COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       2.627  -4.545   0.731  1.00  0.00           O  
HETATM    2  C   UNL     1      -2.705  -4.842   0.122  1.00  0.00           C  
HETATM    3  O   UNL     1       7.948   2.644  -1.280  1.00  0.00           O  
HETATM    4  C   UNL     1      -3.968  -3.980   0.222  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.827   2.355   0.058  1.00  0.00           C  
HETATM    6  N   UNL     1       2.968  -2.383   0.350  1.00  0.00           N  
HETATM    7  C   UNL     1      -2.952  -1.928  -0.483  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.802  -1.006  -1.693  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.127  -0.285  -1.949  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.696   1.305  -1.016  1.00  0.00           C  
HETATM   11  O   UNL     1       7.635   3.122   1.127  1.00  0.00           O  
HETATM   12  S   UNL     1       7.099   2.825  -0.155  1.00  0.00           S  
HETATM   13  C   UNL     1       5.743   3.962  -0.557  1.00  0.00           C  
HETATM   14  C   UNL     1       6.314   1.262   0.054  1.00  0.00           C  
HETATM   15  C   UNL     1       6.157   0.417  -1.029  1.00  0.00           C  
HETATM   16  C   UNL     1       5.542  -0.810  -0.866  1.00  0.00           C  
HETATM   17  C   UNL     1       5.860   0.877   1.302  1.00  0.00           C  
HETATM   18  C   UNL     1       5.244  -0.350   1.465  1.00  0.00           C  
HETATM   19  C   UNL     1       5.082  -1.192   0.381  1.00  0.00           C  
HETATM   20  C   UNL     1       4.410  -2.529   0.559  1.00  0.00           C  
HETATM   21  C   UNL     1       2.159  -3.455   0.459  1.00  0.00           C  
HETATM   22  C   UNL     1       0.715  -3.309   0.249  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.201  -4.314   0.332  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.498  -3.912   0.091  1.00  0.00           C  
HETATM   25  O   UNL     1      -3.917  -2.944  -0.763  1.00  0.00           O  
HETATM   26  S   UNL     1      -0.109  -1.809  -0.148  1.00  0.00           S  
HETATM   27  C   UNL     1      -1.624  -2.591  -0.185  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.397  -1.111   0.731  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.706  -0.388   0.403  1.00  0.00           C  
HETATM   30  N   UNL     1      -4.503   0.488  -0.758  1.00  0.00           N  
HETATM   31  C   UNL     1      -6.782   2.217   1.047  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.903   3.180   2.032  1.00  0.00           C  
HETATM   33  C   UNL     1      -6.068   4.282   2.027  1.00  0.00           C  
HETATM   34  C   UNL     1      -5.113   4.421   1.038  1.00  0.00           C  
HETATM   35  C   UNL     1      -4.987   3.455   0.056  1.00  0.00           C  
HETATM   36 CL   UNL     1      -3.787   3.629  -1.186  1.00  0.00          Cl  
HETATM   37  H   UNL     1      -2.639  -5.501   0.988  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.736  -5.436  -0.791  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.846  -4.602   0.050  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.026  -3.536   1.215  1.00  0.00           H  
HETATM   41  H   UNL     1       2.595  -1.514   0.132  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.020  -0.272  -1.496  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.534  -1.597  -2.569  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.016   0.388  -2.799  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.904  -1.018  -2.165  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.580   0.669  -1.011  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.602   1.789  -1.988  1.00  0.00           H  
HETATM   48  H   UNL     1       6.142   4.965  -0.705  1.00  0.00           H  
HETATM   49  H   UNL     1       5.249   3.629  -1.470  1.00  0.00           H  
HETATM   50  H   UNL     1       5.024   3.974   0.262  1.00  0.00           H  
HETATM   51  H   UNL     1       6.515   0.715  -2.003  1.00  0.00           H  
HETATM   52  H   UNL     1       5.419  -1.470  -1.712  1.00  0.00           H  
HETATM   53  H   UNL     1       5.987   1.535   2.149  1.00  0.00           H  
HETATM   54  H   UNL     1       4.889  -0.650   2.440  1.00  0.00           H  
HETATM   55  H   UNL     1       4.595  -2.897   1.569  1.00  0.00           H  
HETATM   56  H   UNL     1       4.813  -3.237  -0.165  1.00  0.00           H  
HETATM   57  H   UNL     1       0.065  -5.334   0.565  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.552  -1.777   1.580  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.628  -0.379   0.978  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.478  -1.122   0.174  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.015   0.210   1.260  1.00  0.00           H  
HETATM   62  H   UNL     1      -7.435   1.356   1.050  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.649   3.071   2.804  1.00  0.00           H  
HETATM   64  H   UNL     1      -6.163   5.034   2.796  1.00  0.00           H  
HETATM   65  H   UNL     1      -4.461   5.283   1.034  1.00  0.00           H  
CONECT    1   21   21                                                 
CONECT    2   24    4   37   38                                       
CONECT    3   12   12                                                 
CONECT    4    2   25   39   40                                       
CONECT    5   35   10   31   31                                       
CONECT    6   20   21   41                                            
CONECT    7   27    8   28   25                                       
CONECT    8    7    9   42   43                                       
CONECT    9    8   30   44   45                                       
CONECT   10   30    5   46   47                                       
CONECT   11   12   12                                                 
CONECT   12   11   11   13   14                                       
CONECT   12    3    3                                                 
CONECT   13   12   48   49   50                                       
CONECT   14   17   12   15   15                                       
CONECT   15   14   14   16   51                                       
CONECT   16   19   19   15   52                                       
CONECT   17   18   18   14   53                                       
CONECT   18   17   17   19   54                                       
CONECT   19   18   20   16   16                                       
CONECT   20   19    6   55   56                                       
CONECT   21    1    1    6   22                                       
CONECT   22   21   26   23   23                                       
CONECT   23   22   22   24   57                                       
CONECT   24   23   27   27    2                                       
CONECT   25    7    4                                                 
CONECT   26   22   27                                                 
CONECT   27   26   24   24    7                                       
CONECT   28    7   29   58   59                                       
CONECT   29   28   30   60   61                                       
CONECT   30    9   10   29                                            
CONECT   31    5    5   32   62                                       
CONECT   32   33   33   31   63                                       
CONECT   33   34   32   32   64                                       
CONECT   34   35   35   33   65                                       
CONECT   35   36   34   34    5                                       
CONECT   36   35                                                      
CONECT   37    2                                                      
CONECT   38    2                                                      
CONECT   39    4                                                      
CONECT   40    4                                                      
CONECT   41    6                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45    9                                                      
CONECT   46   10                                                      
CONECT   47   10                                                      
CONECT   48   13                                                      
CONECT   49   13                                                      
CONECT   50   13                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   17                                                      
CONECT   54   18                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   23                                                      
CONECT   58   28                                                      
CONECT   59   28                                                      
CONECT   60   29                                                      
CONECT   61   29                                                      
CONECT   62   31                                                      
CONECT   63   32                                                      
CONECT   64   33                                                      
CONECT   65   34                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
