COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.204  -1.760  -0.080  1.00  0.00           C  
HETATM    2  C   UNL     1       1.997  -3.065   0.196  1.00  0.00           C  
HETATM    3  C   UNL     1       3.651  -1.640  -0.326  1.00  0.00           C  
HETATM    4  C   UNL     1       0.901  -1.015  -0.022  1.00  0.00           C  
HETATM    5  C   UNL     1       0.529  -3.283   0.464  1.00  0.00           C  
HETATM    6  N   UNL     1       3.181  -3.700   0.132  1.00  0.00           N  
HETATM    7  N   UNL     1       4.326  -0.550  -0.635  1.00  0.00           N  
HETATM    8  N   UNL     1       4.142  -2.905  -0.166  1.00  0.00           N  
HETATM    9  N   UNL     1      -0.146  -1.987   0.319  1.00  0.00           N  
HETATM   10  C   UNL     1      -0.043  -4.275  -0.551  1.00  0.00           C  
HETATM   11  C   UNL     1       0.334  -3.820   1.883  1.00  0.00           C  
HETATM   12  C   UNL     1       3.672   0.606  -0.856  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.461  -1.739   0.471  1.00  0.00           C  
HETATM   14  C   UNL     1       3.509   1.555   0.181  1.00  0.00           C  
HETATM   15  N   UNL     1       3.168   0.885  -2.063  1.00  0.00           N  
HETATM   16  N   UNL     1      -1.950  -0.510   0.212  1.00  0.00           N  
HETATM   17  O   UNL     1      -2.208  -2.624   0.843  1.00  0.00           O  
HETATM   18  C   UNL     1       2.817   2.748  -0.103  1.00  0.00           C  
HETATM   19  S   UNL     1       4.023   1.554   1.860  1.00  0.00           S  
HETATM   20  C   UNL     1       2.530   2.013  -2.281  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.392  -0.264   0.287  1.00  0.00           C  
HETATM   22  N   UNL     1       2.347   2.922  -1.349  1.00  0.00           N  
HETATM   23  C   UNL     1       2.737   3.609   1.059  1.00  0.00           C  
HETATM   24  C   UNL     1       3.312   3.131   2.148  1.00  0.00           C  
HETATM   25  C   UNL     1       1.982   2.276  -3.660  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.640   1.209   0.492  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.055  -0.716  -1.015  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.636   1.628   1.354  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.868   2.139  -0.178  1.00  0.00           C  
HETATM   30  N   UNL     1      -5.514  -0.602  -0.887  1.00  0.00           N  
HETATM   31  C   UNL     1      -4.863   2.978   1.543  1.00  0.00           C  
HETATM   32  C   UNL     1      -3.096   3.490   0.010  1.00  0.00           C  
HETATM   33  C   UNL     1      -4.095   3.909   0.869  1.00  0.00           C  
HETATM   34  C   UNL     1      -6.173  -0.786  -2.187  1.00  0.00           C  
HETATM   35  C   UNL     1      -6.031  -1.555   0.104  1.00  0.00           C  
HETATM   36  H   UNL     1       0.950  -0.241   0.743  1.00  0.00           H  
HETATM   37  H   UNL     1       0.688  -0.566  -0.992  1.00  0.00           H  
HETATM   38  H   UNL     1       0.466  -5.234  -0.448  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.109  -4.408  -0.368  1.00  0.00           H  
HETATM   40  H   UNL     1       0.108  -3.890  -1.560  1.00  0.00           H  
HETATM   41  H   UNL     1       0.751  -3.113   2.600  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.730  -3.951   2.079  1.00  0.00           H  
HETATM   43  H   UNL     1       0.842  -4.779   1.982  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.346   0.212  -0.025  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.813  -0.823   1.122  1.00  0.00           H  
HETATM   46  H   UNL     1       2.244   4.570   1.037  1.00  0.00           H  
HETATM   47  H   UNL     1       3.342   3.647   3.096  1.00  0.00           H  
HETATM   48  H   UNL     1       0.936   1.971  -3.700  1.00  0.00           H  
HETATM   49  H   UNL     1       2.059   3.340  -3.885  1.00  0.00           H  
HETATM   50  H   UNL     1       2.555   1.708  -4.393  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.712  -0.086  -1.836  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.788  -1.753  -1.218  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.236   0.901   1.881  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.087   1.812  -0.848  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.642   3.306   2.216  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.493   4.217  -0.513  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.933  -1.774  -2.580  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.252  -0.696  -2.063  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.823  -0.023  -2.883  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.656  -1.290   1.093  1.00  0.00           H  
HETATM   61  H   UNL     1      -7.121  -1.520   0.108  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.701  -2.561  -0.152  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.273   4.964   1.015  1.00  0.00           H  
CONECT    1    2    2    3    4                                       
CONECT    2    1    1    5    6                                       
CONECT    3    1    7    7    8                                       
CONECT    4    1    9   36   37                                       
CONECT    5    2    9   10   11                                       
CONECT    6    2    8    8                                            
CONECT    7    3    3   12                                            
CONECT    8    3    6    6                                            
CONECT    9    4    5   13                                            
CONECT   10    5   38   39   40                                       
CONECT   11    5   41   42   43                                       
CONECT   12    7   14   15   15                                       
CONECT   13    9   16   17   17                                       
CONECT   14   12   18   18   19                                       
CONECT   15   12   12   20                                            
CONECT   16   13   21   44                                            
CONECT   17   13   13                                                 
CONECT   18   14   14   22   23                                       
CONECT   19   14   24                                                 
CONECT   20   15   22   22   25                                       
CONECT   21   16   26   27   45                                       
CONECT   22   18   20   20                                            
CONECT   23   18   24   24   46                                       
CONECT   24   19   23   23   47                                       
CONECT   25   20   48   49   50                                       
CONECT   26   21   28   29   29                                       
CONECT   27   21   30   51   52                                       
CONECT   28   26   31   31   53                                       
CONECT   29   26   26   32   54                                       
CONECT   30   27   34   35                                            
CONECT   31   28   28   33   55                                       
CONECT   32   29   33   33   56                                       
CONECT   33   31   32   32   63                                       
CONECT   34   30   57   58   59                                       
CONECT   35   30   60   61   62                                       
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   16                                                      
CONECT   45   21                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   27                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   29                                                      
CONECT   55   31                                                      
CONECT   56   32                                                      
CONECT   57   34                                                      
CONECT   58   34                                                      
CONECT   59   34                                                      
CONECT   60   35                                                      
CONECT   61   35                                                      
CONECT   62   35                                                      
CONECT   63   33                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
