COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.197   0.310  -0.428  1.00  0.00           C  
HETATM    2  C   UNL     1       5.202   1.113   0.897  1.00  0.00           C  
HETATM    3  C   UNL     1       4.838   1.257  -0.439  1.00  0.00           C  
HETATM    4  C   UNL     1       3.479   1.350  -0.788  1.00  0.00           C  
HETATM    5  C   UNL     1       0.570  -1.126  -0.451  1.00  0.00           C  
HETATM    6  C   UNL     1       3.422   1.488  -2.193  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.984   2.726  -1.904  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.784   1.933  -0.871  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.237   2.874   0.202  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.287   1.703  -1.035  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.637   0.415  -0.746  1.00  0.00           C  
HETATM   12  C   UNL     1       1.844  -1.509  -0.887  1.00  0.00           C  
HETATM   13  C   UNL     1       2.204  -2.824  -0.915  1.00  0.00           C  
HETATM   14  C   UNL     1       1.302  -3.805  -0.507  1.00  0.00           C  
HETATM   15  C   UNL     1       0.017  -3.433  -0.066  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.343  -2.083  -0.035  1.00  0.00           C  
HETATM   17  C   UNL     1       4.640   0.901   3.318  1.00  0.00           C  
HETATM   18  N   UNL     1      -0.995   0.804  -0.682  1.00  0.00           N  
HETATM   19  N   UNL     1      -0.934   2.197  -0.550  1.00  0.00           N  
HETATM   20  C   UNL     1       0.326   2.539  -0.209  1.00  0.00           C  
HETATM   21  C   UNL     1       1.061   1.393  -0.123  1.00  0.00           C  
HETATM   22  C   UNL     1       0.831   3.937   0.034  1.00  0.00           C  
HETATM   23  C   UNL     1       2.497   1.297   0.224  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.049   3.125  -0.748  1.00  0.00           C  
HETATM   25  C   UNL     1       2.889   1.153   1.548  1.00  0.00           C  
HETATM   26  C   UNL     1       4.234   1.057   1.875  1.00  0.00           C  
HETATM   27 CL   UNL     1       1.689   1.086   2.800  1.00  0.00          Cl  
HETATM   28  N   UNL     1       5.549   1.338  -1.610  1.00  0.00           N  
HETATM   29  N   UNL     1       4.636   1.479  -2.663  1.00  0.00           N  
HETATM   30  N   UNL     1      -5.057   0.422  -0.335  1.00  0.00           N  
HETATM   31  N   UNL     1       1.367  -5.172  -0.424  1.00  0.00           N  
HETATM   32  N   UNL     1       0.149  -5.659   0.061  1.00  0.00           N  
HETATM   33  C   UNL     1      -0.671  -4.673   0.283  1.00  0.00           C  
HETATM   34  C   UNL     1       2.527  -5.992  -0.784  1.00  0.00           C  
HETATM   35  C   UNL     1      -5.832  -0.408   0.390  1.00  0.00           C  
HETATM   36  O   UNL     1      -5.360  -1.421   0.861  1.00  0.00           O  
HETATM   37  C   UNL     1      -7.285  -0.077   0.617  1.00  0.00           C  
HETATM   38  C   UNL     1      -7.931  -1.174   1.465  1.00  0.00           C  
HETATM   39  H   UNL     1       6.245   1.041   1.167  1.00  0.00           H  
HETATM   40  H   UNL     1       2.520   1.583  -2.780  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.505   2.102  -2.659  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.533   3.564  -2.333  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.859   3.754   0.368  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.959   2.369   1.127  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.904   2.406  -0.476  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.604   1.590  -2.072  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.456  -0.089  -1.696  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.952   0.102   0.041  1.00  0.00           H  
HETATM   49  H   UNL     1       2.549  -0.755  -1.204  1.00  0.00           H  
HETATM   50  H   UNL     1       3.190  -3.105  -1.253  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.326  -1.789   0.302  1.00  0.00           H  
HETATM   52  H   UNL     1       4.689  -0.158   3.570  1.00  0.00           H  
HETATM   53  H   UNL     1       5.619   1.356   3.471  1.00  0.00           H  
HETATM   54  H   UNL     1       3.907   1.393   3.957  1.00  0.00           H  
HETATM   55  H   UNL     1       0.707   4.191   1.087  1.00  0.00           H  
HETATM   56  H   UNL     1       1.887   3.993  -0.231  1.00  0.00           H  
HETATM   57  H   UNL     1       0.266   4.640  -0.578  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.731   4.168  -0.781  1.00  0.00           H  
HETATM   59  H   UNL     1       6.514   1.304  -1.695  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.681  -4.756   0.659  1.00  0.00           H  
HETATM   61  H   UNL     1       2.461  -6.270  -1.836  1.00  0.00           H  
