COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.157   5.161   0.396  1.00  0.00           C  
HETATM    2  C   UNL     1       3.708   3.772   0.204  1.00  0.00           C  
HETATM    3  C   UNL     1       5.037   3.597  -0.123  1.00  0.00           C  
HETATM    4  C   UNL     1       5.548   2.324  -0.301  1.00  0.00           C  
HETATM    5  C   UNL     1       4.727   1.214  -0.150  1.00  0.00           C  
HETATM    6  C   UNL     1       6.620  -0.130  -0.663  1.00  0.00           C  
HETATM    7  C   UNL     1       7.006  -1.602  -0.819  1.00  0.00           C  
HETATM    8  C   UNL     1       6.792  -1.775  -3.224  1.00  0.00           C  
HETATM    9  C   UNL     1       6.210  -3.658  -1.819  1.00  0.00           C  
HETATM   10  C   UNL     1       3.392   1.379   0.177  1.00  0.00           C  
HETATM   11  C   UNL     1       2.877   2.662   0.363  1.00  0.00           C  
HETATM   12  C   UNL     1       1.452   2.846   0.713  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.737   1.956   1.304  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.864   2.206   2.808  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.510   0.716   0.934  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.957  -0.530   1.155  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.668  -1.683   0.814  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.074  -3.016   1.050  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.664  -4.193   0.762  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.912  -5.307   1.074  1.00  0.00           C  
HETATM   21  C   UNL     1       0.284  -5.050   1.613  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.937  -1.574   0.251  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.489  -0.314   0.031  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.836  -0.189  -0.566  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.622  -1.219  -0.937  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.840  -0.853  -1.472  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.055   0.465  -1.539  1.00  0.00           C  
HETATM   28  C   UNL     1      -8.303   1.112  -2.080  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.770   0.831   0.382  1.00  0.00           C  
HETATM   30  N   UNL     1       0.674   1.773   0.957  1.00  0.00           N  
HETATM   31  N   UNL     1      -9.271   1.296  -0.990  1.00  0.00           N  
HETATM   32  N   UNL     1       6.245  -2.194  -1.927  1.00  0.00           N  
HETATM   33  O   UNL     1       0.983   3.966   0.781  1.00  0.00           O  
HETATM   34  O   UNL     1       5.235  -0.034  -0.326  1.00  0.00           O  
HETATM   35  S   UNL     1       0.515  -3.311   1.744  1.00  0.00           S  
HETATM   36  S   UNL     1      -5.665   1.328  -0.894  1.00  0.00           S  
HETATM   37  H   UNL     1       2.670   5.489  -0.523  1.00  0.00           H  
HETATM   38  H   UNL     1       2.431   5.155   1.209  1.00  0.00           H  
HETATM   39  H   UNL     1       3.970   5.845   0.640  1.00  0.00           H  
HETATM   40  H   UNL     1       5.681   4.456  -0.242  1.00  0.00           H  
HETATM   41  H   UNL     1       6.589   2.193  -0.557  1.00  0.00           H  
HETATM   42  H   UNL     1       7.219   0.321   0.128  1.00  0.00           H  
HETATM   43  H   UNL     1       6.803   0.395  -1.601  1.00  0.00           H  
HETATM   44  H   UNL     1       8.073  -1.678  -1.030  1.00  0.00           H  
HETATM   45  H   UNL     1       6.780  -2.137   0.104  1.00  0.00           H  
HETATM   46  H   UNL     1       7.830  -2.097  -3.302  1.00  0.00           H  
HETATM   47  H   UNL     1       6.210  -2.227  -4.027  1.00  0.00           H  
HETATM   48  H   UNL     1       6.742  -0.689  -3.306  1.00  0.00           H  
HETATM   49  H   UNL     1       5.813  -3.941  -0.844  1.00  0.00           H  
HETATM   50  H   UNL     1       5.572  -4.065  -2.603  1.00  0.00           H  
HETATM   51  H   UNL     1       7.219  -4.055  -1.929  1.00  0.00           H  
HETATM   52  H   UNL     1       2.753   0.517   0.294  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.138   2.810   0.759  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.463   1.352   3.354  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.305   3.103   3.076  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.914   2.342   3.067  1.00  0.00           H  
HETATM   57  H   UNL     1       0.027  -0.613   1.591  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.648  -4.259   0.323  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.264  -6.312   0.897  1.00  0.00           H  
HETATM   60  H   UNL     1       1.002  -5.797   1.917  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.490  -2.463  -0.015  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.321  -2.250  -0.826  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.565  -1.577  -1.811  1.00  0.00           H  
HETATM   64  H   UNL     1      -8.052   2.082  -2.510  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.739   0.475  -2.849  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.197   1.809   0.212  1.00  0.00           H  
HETATM   67  H   UNL     1       1.049   0.880   0.902  1.00  0.00           H  
HETATM   68  H   UNL     1      -8.868   1.830  -0.234  1.00  0.00           H  
HETATM   69  H   UNL     1     -10.118   1.729  -1.327  1.00  0.00           H  
CONECT    1    2   37   38   39                                       
CONECT    2    1    3    3   11                                       
CONECT    3    2    2    4   40                                       
CONECT    4    3    5    5   41                                       
CONECT    5    4    4   34   10                                       
CONECT    6   34    7   42   43                                       
CONECT    7    6   32   44   45                                       
CONECT    8   32   46   47   48                                       
CONECT    9   32   49   50   51                                       
CONECT   10    5   11   11   52                                       
CONECT   11   10   10   12    2                                       
CONECT   12   11   33   33   30                                       
CONECT   13   30   14   15   53                                       
CONECT   14   13   54   55   56                                       
CONECT   15   13   16   16   29                                       
CONECT   16   15   15   17   57                                       
CONECT   17   16   18   22   22                                       
CONECT   18   17   19   19   35                                       
CONECT   19   18   18   20   58                                       
CONECT   20   19   21   21   59                                       
CONECT   21   20   20   35   60                                       
CONECT   22   17   17   23   61                                       
CONECT   23   22   24   29   29                                       
CONECT   24   23   25   25   36                                       
CONECT   25   24   24   26   62                                       
CONECT   26   25   27   27   63                                       
CONECT   27   26   26   28   36                                       
CONECT   28   27   31   64   65                                       
CONECT   29   23   23   15   66                                       
CONECT   30   12   13   67                                            
CONECT   31   28   68   69                                            
CONECT   32    7    8    9                                            
CONECT   33   12   12                                                 
CONECT   34    5    6                                                 
CONECT   35   21   18                                                 
CONECT   36   27   24                                                 
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    6                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    7                                                      
CONECT   46    8                                                      
CONECT   47    8                                                      
CONECT   48    8                                                      
CONECT   49    9                                                      
CONECT   50    9                                                      
CONECT   51    9                                                      
CONECT   52   10                                                      
CONECT   53   13                                                      
CONECT   54   14                                                      
CONECT   55   14                                                      
CONECT   56   14                                                      
CONECT   57   16                                                      
CONECT   58   19                                                      
CONECT   59   20                                                      
CONECT   60   21                                                      
CONECT   61   22                                                      
CONECT   62   25                                                      
CONECT   63   26                                                      
CONECT   64   28                                                      
CONECT   65   28                                                      
CONECT   66   29                                                      
CONECT   67   30                                                      
CONECT   68   31                                                      
CONECT   69   31                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
