COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.696   0.466  -1.006  1.00  0.00           C  
HETATM    2  C   UNL     1      -9.762  -1.997   0.154  1.00  0.00           C  
HETATM    3  C   UNL     1       7.301  -1.351  -0.534  1.00  0.00           C  
HETATM    4  C   UNL     1       7.151  -0.303   1.497  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.446  -0.052   0.330  1.00  0.00           C  
HETATM    6  C   UNL     1       6.524  -0.038  -0.690  1.00  0.00           C  
HETATM    7  S   UNL     1       4.733  -1.986  -0.629  1.00  0.00           S  
HETATM    8  C   UNL     1      -7.892  -0.355  -0.069  1.00  0.00           C  
HETATM    9  C   UNL     1     -10.182  -3.331   0.775  1.00  0.00           C  
HETATM   10  O   UNL     1      -1.942   2.131  -0.463  1.00  0.00           O  
HETATM   11  C   UNL     1      -0.632   2.168  -0.175  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.793   3.096   0.210  1.00  0.00           C  
HETATM   13  C   UNL     1       0.313   1.197  -0.835  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.242   2.901  -0.242  1.00  0.00           C  
HETATM   15  C   UNL     1       1.737   1.452  -0.336  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.057   1.337  -0.182  1.00  0.00           C  
HETATM   17  C   UNL     1      -8.281  -1.744   0.443  1.00  0.00           C  
HETATM   18  C   UNL     1       4.120   0.721  -0.507  1.00  0.00           C  
HETATM   19  C   UNL     1       5.079  -0.265  -1.177  1.00  0.00           C  
HETATM   20  C   UNL     1       6.451  -2.583  -0.902  1.00  0.00           C  
HETATM   21  N   UNL     1       7.639  -1.397   0.897  1.00  0.00           N  
HETATM   22  N   UNL     1       6.501   0.526   0.669  1.00  0.00           N  
HETATM   23  O   UNL     1      -0.209   2.981   0.613  1.00  0.00           O  
HETATM   24  O   UNL     1       7.285  -0.082   2.685  1.00  0.00           O  
HETATM   25  O   UNL     1      -7.491  -2.734  -0.218  1.00  0.00           O  
HETATM   26  O   UNL     1      -4.707   1.621   0.190  1.00  0.00           O  
HETATM   27  H   UNL     1       2.401  -0.553  -0.757  1.00  0.00           H  
HETATM   28  H   UNL     1       2.660   0.602  -2.087  1.00  0.00           H  
HETATM   29  H   UNL     1      -9.921  -2.032  -0.924  1.00  0.00           H  
HETATM   30  H   UNL     1     -10.359  -1.192   0.583  1.00  0.00           H  
HETATM   31  H   UNL     1       8.209  -1.326  -1.136  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.356  -0.077   1.416  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.784  -0.799  -0.107  1.00  0.00           H  
HETATM   34  H   UNL     1       7.050   0.633  -1.369  1.00  0.00           H  
HETATM   35  H   UNL     1      -8.554   0.392   0.368  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.982  -0.330  -1.155  1.00  0.00           H  
HETATM   37  H   UNL     1      -9.585  -4.135   0.345  1.00  0.00           H  
HETATM   38  H   UNL     1     -10.023  -3.296   1.852  1.00  0.00           H  
HETATM   39  H   UNL     1     -11.237  -3.511   0.569  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.726   2.950   1.288  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.467   4.105  -0.041  1.00  0.00           H  
HETATM   42  H   UNL     1       0.018   0.178  -0.586  1.00  0.00           H  
HETATM   43  H   UNL     1       0.277   1.333  -1.916  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.866   3.680   0.194  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.294   2.958  -1.329  1.00  0.00           H  
HETATM   46  H   UNL     1       1.773   1.317   0.745  1.00  0.00           H  
HETATM   47  H   UNL     1       2.032   2.472  -0.584  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.147   1.362  -1.268  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.719   2.084   0.255  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.106  -1.797   1.517  1.00  0.00           H  
HETATM   51  H   UNL     1       4.415   1.740  -0.756  1.00  0.00           H  
HETATM   52  H   UNL     1       4.156   0.586   0.574  1.00  0.00           H  
HETATM   53  H   UNL     1       5.017  -0.185  -2.262  1.00  0.00           H  
HETATM   54  H   UNL     1       6.602  -2.860  -1.945  1.00  0.00           H  
HETATM   55  H   UNL     1       6.678  -3.421  -0.242  1.00  0.00           H  
HETATM   56  H   UNL     1       8.135  -2.106   1.336  1.00  0.00           H  
HETATM   57  H   UNL     1       6.083   1.363   0.924  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.596  -2.744  -1.179  1.00  0.00           H  
CONECT    1   18   15   27   28                                       
CONECT    2   17    9   29   30                                       
CONECT    3   21   20    6   31                                       
CONECT    4   24   24   21   22                                       
CONECT    5    8   16   32   33                                       
CONECT    6   22    3   19   34                                       
CONECT    7   20   19                                                 
CONECT    8   17    5   35   36                                       
CONECT    9    2   37   38   39                                       
CONECT   10   11   12                                                 
CONECT   11   13   23   23   10                                       
CONECT   12   10   14   40   41                                       
CONECT   13   15   11   42   43                                       
CONECT   14   26   12   44   45                                       
CONECT   15   13    1   46   47                                       
CONECT   16    5   26   48   49                                       
CONECT   17   25    2    8   50                                       
CONECT   18   19    1   51   52                                       
CONECT   19    7   18    6   53                                       
CONECT   20    7    3   54   55                                       
CONECT   21    4    3   56                                            
CONECT   22    4    6   57                                            
CONECT   23   11   11                                                 
CONECT   24    4    4                                                 
CONECT   25   17   58                                                 
CONECT   26   16   14                                                 
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39    9                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   20                                                      
CONECT   55   20                                                      
CONECT   56   21                                                      
CONECT   57   22                                                      
CONECT   58   25                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
