COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.169   0.153   0.108  1.00  0.00           C  
HETATM    2  O   UNL     1       1.995   0.516   1.255  1.00  0.00           O  
HETATM    3  C   UNL     1       3.507  -0.292  -0.331  1.00  0.00           C  
HETATM    4  C   UNL     1       3.707  -0.711  -1.653  1.00  0.00           C  
HETATM    5  C   UNL     1       4.938  -1.119  -2.075  1.00  0.00           C  
HETATM    6  C   UNL     1       6.016  -1.125  -1.192  1.00  0.00           C  
HETATM    7  C   UNL     1       5.828  -0.707   0.139  1.00  0.00           C  
HETATM    8  C   UNL     1       4.570  -0.290   0.568  1.00  0.00           C  
HETATM    9  C   UNL     1       6.977  -0.719   1.056  1.00  0.00           C  
HETATM   10  C   UNL     1       8.185  -1.140   0.576  1.00  0.00           C  
HETATM   11  C   UNL     1       8.309  -1.545  -0.762  1.00  0.00           C  
HETATM   12  O   UNL     1       9.396  -1.917  -1.171  1.00  0.00           O  
HETATM   13  N   UNL     1       7.263  -1.535  -1.606  1.00  0.00           N  
HETATM   14  O   UNL     1       6.842  -0.326   2.343  1.00  0.00           O  
HETATM   15  N   UNL     1       1.141   0.156  -0.763  1.00  0.00           N  
HETATM   16  C   UNL     1      -0.187   0.598  -0.328  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.238  -0.034  -1.203  1.00  0.00           C  
HETATM   18  O   UNL     1      -0.911  -0.780  -2.102  1.00  0.00           O  
HETATM   19  C   UNL     1      -0.279   2.121  -0.438  1.00  0.00           C  
HETATM   20  C   UNL     1       0.688   2.754   0.528  1.00  0.00           C  
HETATM   21  C   UNL     1       1.981   3.035   0.127  1.00  0.00           C  
HETATM   22  C   UNL     1       0.281   3.060   1.813  1.00  0.00           C  
HETATM   23  C   UNL     1       2.868   3.617   1.013  1.00  0.00           C  
HETATM   24  C   UNL     1       1.170   3.637   2.701  1.00  0.00           C  
HETATM   25  C   UNL     1       2.463   3.917   2.300  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.575  -0.813   1.117  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.993  -1.892   1.747  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.736  -2.343   1.364  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.051  -1.717   0.346  1.00  0.00           C  
HETATM   30 CL   UNL     1      -5.024  -3.703   2.174  1.00  0.00          Cl  
HETATM   31  C   UNL     1      -5.629  -0.621  -0.303  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.902  -0.166   0.086  1.00  0.00           C  
HETATM   33  N   UNL     1      -7.466   0.915  -0.558  1.00  0.00           N  
HETATM   34  C   UNL     1      -6.817   1.541  -1.555  1.00  0.00           C  
HETATM   35  C   UNL     1      -5.538   1.124  -1.984  1.00  0.00           C  
HETATM   36  C   UNL     1      -4.930   0.068  -1.390  1.00  0.00           C  
HETATM   37  O   UNL     1      -7.345   2.493  -2.103  1.00  0.00           O  
HETATM   38  C   UNL     1      -3.564  -0.386  -1.837  1.00  0.00           C  
HETATM   39  N   UNL     1      -2.542   0.229  -0.987  1.00  0.00           N  
HETATM   40  H   UNL     1       2.878  -0.710  -2.345  1.00  0.00           H  
HETATM   41  H   UNL     1       4.420   0.032   1.588  1.00  0.00           H  
HETATM   42  H   UNL     1       5.078  -1.439  -3.097  1.00  0.00           H  
HETATM   43  H   UNL     1       7.389  -1.823  -2.524  1.00  0.00           H  
HETATM   44  H   UNL     1       9.046  -1.161   1.227  1.00  0.00           H  
HETATM   45  H   UNL     1       7.659  -0.373   2.857  1.00  0.00           H  
HETATM   46  H   UNL     1       1.280  -0.133  -1.678  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.348   0.298   0.708  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.031   2.427  -1.455  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.293   2.441  -0.200  1.00  0.00           H  
HETATM   50  H   UNL     1       2.298   2.801  -0.879  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.730   2.844   2.125  1.00  0.00           H  
HETATM   52  H   UNL     1       3.879   3.836   0.700  1.00  0.00           H  
HETATM   53  H   UNL     1       0.853   3.872   3.706  1.00  0.00           H  
HETATM   54  H   UNL     1       3.157   4.371   2.993  1.00  0.00           H  
HETATM   55  H   UNL     1      -8.555  -0.474   1.420  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.519  -2.391   2.547  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.074  -2.070   0.052  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.344   1.228  -0.289  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.043   1.648  -2.788  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.498  -1.471  -1.759  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.403  -0.086  -2.873  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.804   0.825  -0.268  1.00  0.00           H  
CONECT    1    3    2    2   15                                       
CONECT    2    1    1                                                 
CONECT    3    4    8    8    1                                       
CONECT    4    3    5    5   40                                       
CONECT    5    4    4    6   42                                       
CONECT    6    5    7    7   13                                       
CONECT    7    8    6    6    9                                       
CONECT    8    3    3    7   41                                       
CONECT    9    7   10   10   14                                       
CONECT   10   11    9    9   44                                       
CONECT   11   13   10   12   12                                       
CONECT   12   11   11                                                 
CONECT   13    6   11   43                                            
CONECT   14    9   45                                                 
CONECT   15    1   16   46                                            
CONECT   16   15   17   19   47                                       
CONECT   17   39   16   18   18                                       
CONECT   18   17   17                                                 
CONECT   19   16   20   48   49                                       
CONECT   20   19   21   22   22                                       
CONECT   21   20   23   23   50                                       
CONECT   22   20   20   24   51                                       
CONECT   23   21   21   25   52                                       
CONECT   24   25   25   22   53                                       
CONECT   25   23   24   24   54                                       
CONECT   26   27   32   32   55                                       
CONECT   27   26   28   28   56                                       
CONECT   28   27   27   29   30                                       
CONECT   29   28   31   31   57                                       
CONECT   30   28                                                      
CONECT   31   29   29   32   36                                       
CONECT   32   26   26   31   33                                       
CONECT   33   32   34   58                                            
CONECT   34   33   35   37   37                                       
CONECT   35   34   36   36   59                                       
CONECT   36   31   35   35   38                                       
CONECT   37   34   34                                                 
CONECT   38   36   39   60   61                                       
CONECT   39   38   17   62                                            
CONECT   40    4                                                      
CONECT   41    8                                                      
CONECT   42    5                                                      
CONECT   43   13                                                      
CONECT   44   10                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   19                                                      
CONECT   49   19                                                      
CONECT   50   21                                                      
CONECT   51   22                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   25                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   29                                                      
CONECT   58   33                                                      
CONECT   59   35                                                      
CONECT   60   38                                                      
CONECT   61   38                                                      
CONECT   62   39                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
