COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      11.012  -0.749   0.604  1.00  0.00           C  
HETATM    2  C   UNL     1      11.407   0.731   0.799  1.00  0.00           C  
HETATM    3  C   UNL     1      10.209   1.540   0.261  1.00  0.00           C  
HETATM    4  C   UNL     1       9.191   0.481  -0.213  1.00  0.00           C  
HETATM    5  N   UNL     1       9.527  -0.738   0.567  1.00  0.00           N  
HETATM    6  C   UNL     1       9.008  -1.944  -0.092  1.00  0.00           C  
HETATM    7  C   UNL     1       7.493  -2.021   0.106  1.00  0.00           C  
HETATM    8  O   UNL     1       6.868  -0.925  -0.566  1.00  0.00           O  
HETATM    9  C   UNL     1       5.513  -0.845  -0.488  1.00  0.00           C  
HETATM   10  C   UNL     1       4.843   0.193  -1.117  1.00  0.00           C  
HETATM   11  C   UNL     1       3.466   0.275  -1.039  1.00  0.00           C  
HETATM   12  C   UNL     1       4.801  -1.806   0.215  1.00  0.00           C  
HETATM   13  C   UNL     1       3.424  -1.726   0.294  1.00  0.00           C  
HETATM   14  C   UNL     1       2.753  -0.683  -0.331  1.00  0.00           C  
HETATM   15  N   UNL     1       1.357  -0.601  -0.251  1.00  0.00           N  
HETATM   16  C   UNL     1       0.742   0.635  -0.145  1.00  0.00           C  
HETATM   17  N   UNL     1      -0.582   0.698  -0.125  1.00  0.00           N  
HETATM   18  N   UNL     1       1.490   1.725  -0.059  1.00  0.00           N  
HETATM   19  C   UNL     1       0.938   2.924   0.049  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.439   3.034   0.073  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.102   4.382   0.195  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.202   1.869  -0.024  1.00  0.00           C  
HETATM   23  N   UNL     1      -2.587   1.931  -0.004  1.00  0.00           N  
HETATM   24  C   UNL     1      -3.341   0.761  -0.127  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.544   0.632   0.557  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.893  -0.274  -0.938  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.641  -1.429  -1.057  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.835  -1.556  -0.371  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.287  -0.525   0.433  1.00  0.00           C  
HETATM   30  S   UNL     1      -6.812  -0.689   1.301  1.00  0.00           S  
HETATM   31  O   UNL     1      -7.160  -2.065   1.244  1.00  0.00           O  
HETATM   32  O   UNL     1      -6.658   0.025   2.520  1.00  0.00           O  
HETATM   33  N   UNL     1      -7.962   0.121   0.427  1.00  0.00           N  
HETATM   34  C   UNL     1      -8.375  -0.384  -0.885  1.00  0.00           C  
HETATM   35  C   UNL     1      -7.161  -0.961  -1.615  1.00  0.00           C  
HETATM   36  C   UNL     1      -9.428  -1.479  -0.702  1.00  0.00           C  
HETATM   37  C   UNL     1      -8.968   0.761  -1.709  1.00  0.00           C  
HETATM   38  H   UNL     1      11.413  -1.129  -0.335  1.00  0.00           H  
HETATM   39  H   UNL     1      11.368  -1.351   1.440  1.00  0.00           H  
HETATM   40  H   UNL     1      11.564   0.945   1.857  1.00  0.00           H  
HETATM   41  H   UNL     1      12.307   0.961   0.228  1.00  0.00           H  
HETATM   42  H   UNL     1       9.778   2.151   1.055  1.00  0.00           H  
HETATM   43  H   UNL     1      10.521   2.168  -0.573  1.00  0.00           H  
HETATM   44  H   UNL     1       8.174   0.806   0.008  1.00  0.00           H  
HETATM   45  H   UNL     1       9.306   0.295  -1.281  1.00  0.00           H  
HETATM   46  H   UNL     1       9.233  -1.901  -1.158  1.00  0.00           H  
HETATM   47  H   UNL     1       9.477  -2.826   0.344  1.00  0.00           H  
HETATM   48  H   UNL     1       7.120  -2.959  -0.305  1.00  0.00           H  
HETATM   49  H   UNL     1       7.262  -1.974   1.170  1.00  0.00           H  
HETATM   50  H   UNL     1       5.397   0.939  -1.667  1.00  0.00           H  
HETATM   51  H   UNL     1       2.944   1.084  -1.528  1.00  0.00           H  
HETATM   52  H   UNL     1       5.323  -2.617   0.701  1.00  0.00           H  
HETATM   53  H   UNL     1       2.870  -2.474   0.841  1.00  0.00           H  
HETATM   54  H   UNL     1       0.822  -1.410  -0.270  1.00  0.00           H  
HETATM   55  H   UNL     1       1.557   3.806   0.123  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.273   4.794  -0.799  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.055   4.272   0.712  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.457   5.054   0.761  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.032   2.787   0.095  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.897   1.437   1.185  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.961  -0.176  -1.474  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.294  -2.234  -1.688  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.418  -2.460  -0.466  1.00  0.00           H  
HETATM   64  H   UNL     1      -8.363   0.929   0.784  1.00  0.00           H  
HETATM   65  H   UNL     1      -6.851  -1.887  -1.129  1.00  0.00           H  
HETATM   66  H   UNL     1      -7.424  -1.166  -2.653  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.342  -0.243  -1.582  1.00  0.00           H  
HETATM   68  H   UNL     1     -10.310  -1.057  -0.220  1.00  0.00           H  
