COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.135   2.591   0.690  1.00  0.00           C  
HETATM    2  C   UNL     1       4.924   3.585   1.790  1.00  0.00           C  
HETATM    3  C   UNL     1       5.219   3.739   0.282  1.00  0.00           C  
HETATM    4  C   UNL     1       1.674  -1.468   1.779  1.00  0.00           C  
HETATM    5  O   UNL     1      -2.041   0.418   0.608  1.00  0.00           O  
HETATM    6  C   UNL     1      -1.961  -0.114  -0.482  1.00  0.00           C  
HETATM    7  N   UNL     1      -0.761  -0.507  -0.953  1.00  0.00           N  
HETATM    8  C   UNL     1       0.430  -0.400  -0.106  1.00  0.00           C  
HETATM    9  C   UNL     1       1.651  -0.239  -0.974  1.00  0.00           C  
HETATM   10  N   UNL     1       2.825   0.132  -0.424  1.00  0.00           N  
HETATM   11  C   UNL     1       3.977   0.421  -1.282  1.00  0.00           C  
HETATM   12  C   UNL     1       4.709  -0.883  -1.608  1.00  0.00           C  
HETATM   13  O   UNL     1       5.897  -0.590  -2.347  1.00  0.00           O  
HETATM   14  C   UNL     1       4.928   1.372  -0.554  1.00  0.00           C  
HETATM   15  C   UNL     1       4.236   2.720  -0.339  1.00  0.00           C  
HETATM   16  N   UNL     1       3.544   3.090   1.869  1.00  0.00           N  
HETATM   17  O   UNL     1       2.041   2.111   0.481  1.00  0.00           O  
HETATM   18  O   UNL     1       1.578  -0.443  -2.168  1.00  0.00           O  
HETATM   19  C   UNL     1       0.569  -1.667   0.740  1.00  0.00           C  
HETATM   20  C   UNL     1       1.252  -0.382   2.770  1.00  0.00           C  
HETATM   21  C   UNL     1       1.911  -2.780   2.530  1.00  0.00           C  
HETATM   22  O   UNL     1      -3.070  -0.310  -1.218  1.00  0.00           O  
HETATM   23  C   UNL     1      -4.328   0.138  -0.648  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.468  -0.168  -1.622  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.773   0.298  -1.030  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.518  -0.559  -0.242  1.00  0.00           C  
HETATM   27  C   UNL     1      -8.714  -0.130   0.307  1.00  0.00           C  
HETATM   28 CL   UNL     1      -9.651  -1.205   1.297  1.00  0.00          Cl  
HETATM   29  C   UNL     1      -9.163   1.157   0.066  1.00  0.00           C  
HETATM   30  C   UNL     1      -8.416   2.013  -0.722  1.00  0.00           C  
HETATM   31  C   UNL     1      -7.222   1.583  -1.270  1.00  0.00           C  
HETATM   32  H   UNL     1       5.609   2.865   2.239  1.00  0.00           H  
HETATM   33  H   UNL     1       5.008   4.549   2.291  1.00  0.00           H  
HETATM   34  H   UNL     1       4.996   4.751  -0.057  1.00  0.00           H  
HETATM   35  H   UNL     1       6.252   3.473   0.058  1.00  0.00           H  
HETATM   36  H   UNL     1       2.593  -1.165   1.278  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.685  -0.860  -1.854  1.00  0.00           H  
HETATM   38  H   UNL     1       0.333   0.465   0.549  1.00  0.00           H  
HETATM   39  H   UNL     1       2.906   0.207   0.539  1.00  0.00           H  
HETATM   40  H   UNL     1       3.634   0.886  -2.206  1.00  0.00           H  
HETATM   41  H   UNL     1       4.060  -1.525  -2.204  1.00  0.00           H  
HETATM   42  H   UNL     1       6.522  -0.021  -1.877  1.00  0.00           H  
HETATM   43  H   UNL     1       5.201   0.945   0.411  1.00  0.00           H  
HETATM   44  H   UNL     1       5.827   1.517  -1.155  1.00  0.00           H  
HETATM   45  H   UNL     1       3.836   3.097  -1.280  1.00  0.00           H  
HETATM   46  H   UNL     1       2.997   3.120   2.670  1.00  0.00           H  
HETATM   47  H   UNL     1       0.824  -2.508   0.095  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.374  -1.871   1.247  1.00  0.00           H  
HETATM   49  H   UNL     1       2.038  -0.241   3.512  1.00  0.00           H  
HETATM   50  H   UNL     1       1.085   0.553   2.236  1.00  0.00           H  
HETATM   51  H   UNL     1       0.331  -0.684   3.270  1.00  0.00           H  
HETATM   52  H   UNL     1       2.211  -3.554   1.823  1.00  0.00           H  
HETATM   53  H   UNL     1       2.698  -2.638   3.270  1.00  0.00           H  
HETATM   54  H   UNL     1       0.991  -3.083   3.031  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.506  -0.382   0.294  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.283   1.212  -0.467  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.290   0.352  -2.563  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.513  -1.242  -1.803  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.168  -1.563  -0.055  1.00  0.00           H  
HETATM   60  H   UNL     1     -10.096   1.492   0.493  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.766   3.017  -0.910  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.637   2.254  -1.882  1.00  0.00           H  
HETATM   63  S   UNL     1       5.150  -1.731  -0.067  1.00  0.00           S  
HETATM   64  O   UNL     1       5.974  -2.930  -0.515  1.00  0.00           O  
HETATM   65  O   UNL     1       6.058  -0.945   0.693  1.00  0.00           O  
HETATM   66  O   UNL     1       3.997  -2.303   0.535  1.00  0.00           O  
HETATM   67  H   UNL     1       6.285  -3.487   0.212  1.00  0.00           H  
CONECT    1   15   17   17   16                                       
CONECT    2    3   16   32   33                                       
CONECT    3   15    2   34   35                                       
CONECT    4   20   21   19   36                                       
CONECT    5    6    6                                                 
CONECT    6    7   22    5    5                                       
CONECT    7    8    6   37                                            
CONECT    8   19    7    9   38                                       
CONECT    9    8   18   18   10                                       
CONECT   10    9   11   39                                            
CONECT   11   10   12   14   40                                       
CONECT   12   11   13   41   63                                       
CONECT   13   12   42                                                 
CONECT   14   11   15   43   44                                       
CONECT   15   14    3    1   45                                       
CONECT   16    2    1   46                                            
CONECT   17    1    1                                                 
CONECT   18    9    9                                                 
CONECT   19    4    8   47   48                                       
CONECT   20    4   49   50   51                                       
CONECT   21    4   52   53   54                                       
CONECT   22    6   23                                                 
CONECT   23   22   24   55   56                                       
CONECT   24   25   23   57   58                                       
CONECT   25   26   26   31   24                                       
CONECT   26   27   25   25   59                                       
CONECT   27   28   29   29   26                                       
CONECT   28   27                                                      
CONECT   29   27   27   30   60                                       
CONECT   30   29   31   31   61                                       
CONECT   31   30   30   25   62                                       
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   21                                                      
CONECT   54   21                                                      
CONECT   55   23                                                      
CONECT   56   23                                                      
CONECT   57   24                                                      
CONECT   58   24                                                      
CONECT   59   26                                                      
CONECT   60   29                                                      
CONECT   61   30                                                      
CONECT   62   31                                                      
CONECT   63   12   64   65   65                                       
CONECT   63   66   66                                                 
CONECT   64   63   67                                                 
CONECT   65   63   63                                                 
CONECT   66   63   63                                                 
CONECT   67   64                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
