COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.847   2.293   0.765  1.00  0.00           C  
HETATM    2  C   UNL     1       0.518   1.998   0.929  1.00  0.00           C  
HETATM    3  C   UNL     1       3.143   1.479   1.256  1.00  0.00           C  
HETATM    4  C   UNL     1       4.573   0.947   1.375  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.221   1.197  -0.074  1.00  0.00           C  
HETATM    6  C   UNL     1       5.185   1.684  -0.849  1.00  0.00           C  
HETATM    7  C   UNL     1       5.608   1.199  -2.238  1.00  0.00           C  
HETATM    8  C   UNL     1       6.746  -0.686  -1.233  1.00  0.00           C  
HETATM    9  C   UNL     1       6.323  -0.201   0.157  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.462   1.722   0.302  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.616   1.055  -0.079  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.396  -0.589  -1.160  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.202   0.011  -0.824  1.00  0.00           C  
HETATM   14  C   UNL     1       7.962   1.358  -1.692  1.00  0.00           C  
HETATM   15  N   UNL     1      -1.713   1.303   0.382  1.00  0.00           N  
HETATM   16  C   UNL     1       0.959   0.723   0.704  1.00  0.00           C  
HETATM   17  C   UNL     1       0.041  -0.271   0.311  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.264   0.034   0.160  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.966   1.875   0.302  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.820   3.191   0.638  1.00  0.00           C  
HETATM   21  N   UNL     1      -1.538   3.419   0.908  1.00  0.00           N  
HETATM   22  O   UNL     1       2.273   0.418   0.856  1.00  0.00           O  
HETATM   23  N   UNL     1       5.052   0.530   0.051  1.00  0.00           N  
HETATM   24  N   UNL     1       6.879   0.469  -2.132  1.00  0.00           N  
HETATM   25  N   UNL     1      -6.550  -0.064  -0.787  1.00  0.00           N  
HETATM   26 CL   UNL     1      -5.384  -2.057  -2.087  1.00  0.00          Cl  
HETATM   27  N   UNL     1      -7.857   1.564   0.287  1.00  0.00           N  
HETATM   28  S   UNL     1       0.599  -1.916   0.017  1.00  0.00           S  
HETATM   29  O   UNL     1      -0.477  -2.532  -0.678  1.00  0.00           O  
HETATM   30  O   UNL     1       1.869  -1.750  -0.599  1.00  0.00           O  
HETATM   31  C   UNL     1       0.782  -2.634   1.672  1.00  0.00           C  
HETATM   32  C   UNL     1       1.367  -4.043   1.555  1.00  0.00           C  
HETATM   33  C   UNL     1       1.722  -1.761   2.506  1.00  0.00           C  
HETATM   34  C   UNL     1      -0.586  -2.705   2.352  1.00  0.00           C  
HETATM   35  H   UNL     1       1.210   2.770   1.231  1.00  0.00           H  
HETATM   36  H   UNL     1       2.819   1.870   2.220  1.00  0.00           H  
HETATM   37  H   UNL     1       3.112   2.274   0.512  1.00  0.00           H  
HETATM   38  H   UNL     1       5.221   1.732   1.765  1.00  0.00           H  
HETATM   39  H   UNL     1       4.588   0.094   2.053  1.00  0.00           H  
HETATM   40  H   UNL     1       5.939   2.366  -0.457  1.00  0.00           H  
HETATM   41  H   UNL     1       4.228   2.201  -0.921  1.00  0.00           H  
HETATM   42  H   UNL     1       4.841   0.538  -2.642  1.00  0.00           H  
HETATM   43  H   UNL     1       5.735   2.056  -2.899  1.00  0.00           H  
HETATM   44  H   UNL     1       7.703  -1.203  -1.161  1.00  0.00           H  
HETATM   45  H   UNL     1       5.993  -1.368  -1.625  1.00  0.00           H  
HETATM   46  H   UNL     1       6.195  -1.058   0.818  1.00  0.00           H  
HETATM   47  H   UNL     1       7.089   0.460   0.561  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.520   2.633   0.879  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.264  -0.425  -1.133  1.00  0.00           H  
HETATM   50  H   UNL     1       8.904   0.808  -1.687  1.00  0.00           H  
HETATM   51  H   UNL     1       8.039   2.203  -2.375  1.00  0.00           H  
HETATM   52  H   UNL     1       7.748   1.721  -0.687  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.961  -0.734  -0.141  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.613   3.924   0.675  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.912   2.382   0.806  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.668   1.102   0.024  1.00  0.00           H  
HETATM   57  H   UNL     1       2.342  -3.993   1.070  1.00  0.00           H  
HETATM   58  H   UNL     1       1.477  -4.475   2.549  1.00  0.00           H  
HETATM   59  H   UNL     1       0.698  -4.666   0.961  1.00  0.00           H  
HETATM   60  H   UNL     1       1.305  -0.757   2.590  1.00  0.00           H  
HETATM   61  H   UNL     1       1.832  -2.193   3.501  1.00  0.00           H  
HETATM   62  H   UNL     1       2.697  -1.711   2.022  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.281  -3.252   1.715  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.491  -3.217   3.309  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.963  -1.695   2.516  1.00  0.00           H  
CONECT    1    2   21   21   15                                       
CONECT    2   16   16    1   35                                       
CONECT    3    4   22   36   37                                       
CONECT    4    3   23   38   39                                       
CONECT    5   19   13   13   10                                       
CONECT    6    7   23   40   41                                       
CONECT    7   24    6   42   43                                       
CONECT    8   24    9   44   45                                       
CONECT    9    8   23   46   47                                       
CONECT   10    5   11   11   48                                       
CONECT   11   10   10   25   27                                       
CONECT   12   13   26   25   25                                       
CONECT   13    5    5   12   49                                       
CONECT   14   24   50   51   52                                       
CONECT   15    1   18   19                                            
CONECT   16   22    2    2   17                                       
CONECT   17   16   28   18   18                                       
CONECT   18   17   17   15   53                                       
CONECT   19   20   20   15    5                                       
CONECT   20   21   19   19   54                                       
CONECT   21    1    1   20                                            
CONECT   22    3   16                                                 
CONECT   23    4    9    6                                            
CONECT   24   14    8    7                                            
CONECT   25   12   12   11                                            
CONECT   26   12                                                      
CONECT   27   11   55   56                                            
CONECT   28   30   30   17   29                                       
CONECT   28   29   31                                                 
CONECT   29   28   28                                                 
CONECT   30   28   28                                                 
CONECT   31   28   34   32   33                                       
CONECT   32   31   57   58   59                                       
CONECT   33   31   60   61   62                                       
CONECT   34   31   63   64   65                                       
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    6                                                      
CONECT   41    6                                                      
CONECT   42    7                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47    9                                                      
CONECT   48   10                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   14                                                      
CONECT   52   14                                                      
CONECT   53   18                                                      
CONECT   54   20                                                      
CONECT   55   27                                                      
CONECT   56   27                                                      
CONECT   57   32                                                      
CONECT   58   32                                                      
CONECT   59   32                                                      
CONECT   60   33                                                      
CONECT   61   33                                                      
CONECT   62   33                                                      
CONECT   63   34                                                      
CONECT   64   34                                                      
CONECT   65   34                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