HETATM   69  H   UNL     1      -9.705  -1.883  -1.676  1.00  0.00           H  
HETATM   70  H   UNL     1      -9.020  -2.275  -0.080  1.00  0.00           H  
HETATM   71  H   UNL     1      -8.218   1.541  -1.839  1.00  0.00           H  
HETATM   72  H   UNL     1      -9.275   0.386  -2.685  1.00  0.00           H  
HETATM   73  H   UNL     1      -9.833   1.173  -1.189  1.00  0.00           H  
CONECT    1    5    2   38   39                                       
CONECT    2    1    3   40   41                                       
CONECT    3    4    2   42   43                                       
CONECT    4    5    3   44   45                                       
CONECT    5    6    1    4                                            
CONECT    6    7    5   46   47                                       
CONECT    7    8    6   48   49                                       
CONECT    8    9    7                                                 
CONECT    9   12   12   10    8                                       
CONECT   10   11   11    9   50                                       
CONECT   11   14   10   10   51                                       
CONECT   12   13    9    9   52                                       
CONECT   13   14   14   12   53                                       
CONECT   14   15   13   13   11                                       
CONECT   15   16   14   54                                            
CONECT   16   18   18   17   15                                       
CONECT   17   16   22   22                                            
CONECT   18   19   16   16                                            
CONECT   19   20   20   18   55                                       
CONECT   20   21   19   19   22                                       
CONECT   21   20   56   57   58                                       
CONECT   22   20   23   17   17                                       
CONECT   23   22   24   59                                            
CONECT   24   23   26   26   25                                       
CONECT   25   24   29   29   60                                       
CONECT   26   24   24   27   61                                       
CONECT   27   26   28   28   62                                       
CONECT   28   27   27   29   63                                       
CONECT   29   25   25   28   30                                       
CONECT   30   29   32   32   33                                       
CONECT   30   31   31                                                 
CONECT   31   30   30                                                 
CONECT   32   30   30                                                 
CONECT   33   30   34   64                                            
CONECT   34   33   37   35   36                                       
CONECT   35   34   65   66   67                                       
CONECT   36   34   68   69   70                                       
CONECT   37   34   71   72   73                                       
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    2                                                      
CONECT   41    2                                                      
CONECT   42    3                                                      
CONECT   43    3                                                      
CONECT   44    4                                                      
CONECT   45    4                                                      
CONECT   46    6                                                      
CONECT   47    6                                                      
CONECT   48    7                                                      
CONECT   49    7                                                      
CONECT   50   10                                                      
CONECT   51   11                                                      
CONECT   52   12                                                      
CONECT   53   13                                                      
CONECT   54   15                                                      
CONECT   55   19                                                      
CONECT   56   21                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   23                                                      
CONECT   60   25                                                      
CONECT   61   26                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   33                                                      
CONECT   65   35                                                      
CONECT   66   35                                                      
CONECT   67   35                                                      
CONECT   68   36                                                      
CONECT   69   36                                                      
CONECT   70   36                                                      
CONECT   71   37                                                      
CONECT   72   37                                                      
CONECT   73   37                                                      
MASTER        0    0    0    0    0    0    0    0   73    0   73    0
END
