COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.922  -1.089   0.211  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.019   0.126   0.596  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.128   1.544   1.161  1.00  0.00           C  
HETATM    4  C   UNL     1       0.885   1.721   2.293  1.00  0.00           C  
HETATM    5  C   UNL     1       0.863   3.173   2.774  1.00  0.00           C  
HETATM    6  C   UNL     1       0.519   0.794   3.454  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.097  -0.089  -0.434  1.00  0.00           C  
HETATM    8  C   UNL     1       6.750   0.004   0.035  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.443  -0.186  -1.088  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.717   1.129  -1.821  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.722  -0.661  -0.396  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.485  -2.041   0.222  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.224  -3.091  -0.882  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.929  -4.338  -0.305  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.736  -2.531   0.916  1.00  0.00           C  
HETATM   16  C   UNL     1       7.909  -0.120  -0.710  1.00  0.00           C  
HETATM   17  C   UNL     1       8.239  -1.337  -1.279  1.00  0.00           C  
HETATM   18  C   UNL     1       7.410  -2.429  -1.102  1.00  0.00           C  
HETATM   19  C   UNL     1       6.255  -2.307  -0.353  1.00  0.00           C  
HETATM   20  C   UNL     1       4.659  -0.955   1.022  1.00  0.00           C  
HETATM   21  C   UNL     1       2.355  -0.408   0.725  1.00  0.00           C  
HETATM   22 CL   UNL     1       8.948   1.253  -0.932  1.00  0.00          Cl  
HETATM   23  N   UNL     1       1.295  -0.052  -0.027  1.00  0.00           N  
HETATM   24  N   UNL     1      -2.394   0.023  -0.086  1.00  0.00           N  
HETATM   25  N   UNL     1      -5.965  -3.819   0.597  1.00  0.00           N  
HETATM   26  O   UNL     1       2.221  -0.582   1.920  1.00  0.00           O  
HETATM   27  O   UNL     1      -0.798  -0.364  -1.577  1.00  0.00           O  
HETATM   28  O   UNL     1      -4.818   0.955  -2.715  1.00  0.00           O  
HETATM   29  O   UNL     1      -6.431  -1.862   1.651  1.00  0.00           O  
HETATM   30  O   UNL     1       3.563  -0.571   0.151  1.00  0.00           O  
HETATM   31  H   UNL     1      -0.138  -0.597   1.403  1.00  0.00           H  
HETATM   32  H   UNL     1       0.079   2.266   0.371  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.135   1.705   1.545  1.00  0.00           H  
HETATM   34  H   UNL     1       1.882   1.474   1.931  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.135   3.421   3.137  1.00  0.00           H  
HETATM   36  H   UNL     1       1.584   3.300   3.581  1.00  0.00           H  
HETATM   37  H   UNL     1       1.123   3.834   1.947  1.00  0.00           H  
HETATM   38  H   UNL     1       0.535  -0.241   3.112  1.00  0.00           H  
HETATM   39  H   UNL     1       1.241   0.920   4.261  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.479   1.041   3.817  1.00  0.00           H  
HETATM   41  H   UNL     1       6.491   0.954   0.479  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.115  -0.940  -1.804  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.832   1.421  -2.386  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.995   0.046   0.387  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.528  -0.724  -1.127  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.649  -2.006   0.921  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.679  -2.787  -1.825  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.155  -3.269  -1.007  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.383  -4.920  -1.106  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.218  -4.951   0.249  1.00  0.00           H  
HETATM   51  H   UNL     1       9.141  -1.433  -1.865  1.00  0.00           H  
HETATM   52  H   UNL     1       7.668  -3.379  -1.546  1.00  0.00           H  
HETATM   53  H   UNL     1       5.608  -3.160  -0.215  1.00  0.00           H  
HETATM   54  H   UNL     1       4.429  -1.909   1.497  1.00  0.00           H  
HETATM   55  H   UNL     1       4.799  -0.192   1.788  1.00  0.00           H  
HETATM   56  H   UNL     1       1.402   0.088  -0.981  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.634   0.243   0.828  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.716  -4.339   0.923  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.641   0.693  -2.280  1.00  0.00           H  
HETATM   60  S   UNL     1      -4.118   2.422  -0.613  1.00  0.00           S  
HETATM   61  O   UNL     1      -5.314   2.099   0.084  1.00  0.00           O  
HETATM   62  O   UNL     1      -2.951   2.831   0.086  1.00  0.00           O  
HETATM   63  O   UNL     1      -4.491   3.630  -1.460  1.00  0.00           O  
HETATM   64  H   UNL     1      -4.734   4.412  -0.945  1.00  0.00           H  
CONECT    1   19   19    8   20                                       
CONECT    2    7   23    3   31                                       
CONECT    3    2    4   32   33                                       
CONECT    4    3    6    5   34                                       
CONECT    5    4   35   36   37                                       
CONECT    6    4   38   39   40                                       
CONECT    7   24   27   27    2                                       
CONECT    8   16   16    1   41                                       
CONECT    9   11   10   24   42                                       
CONECT   10   28    9   43   60                                       
CONECT   11   12    9   44   45                                       
CONECT   12   15   13   11   46                                       
CONECT   13   14   12   47   48                                       
CONECT   14   25   13   49   50                                       
CONECT   15   25   29   29   12                                       
CONECT   16   17   22    8    8                                       
CONECT   17   18   18   16   51                                       
CONECT   18   17   17   19   52                                       
CONECT   19   18    1    1   53                                       
CONECT   20    1   30   54   55                                       
CONECT   21   26   26   30   23                                       
CONECT   22   16                                                      
CONECT   23   21    2   56                                            
CONECT   24    9    7   57                                            
CONECT   25   15   14   58                                            
CONECT   26   21   21                                                 
CONECT   27    7    7                                                 
CONECT   28   10   59                                                 
CONECT   29   15   15                                                 
CONECT   30   20   21                                                 
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   14                                                      
CONECT   51   17                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   20                                                      
CONECT   55   20                                                      
CONECT   56   23                                                      
CONECT   57   24                                                      
CONECT   58   25                                                      
CONECT   59   28                                                      
CONECT   60   10   61   61   62                                       
CONECT   60   62   63                                                 
CONECT   61   60   60                                                 
CONECT   62   60   60                                                 
CONECT   63   60   64                                                 
CONECT   64   63                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
