COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.937   3.770   0.724  1.00  0.00           C  
HETATM    2  O   UNL     1      -5.940   3.079  -0.022  1.00  0.00           O  
HETATM    3  C   UNL     1      -5.760   1.744  -0.210  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.645   1.113   0.317  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.698   1.008  -0.928  1.00  0.00           C  
HETATM    6  O   UNL     1      -7.797   1.622  -1.443  1.00  0.00           O  
HETATM    7  C   UNL     1      -8.717   0.803  -2.168  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.510  -0.352  -1.116  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.392  -0.974  -0.592  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.463  -0.244   0.125  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.250  -0.929   0.699  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.309  -2.424   0.381  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.585  -3.022   0.978  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.314  -2.623  -1.136  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.224  -0.738   2.159  1.00  0.00           C  
HETATM   16  N   UNL     1      -3.203  -0.591   3.285  1.00  0.00           N  
HETATM   17  C   UNL     1      -1.985  -0.326   0.084  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.753  -1.022   0.667  1.00  0.00           C  
HETATM   19  C   UNL     1       0.511  -0.419   0.051  1.00  0.00           C  
HETATM   20  N   UNL     1       1.694  -1.087   0.611  1.00  0.00           N  
HETATM   21  C   UNL     1       1.745  -2.497   0.204  1.00  0.00           C  
HETATM   22  C   UNL     1       2.926  -0.384   0.228  1.00  0.00           C  
HETATM   23  C   UNL     1       4.104  -0.950   1.022  1.00  0.00           C  
HETATM   24  C   UNL     1       5.368  -0.229   0.629  1.00  0.00           C  
HETATM   25  C   UNL     1       6.137  -0.704  -0.417  1.00  0.00           C  
HETATM   26  C   UNL     1       5.753   0.910   1.312  1.00  0.00           C  
HETATM   27  C   UNL     1       6.911   1.575   0.955  1.00  0.00           C  
HETATM   28  C   UNL     1       7.689   1.101  -0.089  1.00  0.00           C  
HETATM   29  O   UNL     1       8.828   1.755  -0.441  1.00  0.00           O  
HETATM   30  C   UNL     1       9.164   2.924   0.309  1.00  0.00           C  
HETATM   31  C   UNL     1       7.298  -0.042  -0.780  1.00  0.00           C  
HETATM   32  O   UNL     1       8.056  -0.509  -1.809  1.00  0.00           O  
HETATM   33  C   UNL     1       7.594  -1.687  -2.472  1.00  0.00           C  
HETATM   34  H   UNL     1      -5.202   4.825   0.800  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.867   3.341   1.724  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.976   3.673   0.219  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.918   1.681   0.878  1.00  0.00           H  
HETATM   38  H   UNL     1      -8.208   0.351  -3.019  1.00  0.00           H  
HETATM   39  H   UNL     1      -9.099   0.019  -1.514  1.00  0.00           H  
HETATM   40  H   UNL     1      -9.546   1.416  -2.523  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.236  -0.925  -1.673  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.246  -2.034  -0.740  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.440  -2.922   0.810  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.415  -2.330   0.829  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.808  -3.968   0.485  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.442  -3.193   2.045  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.294  -2.556  -1.514  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.726  -3.604  -1.372  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.926  -1.851  -1.602  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.005  -0.468  -0.997  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.942   0.739   0.310  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.734  -0.881   1.747  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.796  -2.087   0.440  1.00  0.00           H  
HETATM   54  H   UNL     1       0.492  -0.561  -1.030  1.00  0.00           H  
HETATM   55  H   UNL     1       0.554   0.646   0.278  1.00  0.00           H  
HETATM   56  H   UNL     1       1.790  -2.560  -0.884  1.00  0.00           H  
HETATM   57  H   UNL     1       2.630  -2.967   0.632  1.00  0.00           H  
HETATM   58  H   UNL     1       0.852  -3.011   0.561  1.00  0.00           H  
HETATM   59  H   UNL     1       3.107  -0.522  -0.838  1.00  0.00           H  
HETATM   60  H   UNL     1       2.819   0.679   0.443  1.00  0.00           H  
HETATM   61  H   UNL     1       3.924  -0.812   2.088  1.00  0.00           H  
HETATM   62  H   UNL     1       4.211  -2.013   0.807  1.00  0.00           H  
HETATM   63  H   UNL     1       5.832  -1.592  -0.951  1.00  0.00           H  
HETATM   64  H   UNL     1       5.148   1.280   2.126  1.00  0.00           H  
HETATM   65  H   UNL     1       7.210   2.465   1.490  1.00  0.00           H  
HETATM   66  H   UNL     1       8.364   3.658   0.215  1.00  0.00           H  
HETATM   67  H   UNL     1       9.291   2.658   1.359  1.00  0.00           H  
HETATM   68  H   UNL     1      10.093   3.346  -0.073  1.00  0.00           H  
HETATM   69  H   UNL     1       7.535  -2.507  -1.756  1.00  0.00           H  
HETATM   70  H   UNL     1       6.607  -1.503  -2.895  1.00  0.00           H  
HETATM   71  H   UNL     1       8.288  -1.951  -3.270  1.00  0.00           H  
CONECT    1    2   34   35   36                                       
CONECT    2    1    3                                                 
CONECT    3    2    4    4    5                                       
CONECT    4    3    3   10   37                                       
CONECT    5    3    6    8    8                                       
CONECT    6    5    7                                                 
CONECT    7    6   38   39   40                                       
CONECT    8    5    5    9   41                                       
CONECT    9   10   10    8   42                                       
CONECT   10    4   11    9    9                                       
CONECT   11   15   17   10   12                                       
CONECT   12   11   13   14   43                                       
CONECT   13   12   44   45   46                                       
CONECT   14   12   47   48   49                                       
CONECT   15   16   16   16   11                                       
CONECT   16   15   15   15                                            
CONECT   17   18   11   50   51                                       
CONECT   18   19   17   52   53                                       
CONECT   19   20   18   54   55                                       
CONECT   20   22   21   19                                            
CONECT   21   20   56   57   58                                       
CONECT   22   23   20   59   60                                       
CONECT   23   24   22   61   62                                       
CONECT   24   25   23   26   26                                       
CONECT   25   31   31   24   63                                       
CONECT   26   24   24   27   64                                       
CONECT   27   28   28   26   65                                       
CONECT   28   31   29   27   27                                       
CONECT   29   28   30                                                 
CONECT   30   29   66   67   68                                       
CONECT   31   32   25   25   28                                       
CONECT   32   33   31                                                 
CONECT   33   32   69   70   71                                       
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    4                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   13                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   14                                                      
CONECT   49   14                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   18                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   21                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   23                                                      
CONECT   63   25                                                      
CONECT   64   26                                                      
CONECT   65   27                                                      
CONECT   66   30                                                      
CONECT   67   30                                                      
CONECT   68   30                                                      
CONECT   69   33                                                      
CONECT   70   33                                                      
CONECT   71   33                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
