COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.099  -2.854  -0.931  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.271  -2.111   0.396  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.775  -0.716   0.128  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.129  -0.310   0.049  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.129   1.051  -0.211  1.00  0.00           C  
HETATM    6  C   UNL     1       4.745   1.890   0.123  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.014   0.395  -0.078  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.546   0.443  -0.078  1.00  0.00           C  
HETATM    9  C   UNL     1       0.484   1.680  -0.188  1.00  0.00           C  
HETATM   10  C   UNL     1       1.264   0.592  -0.551  1.00  0.00           C  
HETATM   11  C   UNL     1       2.641   0.664  -0.450  1.00  0.00           C  
HETATM   12  C   UNL     1       3.243   1.819   0.014  1.00  0.00           C  
HETATM   13  C   UNL     1       2.473   2.907   0.378  1.00  0.00           C  
HETATM   14  C   UNL     1       1.092   2.843   0.279  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.307  -1.167   0.212  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.351   1.916  -0.383  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.847  -1.453   1.589  1.00  0.00           C  
HETATM   18  C   UNL     1       6.472  -2.457   0.210  1.00  0.00           C  
HETATM   19  C   UNL     1       3.126  -0.928   2.565  1.00  0.00           C  
HETATM   20  C   UNL     1       5.776  -1.174   0.670  1.00  0.00           C  
HETATM   21  C   UNL     1       3.505  -1.952   1.493  1.00  0.00           C  
HETATM   22  N   UNL     1      -3.856   1.466  -0.289  1.00  0.00           N  
HETATM   23  N   UNL     1      -0.910   1.612  -0.295  1.00  0.00           N  
HETATM   24  N   UNL     1       4.330  -1.304   0.470  1.00  0.00           N  
HETATM   25  O   UNL     1      -6.848  -1.646  -0.763  1.00  0.00           O  
HETATM   26  O   UNL     1      -0.904  -0.572   0.119  1.00  0.00           O  
HETATM   27  O   UNL     1       2.730  -1.724  -1.361  1.00  0.00           O  
HETATM   28  O   UNL     1       4.686  -0.208  -1.712  1.00  0.00           O  
HETATM   29  O   UNL     1       0.333   3.913   0.636  1.00  0.00           O  
HETATM   30  S   UNL     1       3.629  -0.720  -0.911  1.00  0.00           S  
HETATM   31  H   UNL     1      -4.059  -2.907  -1.445  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.382  -2.322  -1.555  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.735  -3.863  -0.737  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.989  -2.643   1.020  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.311  -2.058   0.910  1.00  0.00           H  
HETATM   36  H   UNL     1       5.155   2.323  -0.789  1.00  0.00           H  
HETATM   37  H   UNL     1       5.018   2.513   0.975  1.00  0.00           H  
HETATM   38  H   UNL     1       5.148   0.887   0.262  1.00  0.00           H  
HETATM   39  H   UNL     1       0.796  -0.312  -0.913  1.00  0.00           H  
HETATM   40  H   UNL     1       2.947   3.808   0.739  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.696   1.856  -1.415  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.139   1.569   0.285  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.101   2.950  -0.144  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.293  -0.871   2.325  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.902  -1.180   1.630  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.739  -2.515   1.809  1.00  0.00           H  
HETATM   47  H   UNL     1       7.547  -2.359   0.359  1.00  0.00           H  
HETATM   48  H   UNL     1       6.099  -3.300   0.791  1.00  0.00           H  
HETATM   49  H   UNL     1       6.265  -2.623  -0.847  1.00  0.00           H  
HETATM   50  H   UNL     1       2.589  -1.429   3.371  1.00  0.00           H  
HETATM   51  H   UNL     1       4.029  -0.466   2.962  1.00  0.00           H  
HETATM   52  H   UNL     1       2.488  -0.161   2.126  1.00  0.00           H  
HETATM   53  H   UNL     1       5.983  -1.007   1.727  1.00  0.00           H  
HETATM   54  H   UNL     1       6.148  -0.330   0.089  1.00  0.00           H  
HETATM   55  H   UNL     1       4.066  -2.766   1.950  1.00  0.00           H  
HETATM   56  H   UNL     1       2.600  -2.348   1.032  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.572   2.377  -0.464  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.419   2.405  -0.526  1.00  0.00           H  
HETATM   59  H   UNL     1       0.069   3.915   1.566  1.00  0.00           H  
CONECT    1    2   31   32   33                                       
CONECT    2    3    1   34   35                                       
CONECT    3    4    7    7    2                                       
CONECT    4    5    5   15    3                                       
CONECT    5   16   22    4    4                                       
CONECT    6   12   36   37   38                                       
CONECT    7   22    8    3    3                                       
CONECT    8   26   26    7   23                                       
CONECT    9   10   23   14   14                                       
CONECT   10   11   11    9   39                                       
CONECT   11   30   10   10   12                                       
CONECT   12   11    6   13   13                                       
CONECT   13   12   12   14   40                                       
CONECT   14    9    9   13   29                                       
CONECT   15   25   25    4   17                                       
CONECT   16    5   41   42   43                                       
CONECT   17   15   44   45   46                                       
CONECT   18   20   47   48   49                                       
CONECT   19   21   50   51   52                                       
CONECT   20   18   24   53   54                                       
CONECT   21   19   24   55   56                                       
CONECT   22    5    7   57                                            
CONECT   23    8    9   58                                            
CONECT   24   21   20   30                                            
CONECT   25   15   15                                                 
CONECT   26    8    8                                                 
CONECT   27   30   30                                                 
CONECT   28   30   30                                                 
CONECT   29   14   59                                                 
CONECT   30   28   28   24   27                                       
CONECT   30   27   11                                                 
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39   10                                                      
CONECT   40   13                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   17                                                      
CONECT   46   17                                                      
CONECT   47   18                                                      
CONECT   48   18                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   20                                                      
CONECT   55   21                                                      
CONECT   56   21                                                      
CONECT   57   22                                                      
CONECT   58   23                                                      
CONECT   59   29                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
