COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.181  -4.073  -1.851  1.00  0.00           N  
HETATM    2  N   UNL     1       0.060  -1.282   2.340  1.00  0.00           N  
HETATM    3  C   UNL     1      -2.038  -0.534   1.062  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.961   1.706   0.986  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.868  -0.951   1.775  1.00  0.00           C  
HETATM    6  N   UNL     1      -2.207  -3.353  -1.229  1.00  0.00           N  
HETATM    7  C   UNL     1      -2.423  -1.084  -0.130  1.00  0.00           C  
HETATM    8  O   UNL     1       4.426  -1.997   0.242  1.00  0.00           O  
HETATM    9  C   UNL     1      -4.004   0.733   0.675  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.698  -2.152  -0.826  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.935   0.515   1.544  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.356  -2.135  -1.204  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.843   1.284   2.721  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.853   2.446   2.140  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.587  -3.808  -1.041  1.00  0.00           C  
HETATM   16  C   UNL     1       0.607  -1.033  -0.976  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.087  -3.359  -1.839  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.792   2.234   3.007  1.00  0.00           C  
HETATM   19  C   UNL     1       0.267   0.266  -1.335  1.00  0.00           C  
HETATM   20  C   UNL     1       1.852  -1.306  -0.395  1.00  0.00           C  
HETATM   21  C   UNL     1       1.179   1.296  -1.116  1.00  0.00           C  
HETATM   22  C   UNL     1       2.751  -0.305  -0.171  1.00  0.00           C  
HETATM   23  C   UNL     1       2.436   1.005  -0.534  1.00  0.00           C  
HETATM   24  C   UNL     1       4.089  -0.616   0.449  1.00  0.00           C  
HETATM   25  C   UNL     1       0.877   2.683  -1.474  1.00  0.00           C  
HETATM   26  C   UNL     1       3.371   2.115  -0.314  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.451   3.029  -2.095  1.00  0.00           C  
HETATM   28  C   UNL     1       4.022  -0.443   1.987  1.00  0.00           C  
HETATM   29  C   UNL     1       5.104  -2.513   1.393  1.00  0.00           C  
HETATM   30  C   UNL     1       5.173  -1.382   2.440  1.00  0.00           C  
HETATM   31  N   UNL     1       1.755   3.616  -1.255  1.00  0.00           N  
HETATM   32  N   UNL     1       3.003   3.358  -0.689  1.00  0.00           N  
HETATM   33  N   UNL     1      -0.508   4.473  -2.358  1.00  0.00           N  
HETATM   34  O   UNL     1       4.458   1.918   0.199  1.00  0.00           O  
HETATM   35  S   UNL     1      -3.899  -0.342  -0.713  1.00  0.00           S  
HETATM   36  H   UNL     1      -5.790   1.877   0.314  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.020   1.126   3.403  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.597   3.194   2.371  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.692  -4.251  -0.051  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.266  -2.960  -1.134  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.830  -4.553  -1.800  1.00  0.00           H  
HETATM   42  H   UNL     1       0.866  -3.660  -2.250  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.712   2.818   3.912  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.696   0.476  -1.778  1.00  0.00           H  
HETATM   45  H   UNL     1       2.103  -2.321  -0.122  1.00  0.00           H  
HETATM   46  H   UNL     1       4.860   0.029   0.027  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.567   2.484  -3.032  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.255   2.752  -1.412  1.00  0.00           H  
HETATM   49  H   UNL     1       4.221   0.590   2.275  1.00  0.00           H  
HETATM   50  H   UNL     1       3.062  -0.779   2.379  1.00  0.00           H  
HETATM   51  H   UNL     1       4.551  -3.360   1.799  1.00  0.00           H  
HETATM   52  H   UNL     1       6.112  -2.826   1.119  1.00  0.00           H  
HETATM   53  H   UNL     1       6.133  -0.868   2.394  1.00  0.00           H  
HETATM   54  H   UNL     1       4.986  -1.769   3.442  1.00  0.00           H  
HETATM   55  H   UNL     1       3.618   4.095  -0.545  1.00  0.00           H  
HETATM   56  H   UNL     1       0.264   4.766  -2.937  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.390   4.730  -2.775  1.00  0.00           H  
CONECT    1   17   17    6                                            
CONECT    2    5    5    5                                            
CONECT    3    5   11    7    7                                       
CONECT    4    9    9   14   36                                       
CONECT    5    2    2    2    3                                       
CONECT    6    1   10   15                                            
CONECT    7    3    3   10   35                                       
CONECT    8   29   24                                                 
CONECT    9   11   35    4    4                                       
CONECT   10   12   12    6    7                                       
CONECT   11   13   13    3    9                                       
CONECT   12   16   17   10   10                                       
CONECT   13   11   11   18   37                                       
CONECT   14   18   18    4   38                                       
CONECT   15    6   39   40   41                                       
CONECT   16   20   20   19   12                                       
CONECT   17   12    1    1   42                                       
CONECT   18   13   14   14   43                                       
CONECT   19   21   21   16   44                                       
CONECT   20   22   16   16   45                                       
CONECT   21   23   25   19   19                                       
CONECT   22   24   23   23   20                                       
CONECT   23   26   22   22   21                                       
CONECT   24    8   22   28   46                                       
CONECT   25   31   31   21   27                                       
CONECT   26   34   34   23   32                                       
CONECT   27   25   33   47   48                                       
CONECT   28   24   30   49   50                                       
CONECT   29    8   30   51   52                                       
CONECT   30   29   28   53   54                                       
CONECT   31   32   25   25                                            
CONECT   32   26   31   55                                            
CONECT   33   27   56   57                                            
CONECT   34   26   26                                                 
CONECT   35    7    9                                                 
CONECT   36    4                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   24                                                      
CONECT   47   27                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
CONECT   52   29                                                      
CONECT   53   30                                                      
CONECT   54   30                                                      
CONECT   55   32                                                      
CONECT   56   33                                                      
CONECT   57   33                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
