COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.071   1.329   0.256  1.00  0.00           C  
HETATM    2  C   UNL     1       1.597   0.544  -0.315  1.00  0.00           C  
HETATM    3  C   UNL     1       1.972   1.941  -0.814  1.00  0.00           C  
HETATM    4  C   UNL     1       3.346   2.302  -0.312  1.00  0.00           C  
HETATM    5  C   UNL     1       3.502   2.829   0.957  1.00  0.00           C  
HETATM    6  C   UNL     1       4.762   3.160   1.418  1.00  0.00           C  
HETATM    7  C   UNL     1       5.867   2.963   0.611  1.00  0.00           C  
HETATM    8  C   UNL     1       5.712   2.435  -0.657  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.240  -3.004  -1.465  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.417  -2.830   0.045  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.659  -1.978   0.319  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.586  -4.203   0.700  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.956  -0.945   0.124  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.566   1.056   0.078  1.00  0.00           C  
HETATM   15  C   UNL     1       4.452   2.100  -1.117  1.00  0.00           C  
HETATM   16  C   UNL     1       2.513  -0.476  -0.941  1.00  0.00           C  
HETATM   17  C   UNL     1       4.601  -1.731  -0.992  1.00  0.00           C  
HETATM   18  C   UNL     1       5.866  -1.836  -0.180  1.00  0.00           C  
HETATM   19  C   UNL     1       5.956  -2.740   0.862  1.00  0.00           C  
HETATM   20  C   UNL     1       8.114  -2.085   1.331  1.00  0.00           C  
HETATM   21  C   UNL     1       8.100  -1.163   0.301  1.00  0.00           C  
HETATM   22  C   UNL     1       6.956  -1.031  -0.472  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.371   2.104   0.849  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.840   1.910   0.575  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.437   2.561  -0.488  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.785   2.383  -0.739  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.536   1.554   0.073  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.938   0.902   1.136  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.590   1.077   1.384  1.00  0.00           C  
HETATM   30  N   UNL     1      -2.883  -0.278   0.594  1.00  0.00           N  
HETATM   31  N   UNL     1       3.711  -0.739  -0.383  1.00  0.00           N  
HETATM   32  N   UNL     1       7.060  -2.837   1.577  1.00  0.00           N  
HETATM   33  O   UNL     1      -4.247  -2.171   0.597  1.00  0.00           O  
HETATM   34  O   UNL     1      -4.660  -0.439  -0.728  1.00  0.00           O  
HETATM   35  O   UNL     1       2.171  -1.060  -1.948  1.00  0.00           O  
HETATM   36  S   UNL     1      -0.119   0.179  -0.774  1.00  0.00           S  
HETATM   37  H   UNL     1      -0.851   2.354  -0.045  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.798   1.191   1.302  1.00  0.00           H  
HETATM   39  H   UNL     1       1.699   0.506   0.770  1.00  0.00           H  
HETATM   40  H   UNL     1       1.970   1.950  -1.904  1.00  0.00           H  
HETATM   41  H   UNL     1       1.248   2.666  -0.444  1.00  0.00           H  
HETATM   42  H   UNL     1       2.639   2.983   1.587  1.00  0.00           H  
HETATM   43  H   UNL     1       4.884   3.573   2.408  1.00  0.00           H  
HETATM   44  H   UNL     1       6.852   3.223   0.971  1.00  0.00           H  
HETATM   45  H   UNL     1       6.575   2.282  -1.288  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.356  -3.611  -1.659  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.119  -3.499  -1.879  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.120  -2.026  -1.931  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.537  -2.473  -0.096  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.785  -1.855   1.394  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.538  -1.001  -0.148  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.702  -4.809   0.505  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.712  -4.079   1.776  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.465  -4.697   0.286  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.821   1.107  -0.980  1.00  0.00           H  
HETATM   56  H   UNL     1       4.331   1.684  -2.106  1.00  0.00           H  
HETATM   57  H   UNL     1       4.846  -1.423  -2.008  1.00  0.00           H  
HETATM   58  H   UNL     1       4.103  -2.700  -1.015  1.00  0.00           H  
HETATM   59  H   UNL     1       5.112  -3.373   1.094  1.00  0.00           H  
HETATM   60  H   UNL     1       9.001  -2.193   1.938  1.00  0.00           H  
HETATM   61  H   UNL     1       8.967  -0.549   0.105  1.00  0.00           H  
HETATM   62  H   UNL     1       6.917  -0.319  -1.283  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.183   1.995   1.916  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.071   3.102   0.527  1.00  0.00           H  
HETATM   65  H   UNL     1      -4.851   3.208  -1.123  1.00  0.00           H  
HETATM   66  H   UNL     1      -7.252   2.892  -1.569  1.00  0.00           H  
HETATM   67  H   UNL     1      -8.589   1.415  -0.122  1.00  0.00           H  
HETATM   68  H   UNL     1      -7.525   0.255   1.771  1.00  0.00           H  
HETATM   69  H   UNL     1      -5.122   0.565   2.212  1.00  0.00           H  
HETATM   70  H   UNL     1      -2.320  -0.682   1.273  1.00  0.00           H  
HETATM   71  H   UNL     1       3.984  -0.272   0.422  1.00  0.00           H  
CONECT    1   14   36   37   38                                       
CONECT    2    3   16   36   39                                       
CONECT    3    2    4   40   41                                       
CONECT    4    3    5    5   15                                       
CONECT    5    4    4    6   42                                       
CONECT    6    5    7    7   43                                       
CONECT    7    6    6    8   44                                       
CONECT    8   15   15    7   45                                       
CONECT    9   10   46   47   48                                       
CONECT   10    9   12   33   11                                       
CONECT   11   10   49   50   51                                       
CONECT   12   10   52   53   54                                       
CONECT   13   33   30   34   34                                       
CONECT   14   23   30    1   55                                       
CONECT   15    4    8    8   56                                       
CONECT   16    2   31   35   35                                       
CONECT   17   18   31   57   58                                       
CONECT   18   22   22   19   17                                       
CONECT   19   32   32   18   59                                       
CONECT   20   21   21   32   60                                       
CONECT   21   20   20   22   61                                       
CONECT   22   21   18   18   62                                       
CONECT   23   24   14   63   64                                       
CONECT   24   25   23   29   29                                       
CONECT   25   26   26   24   65                                       
CONECT   26   25   25   27   66                                       
CONECT   27   26   28   28   67                                       
CONECT   28   27   27   29   68                                       
CONECT   29   24   24   28   69                                       
CONECT   30   13   14   70                                            
CONECT   31   17   16   71                                            
CONECT   32   20   19   19                                            
CONECT   33   10   13                                                 
CONECT   34   13   13                                                 
CONECT   35   16   16                                                 
CONECT   36    1    2                                                 
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    3                                                      
CONECT   41    3                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47    9                                                      
CONECT   48    9                                                      
CONECT   49   11                                                      
CONECT   50   11                                                      
CONECT   51   11                                                      
CONECT   52   12                                                      
CONECT   53   12                                                      
CONECT   54   12                                                      
CONECT   55   14                                                      
CONECT   56   15                                                      
CONECT   57   17                                                      
CONECT   58   17                                                      
CONECT   59   19                                                      
CONECT   60   20                                                      
CONECT   61   21                                                      
CONECT   62   22                                                      
CONECT   63   23                                                      
CONECT   64   23                                                      
CONECT   65   25                                                      
CONECT   66   26                                                      
CONECT   67   27                                                      
CONECT   68   28                                                      
CONECT   69   29                                                      
CONECT   70   30                                                      
CONECT   71   31                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
