COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.520  -0.735   2.462  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.762  -0.196   0.334  1.00  0.00           C  
HETATM    3  C   UNL     1       4.752  -0.937   1.920  1.00  0.00           C  
HETATM    4  C   UNL     1       4.927  -0.859   0.528  1.00  0.00           C  
HETATM    5  C   UNL     1       3.814  -0.571  -0.300  1.00  0.00           C  
HETATM    6  C   UNL     1       6.188  -1.063  -0.060  1.00  0.00           C  
HETATM    7  C   UNL     1       6.321  -0.981  -1.412  1.00  0.00           C  
HETATM    8  C   UNL     1       5.226  -0.698  -2.226  1.00  0.00           C  
HETATM    9  C   UNL     1       3.991  -0.489  -1.690  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.861   0.779  -0.805  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.720  -0.503  -0.774  1.00  0.00           C  
HETATM   12  N   UNL     1       1.438  -0.082  -0.506  1.00  0.00           N  
HETATM   13  N   UNL     1      -1.673   1.863  -0.232  1.00  0.00           N  
HETATM   14  C   UNL     1       2.418  -0.458   1.659  1.00  0.00           C  
HETATM   15  C   UNL     1       0.387   0.581   0.015  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.033  -0.974   0.110  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.547  -1.764   1.121  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.712  -2.479   0.916  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.364  -2.402  -0.301  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.851  -1.611  -1.312  1.00  0.00           C  
HETATM   21  C   UNL     1       2.549  -0.367   0.290  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.689  -0.893  -1.104  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.997   1.322   0.128  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.274   3.139  -0.063  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.215   4.149   0.540  1.00  0.00           C  
HETATM   26  O   UNL     1       0.446   1.018   1.145  1.00  0.00           O  
HETATM   27  O   UNL     1      -0.157   3.474  -0.397  1.00  0.00           O  
HETATM   28  H   UNL     1       3.394  -0.797   3.533  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.352  -0.397   1.323  1.00  0.00           H  
HETATM   30  H   UNL     1       5.595  -1.156   2.559  1.00  0.00           H  
HETATM   31  H   UNL     1       7.046  -1.283   0.557  1.00  0.00           H  
HETATM   32  H   UNL     1       7.291  -1.138  -1.862  1.00  0.00           H  
HETATM   33  H   UNL     1       5.359  -0.633  -3.295  1.00  0.00           H  
HETATM   34  H   UNL     1       3.151  -0.270  -2.332  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.594   1.021  -1.834  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.113  -1.367  -0.503  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.212  -0.661  -1.733  1.00  0.00           H  
HETATM   38  H   UNL     1       1.423  -0.362  -1.435  1.00  0.00           H  
HETATM   39  H   UNL     1       1.450  -0.306   2.114  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.037  -1.824   2.071  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.113  -3.096   1.706  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.275  -2.961  -0.462  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.360  -1.552  -2.262  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.288  -0.275  -1.894  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.708   1.489  -0.681  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.355   1.779   1.050  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.164   3.667   0.774  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.778   4.553   1.453  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.384   4.958  -0.171  1.00  0.00           H  
CONECT    1    3   14   14   28                                       
CONECT    2   16   23   11   29                                       
CONECT    3    4    4    1   30                                       
CONECT    4    5    6    3    3                                       
CONECT    5    9   21   21    4                                       
CONECT    6    7    7    4   31                                       
CONECT    7    8    6    6   32                                       
CONECT    8    9    9    7   33                                       
CONECT    9    8    8    5   34                                       
CONECT   10   11   13   15   35                                       
CONECT   11    2   10   36   37                                       
CONECT   12   15   21   38                                            
CONECT   13   23   10   24                                            
CONECT   14   21    1    1   39                                       
CONECT   15   26   26   10   12                                       
CONECT   16   17   17   22    2                                       
CONECT   17   18   16   16   40                                       
CONECT   18   19   19   17   41                                       
CONECT   19   18   18   20   42                                       
CONECT   20   19   22   22   43                                       
CONECT   21    5    5   12   14                                       
CONECT   22   20   20   16   44                                       
CONECT   23    2   13   45   46                                       
CONECT   24   13   25   27   27                                       
CONECT   25   24   47   48   49                                       
CONECT   26   15   15                                                 
CONECT   27   24   24                                                 
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   14                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   25                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
