COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.673   1.671   0.036  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.022   0.443   0.243  1.00  0.00           C  
HETATM    3  C   UNL     1       0.026   1.497   0.155  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.930   2.802  -0.108  1.00  0.00           C  
HETATM    5  N   UNL     1      -0.711   0.392   0.296  1.00  0.00           N  
HETATM    6  C   UNL     1       1.411   1.720   0.170  1.00  0.00           C  
HETATM    7  C   UNL     1       1.610   3.091  -0.029  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.617   3.013  -0.237  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.831  -0.818   0.405  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.452  -1.254  -0.947  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.492  -3.181  -0.092  1.00  0.00           C  
HETATM   12  C   UNL     1       6.522  -1.485  -0.874  1.00  0.00           C  
HETATM   13  O   UNL     1       5.567  -0.458  -1.146  1.00  0.00           O  
HETATM   14  C   UNL     1       4.509  -0.361  -0.301  1.00  0.00           C  
HETATM   15  C   UNL     1       3.547   0.611  -0.517  1.00  0.00           C  
HETATM   16  N   UNL     1       4.406  -1.201   0.717  1.00  0.00           N  
HETATM   17  C   UNL     1       3.397  -1.149   1.568  1.00  0.00           C  
HETATM   18  C   UNL     1       2.400  -0.209   1.428  1.00  0.00           C  
HETATM   19  C   UNL     1       2.463   0.698   0.361  1.00  0.00           C  
HETATM   20  N   UNL     1       0.443   3.674  -0.158  1.00  0.00           N  
HETATM   21  N   UNL     1      -0.568   2.713  -0.048  1.00  0.00           N  
HETATM   22  O   UNL     1      -4.030   1.728  -0.025  1.00  0.00           O  
HETATM   23  C   UNL     1      -1.917  -2.021   0.744  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.897  -4.334   0.827  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.447  -3.662  -1.101  1.00  0.00           C  
HETATM   26  O   UNL     1      -3.645  -2.676  -0.786  1.00  0.00           O  
HETATM   27  H   UNL     1      -2.411   3.755  -0.268  1.00  0.00           H  
HETATM   28  H   UNL     1       2.569   3.587  -0.069  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.264   3.422  -1.184  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.702   2.917  -0.265  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.332   3.682   0.575  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.602  -0.689   1.164  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.406  -0.753  -1.110  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.765  -1.051  -1.768  1.00  0.00           H  
HETATM   35  H   UNL     1       6.952  -1.329   0.116  1.00  0.00           H  
HETATM   36  H   UNL     1       6.031  -2.457  -0.907  1.00  0.00           H  
HETATM   37  H   UNL     1       7.314  -1.452  -1.622  1.00  0.00           H  
HETATM   38  H   UNL     1       3.632   1.292  -1.352  1.00  0.00           H  
HETATM   39  H   UNL     1       3.352  -1.854   2.385  1.00  0.00           H  
HETATM   40  H   UNL     1       1.579  -0.174   2.128  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.888  -1.813   0.451  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.972  -2.254   1.808  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.022  -4.689   1.372  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.650  -3.987   1.535  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.308  -5.148   0.230  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.561  -4.007  -0.570  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.861  -4.482  -1.689  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.177  -2.840  -1.764  1.00  0.00           H  
CONECT    1   22    2    4    4                                       
CONECT    2    9    1    5    5                                       
CONECT    3    5   21    6    6                                       
CONECT    4    1    1   21   27                                       
CONECT    5    2    2    3                                            
CONECT    6    3    3    7   19                                       
CONECT    7   20   20    6   28                                       
CONECT    8   22   29   30   31                                       
CONECT    9   10    2   23   32                                       
CONECT   10    9   26   33   34                                       
CONECT   11   26   24   23   25                                       
CONECT   12   13   35   36   37                                       
CONECT   13   12   14                                                 
CONECT   14   15   13   16   16                                       
CONECT   15   19   19   14   38                                       
CONECT   16   14   14   17                                            
CONECT   17   18   18   16   39                                       
CONECT   18   19   17   17   40                                       
CONECT   19    6   15   15   18                                       
CONECT   20   21    7    7                                            
CONECT   21    4    3   20                                            
CONECT   22    8    1                                                 
CONECT   23    9   11   41   42                                       
CONECT   24   11   43   44   45                                       
CONECT   25   11   46   47   48                                       
CONECT   26   10   11                                                 
CONECT   27    4                                                      
CONECT   28    7                                                      
CONECT   29    8                                                      
CONECT   30    8                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   10                                                      
CONECT   35   12                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   15                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
CONECT   41   23                                                      
CONECT   42   23                                                      
CONECT   43   24                                                      
CONECT   44   24                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
