COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1     -11.691   0.576   0.726  1.00  0.00           C  
HETATM    2  C   UNL     1     -10.913   1.188  -0.241  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.746  -0.341   1.553  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.557  -0.371   0.420  1.00  0.00           C  
HETATM    5  C   UNL     1      -8.999  -0.041   0.527  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.399  -1.324   0.113  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.865  -0.988   0.221  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.405  -0.649   1.448  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.200  -0.388  -0.275  1.00  0.00           C  
HETATM   10  C   UNL     1       7.186   1.305  -0.929  1.00  0.00           C  
HETATM   11  C   UNL     1      10.083  -2.294  -0.495  1.00  0.00           C  
HETATM   12  C   UNL     1       6.518   0.776   0.167  1.00  0.00           C  
HETATM   13  C   UNL     1       1.802   1.879  -1.087  1.00  0.00           C  
HETATM   14  O   UNL     1       5.187   2.946   0.402  1.00  0.00           O  
HETATM   15  S   UNL     1       5.089   1.586   0.803  1.00  0.00           S  
HETATM   16  C   UNL     1       6.972  -0.382   0.758  1.00  0.00           C  
HETATM   17  C   UNL     1       8.103  -1.023   0.255  1.00  0.00           C  
HETATM   18  S   UNL     1       8.939  -2.489   0.756  1.00  0.00           S  
HETATM   19  N   UNL     1       9.844  -1.247  -1.191  1.00  0.00           N  
HETATM   20  C   UNL     1       8.780  -0.494  -0.849  1.00  0.00           C  
HETATM   21  C   UNL     1       8.289   0.690  -1.436  1.00  0.00           C  
HETATM   22  N   UNL     1       3.777   0.958   0.011  1.00  0.00           N  
HETATM   23  C   UNL     1       3.294   1.566  -1.236  1.00  0.00           C  
HETATM   24  C   UNL     1       1.056   0.607  -0.678  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.440   0.908  -0.561  1.00  0.00           C  
HETATM   26  N   UNL     1      -2.636  -0.099  -0.163  1.00  0.00           N  
HETATM   27  C   UNL     1      -9.571   0.884  -0.344  1.00  0.00           C  
HETATM   28  C   UNL     1     -11.129  -0.343   1.594  1.00  0.00           C  
HETATM   29  C   UNL     1      -9.787  -0.654   1.499  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.007  -0.713  -0.815  1.00  0.00           C  
HETATM   31 CL   UNL     1      -8.009  -0.753  -2.232  1.00  0.00          Cl  
HETATM   32  C   UNL     1      -5.663  -1.020  -0.908  1.00  0.00           C  
HETATM   33  C   UNL     1       1.584   0.116   0.672  1.00  0.00           C  
HETATM   34  C   UNL     1       3.074  -0.217   0.543  1.00  0.00           C  
HETATM   35  O   UNL     1       4.969   1.183   2.160  1.00  0.00           O  
HETATM   36  H   UNL     1     -12.740   0.819   0.806  1.00  0.00           H  
HETATM   37  H   UNL     1     -11.358   1.904  -0.915  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.166  -0.072   2.511  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.057  -1.762   1.050  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.248  -2.036  -0.698  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.777  -0.626   2.326  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.034  -1.095  -1.088  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.842  -0.820   0.660  1.00  0.00           H  
HETATM   44  H   UNL     1       6.823   2.213  -1.387  1.00  0.00           H  
HETATM   45  H   UNL     1      10.906  -2.969  -0.677  1.00  0.00           H  
HETATM   46  H   UNL     1       1.665   2.643  -0.322  1.00  0.00           H  
HETATM   47  H   UNL     1       1.409   2.241  -2.037  1.00  0.00           H  
HETATM   48  H   UNL     1       6.453  -0.793   1.611  1.00  0.00           H  
HETATM   49  H   UNL     1       8.793   1.112  -2.293  1.00  0.00           H  
HETATM   50  H   UNL     1       3.440   0.870  -2.062  1.00  0.00           H  
HETATM   51  H   UNL     1       3.843   2.487  -1.431  1.00  0.00           H  
HETATM   52  H   UNL     1       1.213  -0.165  -1.431  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.797   1.340  -1.496  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.606   1.614   0.252  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.810   0.602   0.542  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.965   1.362  -1.100  1.00  0.00           H  
HETATM   57  H   UNL     1     -11.740  -0.818   2.346  1.00  0.00           H  
HETATM   58  H   UNL     1      -9.349  -1.371   2.178  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.235  -1.285  -1.864  1.00  0.00           H  
HETATM   60  H   UNL     1       1.449   0.897   1.421  1.00  0.00           H  
HETATM   61  H   UNL     1       1.036  -0.777   0.974  1.00  0.00           H  
HETATM   62  H   UNL     1       3.202  -1.059  -0.138  1.00  0.00           H  
HETATM   63  H   UNL     1       3.477  -0.472   1.523  1.00  0.00           H  
CONECT    1   28   28    2   36                                       
CONECT    2    1   27   27   37                                       
CONECT    3    8    8    4   38                                       
CONECT    4    3    5   30   30                                       
CONECT    5   29   29   27    4                                       
CONECT    6   26    7   39   40                                       
CONECT    7    8    6   32   32                                       
CONECT    8    3    3    7   41                                       
CONECT    9   25   26   42   43                                       
CONECT   10   21   21   12   44                                       
CONECT   11   18   19   19   45                                       
CONECT   12   16   16   10   15                                       
CONECT   13   23   24   46   47                                       
CONECT   14   15   15                                                 
CONECT   15   12   35   35   22                                       
CONECT   15   14   14                                                 
CONECT   16   17   12   12   48                                       
CONECT   17   18   20   20   16                                       
CONECT   18   11   17                                                 
CONECT   19   11   11   20                                            
CONECT   20   19   17   17   21                                       
CONECT   21   20   10   10   49                                       
CONECT   22   15   23   34                                            
CONECT   23   13   22   50   51                                       
CONECT   24   13   25   33   52                                       
CONECT   25   24    9   53   54                                       
CONECT   26    9    6   55                                            
CONECT   27    2    2    5   56                                       
CONECT   28    1    1   29   57                                       
CONECT   29   28    5    5   58                                       
CONECT   30    4    4   32   31                                       
CONECT   31   30                                                      
CONECT   32    7    7   30   59                                       
CONECT   33   24   34   60   61                                       
CONECT   34   22   33   62   63                                       
CONECT   35   15   15                                                 
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    3                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   13                                                      
CONECT   47   13                                                      
CONECT   48   16                                                      
CONECT   49   21                                                      
CONECT   50   23                                                      
CONECT   51   23                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   25                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   28                                                      
CONECT   58   29                                                      
CONECT   59   32                                                      
CONECT   60   33                                                      
CONECT   61   33                                                      
CONECT   62   34                                                      
CONECT   63   34                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
