COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK A   1      -2.339   0.996   0.138  1.00  0.00           N  
HETATM    2  C   UNK A   1      -2.605  -1.320   0.911  1.00  0.00           C  
HETATM    3  C   UNK A   1      -2.241  -2.178  -0.302  1.00  0.00           C  
HETATM    4  C   UNK A   1      -1.206  -4.629  -1.293  1.00  0.00           C  
HETATM    5  C   UNK A   0      -0.307   5.631  -0.553  1.00  0.00           C  
HETATM    6  C   UNK A   0      -1.036   0.798   0.136  1.00  0.00           C  
HETATM    7  C   UNK A   0       1.819   0.311   0.141  1.00  0.00           C  
HETATM    8  C   UNK A   0      -0.660   3.204  -0.202  1.00  0.00           C  
HETATM    9  C   UNK A   0      -0.157   1.889  -0.033  1.00  0.00           C  
HETATM   10  C   UNK A   0       1.243   1.693  -0.036  1.00  0.00           C  
HETATM   11  C   UNK A   0       2.061   2.758  -0.200  1.00  0.00           C  
HETATM   12  C   UNK A   1      -4.542   0.176   0.333  1.00  0.00           C  
HETATM   13  C   UNK A   1      -3.161   0.000   0.444  1.00  0.00           C  
HETATM   14  C   UNK A   1      -0.623  -6.010  -0.985  1.00  0.00           C  
HETATM   15  C   UNK A   0       0.214   4.230  -0.366  1.00  0.00           C  
HETATM   16  N   UNK A   0       1.554   4.005  -0.359  1.00  0.00           N  
HETATM   17  O   UNK A   0       3.858  -1.617   1.515  1.00  0.00           O  
HETATM   18  O   UNK A   0       5.733  -0.449   0.294  1.00  0.00           O  
HETATM   19  O   UNK A   0      -2.000   3.433  -0.205  1.00  0.00           O  
HETATM   20  O   UNK A   0       3.958  -1.902  -0.991  1.00  0.00           O  
HETATM   21  O   UNK A   0       3.245   0.381   0.100  1.00  0.00           O  
HETATM   22  O   UNK A   1      -5.041   1.360  -0.087  1.00  0.00           O  
HETATM   23  O   UNK A   1      -5.297  -0.740   0.614  1.00  0.00           O  
HETATM   24  P   UNK A   0       4.191  -0.912   0.257  1.00  0.00           P  
HETATM   25  S   UNK A   1      -1.571  -3.767   0.261  1.00  0.00           S  
HETATM   26  H   UNK A   1      -3.353  -1.838   1.512  1.00  0.00           H  
HETATM   27  H   UNK A   1      -1.713  -1.146   1.513  1.00  0.00           H  
HETATM   28  H   UNK A   1      -3.133  -2.353  -0.904  1.00  0.00           H  
HETATM   29  H   UNK A   1      -1.493  -1.661  -0.902  1.00  0.00           H  
HETATM   30  H   UNK A   1      -0.483  -4.050  -1.868  1.00  0.00           H  
HETATM   31  H   UNK A   1      -2.123  -4.743  -1.870  1.00  0.00           H  
HETATM   32  H   UNK A   0      -0.409   6.113   0.420  1.00  0.00           H  
HETATM   33  H   UNK A   0       0.391   6.200  -1.167  1.00  0.00           H  
HETATM   34  H   UNK A   0      -1.278   5.596  -1.045  1.00  0.00           H  
HETATM   35  H   UNK A   0      -0.642  -0.199   0.264  1.00  0.00           H  
HETATM   36  H   UNK A   0       1.502  -0.094   1.102  1.00  0.00           H  
HETATM   37  H   UNK A   0       1.464  -0.336  -0.661  1.00  0.00           H  
HETATM   38  H   UNK A   0       3.131   2.613  -0.203  1.00  0.00           H  
HETATM   39  H   UNK A   1      -0.403  -6.528  -1.919  1.00  0.00           H  
HETATM   40  H   UNK A   1       0.294  -5.897  -0.408  1.00  0.00           H  
HETATM   41  H   UNK A   1      -1.345  -6.589  -0.410  1.00  0.00           H  
HETATM   42  H   UNK A   0       6.361  -1.178   0.387  1.00  0.00           H  
HETATM   43  H   UNK A   0      -2.239   4.362  -0.326  1.00  0.00           H  
HETATM   44  H   UNK A   0       4.157  -1.506  -1.850  1.00  0.00           H  
HETATM   45  H   UNK A   1      -6.007   1.386  -0.132  1.00  0.00           H  
HETATM   46  H   UNK A   0       2.161   4.753  -0.474  1.00  0.00           H  
CONECT    1    6   13   13                                            
CONECT    2   13    3   26   27                                       
CONECT    3    2   25   28   29                                       
CONECT    4   25   14   30   31                                       
CONECT    5   15   32   33   34                                       
CONECT    6    9    9    1   35                                       
CONECT    7   10   21   36   37                                       
CONECT    8   15   15   19    9                                       
CONECT    9    8   10    6    6                                       
CONECT   10   11   11    9    7                                       
CONECT   11   16   10   10   38                                       
CONECT   12   23   23   13   22                                       
CONECT   13    1    1   12    2                                       
CONECT   14    4   39   40   41                                       
CONECT   15    5   16    8    8                                       
CONECT   16   15   11   46                                            
CONECT   17   24   24                                                 
CONECT   18   24   42                                                 
CONECT   19    8   43                                                 
CONECT   20   24   44                                                 
CONECT   21    7   24                                                 
CONECT   22   12   45                                                 
CONECT   23   12   12                                                 
CONECT   24   21   17   17   20                                       
CONECT   24   18                                                      
CONECT   25    3    4                                                 
CONECT   26    2                                                      
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38   11                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   18                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   22                                                      
CONECT   46   16                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
