COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   0      -0.409  -3.788   0.042  1.00  0.00           C  
HETATM    2  C   UNK A   0      -0.159  -2.472   0.190  1.00  0.00           C  
HETATM    3  C   UNK A   0       1.988  -3.104   0.079  1.00  0.00           C  
HETATM    4  C   UNK A   0      -5.360   1.035  -0.052  1.00  0.00           C  
HETATM    5  C   UNK A   0      -8.043   0.482  -0.348  1.00  0.00           C  
HETATM    6  C   UNK A   0      -7.667   1.781  -0.273  1.00  0.00           C  
HETATM    7  C   UNK A   0      -5.800  -0.241  -0.133  1.00  0.00           C  
HETATM    8  C   UNK A   0      -6.292   2.094  -0.121  1.00  0.00           C  
HETATM    9  C   UNK A   1       0.754   2.541   0.042  1.00  0.00           C  
HETATM   10  C   UNK A   0      -1.237  -1.470   0.326  1.00  0.00           C  
HETATM   11  C   UNK A   1       5.391   0.999   0.927  1.00  0.00           C  
HETATM   12  C   UNK A   0      -0.903  -0.056   0.617  1.00  0.00           C  
HETATM   13  C   UNK A   1       6.738   1.000   1.527  1.00  0.00           C  
HETATM   14  C   UNK A   1       5.713   0.989  -2.867  1.00  0.00           C  
HETATM   15  C   UNK A   0      -4.811  -1.375  -0.060  1.00  0.00           C  
HETATM   16  C   UNK A   1       5.196   0.519  -0.488  1.00  0.00           C  
HETATM   17  C   UNK A   1       5.908   1.470  -1.452  1.00  0.00           C  
HETATM   18  C   UNK A   1       2.037   1.699   1.989  1.00  0.00           C  
HETATM   19  C   UNK A   1       0.687   1.671   1.270  1.00  0.00           C  
HETATM   20  N   UNK A   0       1.133  -2.139   0.206  1.00  0.00           N  
HETATM   21  N   UNK A   0      -2.482  -1.831   0.190  1.00  0.00           N  
HETATM   22  N   UNK A   1       4.377   1.411   1.615  1.00  0.00           N  
HETATM   23  N   UNK A   0      -7.119  -0.511  -0.279  1.00  0.00           N  
HETATM   24  N   UNK A   0       3.365  -2.955   0.072  1.00  0.00           N  
HETATM   25  N   UNK A   1       0.372   0.295   0.877  1.00  0.00           N  
HETATM   26  O   UNK A   1       7.702   0.696   0.854  1.00  0.00           O  
HETATM   27  O   UNK A   1       5.071  -0.012  -3.082  1.00  0.00           O  
HETATM   28  O   UNK A   0      -5.921   3.258  -0.049  1.00  0.00           O  
HETATM   29  O   UNK A   1       0.558   2.062  -1.049  1.00  0.00           O  
HETATM   30  O   UNK A   0      -1.778   0.787   0.621  1.00  0.00           O  
HETATM   31  O   UNK A   1       6.899   1.337   2.822  1.00  0.00           O  
HETATM   32  O   UNK A   1       6.253   1.672  -3.888  1.00  0.00           O  
HETATM   33  O   UNK A   0      -8.596   2.773  -0.343  1.00  0.00           O  
HETATM   34  O   UNK A   0      -7.544  -1.859  -0.360  1.00  0.00           O  
HETATM   35  O   UNK A   0      -3.508  -0.855   0.212  1.00  0.00           O  
HETATM   36  O   UNK A   1       3.070   1.311   1.080  1.00  0.00           O  
HETATM   37  S   UNK A   0       1.131  -4.634  -0.077  1.00  0.00           S  
HETATM   38  H   UNK A   0      -1.387  -4.246   0.007  1.00  0.00           H  
HETATM   39  H   UNK A   0      -4.307   1.242   0.069  1.00  0.00           H  
HETATM   40  H   UNK A   0      -9.088   0.234  -0.463  1.00  0.00           H  
HETATM   41  H   UNK A   1       0.977   3.593   0.137  1.00  0.00           H  
HETATM   42  H   UNK A   0      -5.102  -2.060   0.737  1.00  0.00           H  
HETATM   43  H   UNK A   0      -4.798  -1.908  -1.011  1.00  0.00           H  
HETATM   44  H   UNK A   1       5.613  -0.483  -0.592  1.00  0.00           H  
HETATM   45  H   UNK A   1       4.131   0.495  -0.720  1.00  0.00           H  
HETATM   46  H   UNK A   1       6.972   1.493  -1.219  1.00  0.00           H  
HETATM   47  H   UNK A   1       5.491   2.472  -1.348  1.00  0.00           H  
HETATM   48  H   UNK A   1       2.234   2.707   2.353  1.00  0.00           H  
HETATM   49  H   UNK A   1       2.016   1.006   2.830  1.00  0.00           H  
HETATM   50  H   UNK A   1      -0.088   2.044   1.939  1.00  0.00           H  
HETATM   51  H   UNK A   0       3.758  -2.074   0.167  1.00  0.00           H  
HETATM   52  H   UNK A   0       3.937  -3.733  -0.029  1.00  0.00           H  
HETATM   53  H   UNK A   1       1.081  -0.363   0.804  1.00  0.00           H  
HETATM   54  H   UNK A   1       7.801   1.323   3.170  1.00  0.00           H  
HETATM   55  H   UNK A   1       6.101   1.325  -4.778  1.00  0.00           H  
HETATM   56  H   UNK A   0      -8.220   3.664  -0.357  1.00  0.00           H  
HETATM   57  H   UNK A   0      -8.500  -1.964  -0.463  1.00  0.00           H  
CONECT    1   37    2    2   38                                       
CONECT    2   20   10    1    1                                       
CONECT    3   24   20   20   37                                       
CONECT    4    7    7    8   39                                       
CONECT    5   23    6    6   40                                       
CONECT    6    8    5    5   33                                       
CONECT    7   15    4    4   23                                       
CONECT    8    4   28   28    6                                       
CONECT    9   29   29   19   41                                       
CONECT   10    2   21   21   12                                       
CONECT   11   13   16   22   22                                       
CONECT   12   10   25   30   30                                       
CONECT   13   26   26   11   31                                       
CONECT   14   17   27   27   32                                       
CONECT   15   35    7   42   43                                       
CONECT   16   11   17   44   45                                       
CONECT   17   16   14   46   47                                       
CONECT   18   36   19   48   49                                       
CONECT   19   25    9   18   50                                       
CONECT   20    3    3    2                                            
CONECT   21   35   10   10                                            
CONECT   22   11   11   36                                            
CONECT   23    7   34    5                                            
CONECT   24    3   51   52                                            
CONECT   25   12   19   53                                            
CONECT   26   13   13                                                 
CONECT   27   14   14                                                 
CONECT   28    8    8                                                 
CONECT   29    9    9                                                 
CONECT   30   12   12                                                 
CONECT   31   13   54                                                 
CONECT   32   14   55                                                 
CONECT   33    6   56                                                 
CONECT   34   23   57                                                 
CONECT   35   21   15                                                 
CONECT   36   22   18                                                 
CONECT   37    3    1                                                 
CONECT   38    1                                                      
CONECT   39    4                                                      
CONECT   40    5                                                      
CONECT   41    9                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   17                                                      
CONECT   48   18                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   31                                                      
CONECT   55   32                                                      
CONECT   56   33                                                      
CONECT   57   34                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
