COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK     1      -3.126   0.255  -5.832  1.00  0.00           C  
HETATM    2  N   UNK     1      -4.079   1.070  -6.408  1.00  0.00           N  
HETATM    3  C   UNK     1      -3.081  -1.014  -6.136  1.00  0.00           C  
HETATM    4  O   UNK     1      -3.039  -2.188  -6.417  1.00  0.00           O  
HETATM    5  C   UNK     1      -2.136   0.831  -4.852  1.00  0.00           C  
HETATM    6  O   UNK     1      -1.259  -0.201  -4.398  1.00  0.00           O  
HETATM    7  P   UNK     1      -0.234   0.480  -3.361  1.00  0.00           P  
HETATM    8  O   UNK     1      -1.058   1.112  -2.130  1.00  0.00           O  
HETATM    9  O   UNK     1       0.524   1.550  -4.047  1.00  0.00           O  
HETATM   10  O   UNK     1       0.788  -0.632  -2.807  1.00  0.00           O  
HETATM   11  C   UNK     1       2.670  -0.976  -1.330  1.00  0.00           C  
HETATM   12  C   UNK     1       1.667   0.031  -1.896  1.00  0.00           C  
HETATM   13  C   UNK     1       1.918  -2.087  -0.596  1.00  0.00           C  
HETATM   14  C   UNK     1       3.485  -1.582  -2.475  1.00  0.00           C  
HETATM   15  C   UNK     1       3.611  -0.265  -0.355  1.00  0.00           C  
HETATM   16  O   UNK     1       4.412   0.678  -1.068  1.00  0.00           O  
HETATM   17  C   UNK     1       2.800   0.452   0.691  1.00  0.00           C  
HETATM   18  O   UNK     1       2.744   1.664   0.689  1.00  0.00           O  
HETATM   19  N   UNK     1       2.136  -0.250   1.630  1.00  0.00           N  
HETATM   20  C   UNK     1       1.414   0.448   2.695  1.00  0.00           C  
HETATM   21  C   UNK     1       0.753  -0.575   3.620  1.00  0.00           C  
HETATM   22  C   UNK     1       0.010   0.144   4.716  1.00  0.00           C  
HETATM   23  O   UNK     1       0.009   1.356   4.754  1.00  0.00           O  
HETATM   24  N   UNK     1      -0.653  -0.559   5.655  1.00  0.00           N  
HETATM   25  C   UNK     1      -1.375   0.139   6.720  1.00  0.00           C  
HETATM   26  C   UNK     1      -2.036  -0.884   7.645  1.00  0.00           C  
HETATM   27  S   UNK     1      -2.931  -0.018   8.965  1.00  0.00           S  
HETATM   28  H   UNK     1      -4.716   0.699  -7.039  1.00  0.00           H  
HETATM   29  H   UNK     1      -4.113   2.012  -6.182  1.00  0.00           H  
HETATM   30  H   UNK     1      -2.671   1.253  -4.001  1.00  0.00           H  
HETATM   31  H   UNK     1      -1.554   1.613  -5.340  1.00  0.00           H  
HETATM   32  H   UNK     1      -1.536   0.383  -1.711  1.00  0.00           H  
HETATM   33  H   UNK     1       1.087   0.462  -1.081  1.00  0.00           H  
HETATM   34  H   UNK     1       2.203   0.822  -2.420  1.00  0.00           H  
HETATM   35  H   UNK     1       1.244  -1.646   0.137  1.00  0.00           H  
HETATM   36  H   UNK     1       1.343  -2.672  -1.313  1.00  0.00           H  
HETATM   37  H   UNK     1       2.633  -2.735  -0.088  1.00  0.00           H  
HETATM   38  H   UNK     1       4.073  -0.800  -2.956  1.00  0.00           H  
HETATM   39  H   UNK     1       4.153  -2.348  -2.080  1.00  0.00           H  
HETATM   40  H   UNK     1       2.810  -2.029  -3.204  1.00  0.00           H  
HETATM   41  H   UNK     1       4.257  -0.999   0.125  1.00  0.00           H  
HETATM   42  H   UNK     1       3.803   1.308  -1.478  1.00  0.00           H  
HETATM   43  H   UNK     1       2.137  -1.220   1.600  1.00  0.00           H  
HETATM   44  H   UNK     1       2.113   1.058   3.268  1.00  0.00           H  
HETATM   45  H   UNK     1       0.649   1.088   2.256  1.00  0.00           H  
HETATM   46  H   UNK     1       0.054  -1.185   3.047  1.00  0.00           H  
HETATM   47  H   UNK     1       1.518  -1.215   4.059  1.00  0.00           H  
HETATM   48  H   UNK     1      -0.652  -1.529   5.625  1.00  0.00           H  
HETATM   49  H   UNK     1      -0.676   0.749   7.294  1.00  0.00           H  
HETATM   50  H   UNK     1      -2.140   0.779   6.281  1.00  0.00           H  
HETATM   51  H   UNK     1      -2.735  -1.493   7.072  1.00  0.00           H  
HETATM   52  H   UNK     1      -1.271  -1.524   8.085  1.00  0.00           H  
HETATM   53  H   UNK     1      -3.422  -1.070   9.644  1.00  0.00           H  
CONECT    1    2    3    3    5                                       
CONECT    2    1   28   29                                            
CONECT    3    1    1    4    4                                       
CONECT    4    3    3                                                 
CONECT    5    1    6   30   31                                       
CONECT    6    5    7                                                 
CONECT    7    6    8    9    9                                       
CONECT    7   10                                                      
CONECT    8    7   32                                                 
CONECT    9    7    7                                                 
CONECT   10    7   12                                                 
CONECT   11   12   13   14   15                                       
CONECT   12   10   11   33   34                                       
CONECT   13   11   35   36   37                                       
CONECT   14   11   38   39   40                                       
CONECT   15   11   16   17   41                                       
CONECT   16   15   42                                                 
CONECT   17   15   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   20   43                                            
CONECT   20   19   21   44   45                                       
CONECT   21   20   22   46   47                                       
CONECT   22   21   23   23   24                                       
CONECT   23   22   22                                                 
CONECT   24   22   25   48                                            
CONECT   25   24   26   49   50                                       
CONECT   26   25   27   51   52                                       
CONECT   27   26   53                                                 
CONECT   28    2                                                      
CONECT   29    2                                                      
CONECT   30    5                                                      
CONECT   31    5                                                      
CONECT   32    8                                                      
CONECT   33   12                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   26                                                      
CONECT   53   27                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
