COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.746  -5.175   0.287  1.00  0.00           C  
HETATM    2  C   UNL     1       5.083  -4.627  -0.937  1.00  0.00           C  
HETATM    3  C   UNL     1       4.928  -4.444   1.446  1.00  0.00           C  
HETATM    4  C   UNL     1       5.450  -3.166   1.381  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.132   0.155   1.558  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.507   1.809  -0.131  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.239  -0.546   1.117  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.617   1.111  -0.569  1.00  0.00           C  
HETATM    9  C   UNL     1       2.239   2.211   0.463  1.00  0.00           C  
HETATM   10  C   UNL     1       7.298   2.637  -0.146  1.00  0.00           C  
HETATM   11  C   UNL     1       2.759   0.659  -1.160  1.00  0.00           C  
HETATM   12  C   UNL     1       4.648   2.002  -0.268  1.00  0.00           C  
HETATM   13  C   UNL     1       3.218   1.614  -0.331  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.982  -0.068   0.054  1.00  0.00           C  
HETATM   15  C   UNL     1       5.644   1.027  -0.130  1.00  0.00           C  
HETATM   16  C   UNL     1       1.002   1.739   0.275  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.337   1.629   0.686  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.565   2.102   1.421  1.00  0.00           C  
HETATM   19  C   UNL     1       6.374   3.654  -0.283  1.00  0.00           C  
HETATM   20  C   UNL     1       5.024   3.343  -0.346  1.00  0.00           C  
HETATM   21  C   UNL     1       5.606  -3.349  -1.001  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.768   1.334   0.936  1.00  0.00           C  
HETATM   23  C   UNL     1       5.792  -2.619   0.158  1.00  0.00           C  
HETATM   24  C   UNL     1     -10.067  -0.996   0.059  1.00  0.00           C  
HETATM   25  C   UNL     1       6.363  -1.226   0.089  1.00  0.00           C  
HETATM   26  C   UNL     1      -8.770  -0.291   0.461  1.00  0.00           C  
HETATM   27  N   UNL     1       6.918   1.374  -0.074  1.00  0.00           N  
HETATM   28  N   UNL     1      -0.137   2.177   0.957  1.00  0.00           N  
HETATM   29  O   UNL     1      -1.430   0.754  -0.150  1.00  0.00           O  
HETATM   30  O   UNL     1      -7.518  -0.594  -1.876  1.00  0.00           O  
HETATM   31  O   UNL     1      -7.127  -2.307  -0.134  1.00  0.00           O  
HETATM   32  O   UNL     1       5.299  -0.282  -0.052  1.00  0.00           O  
HETATM   33  S   UNL     1       1.021   0.486  -0.958  1.00  0.00           S  
HETATM   34  S   UNL     1      -7.392  -0.962  -0.509  1.00  0.00           S  
HETATM   35  H   UNL     1       4.338  -6.174   0.337  1.00  0.00           H  
HETATM   36  H   UNL     1       4.937  -5.197  -1.842  1.00  0.00           H  
HETATM   37  H   UNL     1       4.661  -4.871   2.401  1.00  0.00           H  
HETATM   38  H   UNL     1       5.592  -2.594   2.287  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.555  -0.217   2.392  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.223   2.731  -0.618  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.524  -1.468   1.604  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.200   1.487  -1.397  1.00  0.00           H  
HETATM   43  H   UNL     1       2.464   2.990   1.177  1.00  0.00           H  
HETATM   44  H   UNL     1       8.350   2.878  -0.101  1.00  0.00           H  
HETATM   45  H   UNL     1       3.365   0.090  -1.849  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.435   1.935   2.490  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.713   3.165   1.234  1.00  0.00           H  
HETATM   48  H   UNL     1       6.699   4.682  -0.340  1.00  0.00           H  
HETATM   49  H   UNL     1       4.282   4.120  -0.454  1.00  0.00           H  
HETATM   50  H   UNL     1       5.870  -2.921  -1.957  1.00  0.00           H  
HETATM   51  H   UNL     1     -10.256  -0.832  -1.002  1.00  0.00           H  
HETATM   52  H   UNL     1      -9.974  -2.065   0.251  1.00  0.00           H  
HETATM   53  H   UNL     1     -10.895  -0.592   0.642  1.00  0.00           H  
HETATM   54  H   UNL     1       6.918  -1.015   1.003  1.00  0.00           H  
HETATM   55  H   UNL     1       7.031  -1.150  -0.769  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.863   0.778   0.269  1.00  0.00           H  
HETATM   57  H   UNL     1      -8.581  -0.455   1.522  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.063   2.877   1.625  1.00  0.00           H  
CONECT    1    2    2    3   35                                       
CONECT    2   21    1    1   36                                       
CONECT    3    4    4    1   37                                       
CONECT    4   23    3    3   38                                       
CONECT    5    7   22   22   39                                       
CONECT    6    8    8   22   40                                       
CONECT    7   14   14    5   41                                       
CONECT    8   14    6    6   42                                       
CONECT    9   13   16   16   43                                       
CONECT   10   19   19   27   44                                       
CONECT   11   13   13   33   45                                       
CONECT   12   20   20   15   13                                       
CONECT   13   12    9   11   11                                       
CONECT   14   34    7    7    8                                       
CONECT   15   27   27   12   32                                       
CONECT   16    9    9   33   28                                       
CONECT   17   28   18   29   29                                       
CONECT   18   22   17   46   47                                       
CONECT   19   10   10   20   48                                       
CONECT   20   19   12   12   49                                       
CONECT   21   23   23    2   50                                       
CONECT   22    5    5    6   18                                       
CONECT   23   25   21   21    4                                       
CONECT   24   26   51   52   53                                       
CONECT   25   32   23   54   55                                       
CONECT   26   24   34   56   57                                       
CONECT   27   10   15   15                                            
CONECT   28   16   17   58                                            
CONECT   29   17   17                                                 
CONECT   30   34   34                                                 
CONECT   31   34   34                                                 
CONECT   32   15   25                                                 
CONECT   33   11   16                                                 
CONECT   34   31   31   26   30                                       
CONECT   34   30   14                                                 
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   18                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
CONECT   53   24                                                      
CONECT   54   25                                                      
CONECT   55   25                                                      
CONECT   56   26                                                      
CONECT   57   26                                                      
CONECT   58   28                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