HETATM   62  H   UNL     1       3.441  -5.422  -0.615  1.00  0.00           H  
HETATM   63  H   UNL     1       2.541  -6.892  -0.170  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.363   0.878   1.137  1.00  0.00           H  
HETATM   65  H   UNL     1      -7.796  -0.011  -0.343  1.00  0.00           H  
HETATM   66  H   UNL     1      -7.853  -2.129   0.945  1.00  0.00           H  
HETATM   67  H   UNL     1      -7.420  -1.240   2.425  1.00  0.00           H  
HETATM   68  H   UNL     1      -8.982  -0.935   1.628  1.00  0.00           H  
CONECT    1    5   18   18   21                                       
CONECT    2    3    3   26   39                                       
CONECT    3    4   28    2    2                                       
CONECT    4    6   23   23    3                                       
CONECT    5   12   12   16    1                                       
CONECT    6    4   29   29   40                                       
CONECT    7   24    8   41   42                                       
CONECT    8    9   11    7   10                                       
CONECT    9   24    8   43   44                                       
CONECT   10    8   30   45   46                                       
CONECT   11    8   30   47   48                                       
CONECT   12   13    5    5   49                                       
CONECT   13   14   14   12   50                                       
CONECT   14   31   13   13   15                                       
CONECT   15   14   33   16   16                                       
CONECT   16   15   15    5   51                                       
CONECT   17   26   52   53   54                                       
CONECT   18    1    1   19                                            
CONECT   19   18   24   20                                            
CONECT   20   21   21   19   22                                       
CONECT   21    1   23   20   20                                       
CONECT   22   20   55   56   57                                       
CONECT   23   21    4    4   25                                       
CONECT   24    9   19    7   58                                       
CONECT   25   23   27   26   26                                       
CONECT   26   25   25    2   17                                       
CONECT   27   25                                                      
CONECT   28   29    3   59                                            
CONECT   29    6    6   28                                            
CONECT   30   11   10   35                                            
CONECT   31   34   32   14                                            
CONECT   32   31   33   33                                            
CONECT   33   32   32   15   60                                       
CONECT   34   31   61   62   63                                       
CONECT   35   30   37   36   36                                       
CONECT   36   35   35                                                 
CONECT   37   38   35   64   65                                       
CONECT   38   37   66   67   68                                       
CONECT   39    2                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    7                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   10                                                      
CONECT   47   11                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   16                                                      
CONECT   52   17                                                      
CONECT   53   17                                                      
CONECT   54   17                                                      
CONECT   55   22                                                      
CONECT   56   22                                                      
CONECT   57   22                                                      
CONECT   58   24                                                      
CONECT   59   28                                                      
CONECT   60   33                                                      
CONECT   61   34                                                      
CONECT   62   34                                                      
CONECT   63   34                                                      
CONECT   64   37                                                      
CONECT   65   37                                                      
CONECT   66   38                                                      
CONECT   67   38                                                      
CONECT   68   38                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
