COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -5.786  -0.221   1.344  1.00  0.00           N  
HETATM    2  C   UNL     1      -5.320  -1.409   0.968  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.893  -2.603   1.444  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.389  -3.801   1.043  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.309  -3.869   0.164  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.728  -2.734  -0.318  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.224  -1.483   0.072  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.659  -0.278  -0.407  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.517  -0.297  -1.345  1.00  0.00           C  
HETATM   10  O   UNL     1      -2.717  -0.314  -2.543  1.00  0.00           O  
HETATM   11  O   UNL     1      -1.256  -0.295  -0.872  1.00  0.00           O  
HETATM   12  C   UNL     1      -0.184  -0.314  -1.852  1.00  0.00           C  
HETATM   13  C   UNL     1       1.145  -0.309  -1.142  1.00  0.00           C  
HETATM   14  O   UNL     1       1.185  -0.291   0.070  1.00  0.00           O  
HETATM   15  N   UNL     1       2.289  -0.324  -1.854  1.00  0.00           N  
HETATM   16  C   UNL     1       3.522  -0.222  -1.200  1.00  0.00           C  
HETATM   17  C   UNL     1       3.698  -0.804   0.048  1.00  0.00           C  
HETATM   18  C   UNL     1       4.916  -0.702   0.691  1.00  0.00           C  
HETATM   19  C   UNL     1       5.959  -0.020   0.093  1.00  0.00           C  
HETATM   20  S   UNL     1       7.509   0.115   0.920  1.00  0.00           S  
HETATM   21  O   UNL     1       7.576  -0.975   1.829  1.00  0.00           O  
HETATM   22  O   UNL     1       8.483   0.347  -0.089  1.00  0.00           O  
HETATM   23  N   UNL     1       7.455   1.490   1.842  1.00  0.00           N  
HETATM   24  C   UNL     1       5.787   0.561  -1.150  1.00  0.00           C  
HETATM   25  C   UNL     1       4.574   0.457  -1.801  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.207   0.931   0.030  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.607   2.194  -0.535  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.739   3.361   0.443  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.044   4.099   0.142  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.227   3.155   0.331  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.880   2.184   1.463  1.00  0.00           C  
HETATM   32  C   UNL     1      -5.267   0.918   0.920  1.00  0.00           C  
HETATM   33  H   UNL     1      -6.731  -2.568   2.125  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.832  -4.714   1.411  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.926  -4.833  -0.138  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.891  -2.798  -0.997  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.267  -1.213  -2.463  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.259   0.567  -2.489  1.00  0.00           H  
HETATM   39  H   UNL     1       2.258  -0.407  -2.820  1.00  0.00           H  
HETATM   40  H   UNL     1       2.883  -1.337   0.516  1.00  0.00           H  
HETATM   41  H   UNL     1       5.053  -1.154   1.662  1.00  0.00           H  
HETATM   42  H   UNL     1       7.964   1.541   2.666  1.00  0.00           H  
HETATM   43  H   UNL     1       6.914   2.243   1.558  1.00  0.00           H  
HETATM   44  H   UNL     1       6.605   1.093  -1.614  1.00  0.00           H  
HETATM   45  H   UNL     1       4.440   0.911  -2.771  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.552   2.024  -0.747  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.119   2.448  -1.463  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.759   2.982   1.465  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.895   4.040   0.320  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.145   4.947   0.820  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.028   4.458  -0.887  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.116   3.726   0.596  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.406   2.599  -0.589  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.172   2.662   2.140  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.788   1.936   2.012  1.00  0.00           H  
CONECT    1   32    2    2                                            
CONECT    2    1    1    7    3                                       
CONECT    3    2    4    4   33                                       
CONECT    4    3    3    5   34                                       
CONECT    5    6    6    4   35                                       
CONECT    6    7    5    5   36                                       
CONECT    7    8    8    2    6                                       
CONECT    8   26    9    7    7                                       
CONECT    9   10   10    8   11                                       
CONECT   10    9    9                                                 
CONECT   11    9   12                                                 
CONECT   12   13   11   37   38                                       
CONECT   13   15   14   14   12                                       
CONECT   14   13   13                                                 
CONECT   15   16   13   39                                            
CONECT   16   25   25   17   15                                       
CONECT   17   18   18   16   40                                       
CONECT   18   19   17   17   41                                       
CONECT   19   20   24   24   18                                       
CONECT   20   22   22   21   21                                       
CONECT   20   23   19                                                 
CONECT   21   20   20                                                 
CONECT   22   20   20                                                 
CONECT   23   20   42   43                                            
CONECT   24   19   19   25   44                                       
CONECT   25   24   16   16   45                                       
CONECT   26   27   32   32    8                                       
CONECT   27   28   26   46   47                                       
CONECT   28   27   29   48   49                                       
CONECT   29   28   30   50   51                                       
CONECT   30   29   31   52   53                                       
CONECT   31   30   32   54   55                                       
CONECT   32   31   26   26    1                                       
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   15                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   23                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
CONECT   45   25                                                      
CONECT   46   27                                                      
CONECT   47   27                                                      
CONECT   48   28                                                      
CONECT   49   28                                                      
CONECT   50   29                                                      
CONECT   51   29                                                      
CONECT   52   30                                                      
CONECT   53   30                                                      
CONECT   54   31                                                      
CONECT   55   31                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
