201   0.897   4.732  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.304   0.664   0.331  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.211   2.086  -3.615  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.504   3.360  -2.407  1.00  0.00           H  
HETATM   62  H   UNL     1       0.207   3.677  -0.498  1.00  0.00           H  
HETATM   63  H   UNL     1       2.687   4.919  -0.354  1.00  0.00           H  
HETATM   64  H   UNL     1       3.634   6.709   2.000  1.00  0.00           H  
HETATM   65  H   UNL     1       5.354   6.360   1.705  1.00  0.00           H  
HETATM   66  H   UNL     1       4.253   6.630   0.333  1.00  0.00           H  
HETATM   67  H   UNL     1       3.230   0.955   1.176  1.00  0.00           H  
HETATM   68  H   UNL     1       5.064  -1.144  -2.817  1.00  0.00           H  
HETATM   69  H   UNL     1       4.071  -1.912  -4.080  1.00  0.00           H  
HETATM   70  H   UNL     1       1.590  -5.631  -1.254  1.00  0.00           H  
HETATM   71  H   UNL     1       4.250  -6.857   2.883  1.00  0.00           H  
HETATM   72  H   UNL     1       4.193  -8.277   1.811  1.00  0.00           H  
HETATM   73  H   UNL     1       5.622  -7.215   1.806  1.00  0.00           H  
HETATM   74  H   UNL     1       5.436  -4.909   0.521  1.00  0.00           H  
HETATM   75  H   UNL     1       1.773  -1.469  -4.247  1.00  0.00           H  
HETATM   76  H   UNL     1      -7.497  -0.709  -1.777  1.00  0.00           H  
HETATM   77  H   UNL     1      -3.799   2.000  -2.962  1.00  0.00           H  
HETATM   78  H   UNL     1       5.081   4.630   3.954  1.00  0.00           H  
CONECT    1   34   48   49   50                                       
CONECT    2    3   34   51   52                                       
CONECT    3    2   35   53   54                                       
CONECT    4   35    5   55   56                                       
CONECT    5   34    4   57   58                                       
CONECT    6   43   35    7    7                                       
CONECT    7    6    6    8   59                                       
CONECT    8   32   32    7   36                                       
CONECT    9   36   44   44   10                                       
CONECT   10    9   37   60   61                                       
CONECT   11   12   12   37   62                                       
CONECT   12   11   11   13   21                                       
CONECT   13   14   12   19   19                                       
CONECT   14   15   15   13   63                                       
CONECT   15   16   14   14   17                                       
CONECT   16   15   64   65   66                                       
CONECT   17   15   45   18   18                                       
CONECT   18   17   17   19   20                                       
CONECT   19   13   13   18   67                                       
CONECT   20   18   38   38   38                                       
CONECT   21   12   31   31   22                                       
CONECT   22   21   46   46   39                                       
CONECT   23   39   24   68   69                                       
CONECT   24   23   25   25   25                                       
CONECT   25   24   24   24   26                                       
CONECT   26   25   27   29   29                                       
CONECT   27   26   40   40   70                                       
CONECT   28   41   71   72   73                                       
CONECT   29   26   26   41   74                                       
CONECT   30   42   42   39   75                                       
CONECT   31   37   21   21   42                                       
CONECT   32   33   47    8    8                                       
CONECT   33   43   43   32   76                                       
CONECT   34    2    1    5                                            
CONECT   35    6    3    4                                            
CONECT   36    8    9   77                                            
CONECT   37   11   10   31                                            
CONECT   38   20   20   20                                            
CONECT   39   22   30   23                                            
CONECT   40   27   27   41                                            
CONECT   41   29   40   28                                            
CONECT   42   31   30   30                                            
CONECT   43   33   33    6                                            
CONECT   44    9    9                                                 
CONECT   45   17   78                                                 
CONECT   46   22   22                                                 
CONECT   47   32                                                      
CONECT   48    1                                                      
CONECT   49    1                                                      
CONECT   50    1                                                      
CONECT   51    2                                                      
CONECT   52    2                                                      
CONECT   53    3                                                      
CONECT   54    3                                                      
CONECT   55    4                                                      
CONECT   56    4                                                      
CONECT   57    5                                                      
CONECT   58    5                                                      
CONECT   59    7                                                      
CONECT   60   10                                                      
CONECT   61   10                                                      
CONECT   62   11                                                      
CONECT   63   14                                                      
CONECT   64   16                                                      
CONECT   65   16                                                      
CONECT   66   16                                                      
CONECT   67   19                                                      
CONECT   68   23                                                      
CONECT   69   23                                                      
CONECT   70   27                                                      
CONECT   71   28                                                      
CONECT   72   28                                                      
CONECT   73   28                                                      
CONECT   74   29                                                      
CONECT   75   30                                                      
CONECT   76   33                                                      
CONECT   77   36                                                      
CONECT   78   45                                                      
MASTER        0    0    0    0    0    0    0    0   78    0   78    0
END
