COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.773  -0.046  -3.929  1.00  0.00           C  
HETATM    2  C   UNL     1       0.509   0.370  -4.275  1.00  0.00           C  
HETATM    3  C   UNL     1       1.487   0.418  -3.320  1.00  0.00           C  
HETATM    4  C   UNL     1       1.162   0.031  -2.009  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.146  -0.376  -1.731  1.00  0.00           C  
HETATM    6  N   UNL     1      -1.055  -0.402  -2.682  1.00  0.00           N  
HETATM    7  C   UNL     1       2.178   0.060  -0.947  1.00  0.00           C  
HETATM    8  C   UNL     1       1.852  -0.309   0.308  1.00  0.00           C  
HETATM    9  C   UNL     1       2.862  -0.280   1.365  1.00  0.00           C  
HETATM   10  O   UNL     1       3.971   0.165   1.134  1.00  0.00           O  
HETATM   11  N   UNL     1       2.566  -0.747   2.594  1.00  0.00           N  
HETATM   12  C   UNL     1       3.536  -0.610   3.683  1.00  0.00           C  
HETATM   13  C   UNL     1       1.273  -1.391   2.841  1.00  0.00           C  
HETATM   14  C   UNL     1       0.268  -0.352   3.268  1.00  0.00           C  
HETATM   15  C   UNL     1       0.491   0.963   3.410  1.00  0.00           C  
HETATM   16  N   UNL     1      -0.656   1.590   3.812  1.00  0.00           N  
HETATM   17  C   UNL     1      -1.671   0.669   3.943  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.138  -0.587   3.602  1.00  0.00           C  
HETATM   19  N   UNL     1      -1.768  -0.088  -4.900  1.00  0.00           N  
HETATM   20  C   UNL     1      -0.785   3.027   4.066  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.258  -1.607   4.018  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.791  -0.369   4.349  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.008   0.764   4.314  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.947  -1.723   3.651  1.00  0.00           C  
HETATM   25  C   UNL     1       0.815   0.771  -5.694  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.015  -0.081  -6.654  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.452  -0.099  -6.207  1.00  0.00           C  
HETATM   28  O   UNL     1      -2.336  -0.123  -7.036  1.00  0.00           O  
HETATM   29  H   UNL     1       2.487   0.743  -3.569  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.412  -0.673  -0.728  1.00  0.00           H  
HETATM   31  H   UNL     1       3.186   0.377  -1.172  1.00  0.00           H  
HETATM   32  H   UNL     1       0.844  -0.625   0.533  1.00  0.00           H  
HETATM   33  H   UNL     1       4.464  -0.192   3.293  1.00  0.00           H  
HETATM   34  H   UNL     1       3.132   0.051   4.449  1.00  0.00           H  
HETATM   35  H   UNL     1       3.734  -1.590   4.118  1.00  0.00           H  
HETATM   36  H   UNL     1       0.929  -1.876   1.927  1.00  0.00           H  
HETATM   37  H   UNL     1       1.383  -2.136   3.629  1.00  0.00           H  
HETATM   38  H   UNL     1       1.436   1.454   3.233  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.700  -0.111  -4.632  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.079   3.533   3.147  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.543   3.194   4.831  1.00  0.00           H  
HETATM   42  H   UNL     1       0.170   3.423   4.409  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.885  -2.486   4.050  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.829  -0.293   4.638  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.432   1.723   4.574  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.540  -2.690   3.395  1.00  0.00           H  
HETATM   47  H   UNL     1       1.875   0.615  -5.895  1.00  0.00           H  
HETATM   48  H   UNL     1       0.569   1.823  -5.836  1.00  0.00           H  
HETATM   49  H   UNL     1       0.373  -1.099  -6.665  1.00  0.00           H  
HETATM   50  H   UNL     1       0.046   0.339  -7.658  1.00  0.00           H  
CONECT    1    2    6    6   19                                       
CONECT    2    1    3    3   25                                       
CONECT    3    2    2    4   29                                       
CONECT    4    3    5    5    7                                       
CONECT    5    4    4    6   30                                       
CONECT    6    1    1    5                                            
CONECT    7    4    8    8   31                                       
CONECT    8    7    7    9   32                                       
CONECT    9    8   10   10   11                                       
CONECT   10    9    9                                                 
CONECT   11    9   12   13                                            
CONECT   12   11   33   34   35                                       
CONECT   13   11   14   36   37                                       
CONECT   14   13   15   15   18                                       
CONECT   15   14   14   16   38                                       
CONECT   16   15   17   20                                            
CONECT   17   16   18   23   23                                       
CONECT   18   14   17   24   24                                       
CONECT   19    1   27   39                                            
CONECT   20   16   40   41   42                                       
CONECT   21   22   22   24   43                                       
CONECT   22   21   21   23   44                                       
CONECT   23   17   17   22   45                                       
CONECT   24   18   18   21   46                                       
CONECT   25    2   26   47   48                                       
CONECT   26   25   27   49   50                                       
CONECT   27   19   26   28   28                                       
CONECT   28   27   27                                                 
CONECT   29    3                                                      
CONECT   30    5                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33   12                                                      
CONECT   34   12                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   15                                                      
CONECT   39   19                                                      
CONECT   40   20                                                      
CONECT   41   20                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   26                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
