COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.365  -0.968  -1.705  1.00  0.00           O  
HETATM    2  C   UNL     1       3.740  -0.565  -0.616  1.00  0.00           C  
HETATM    3  C   UNL     1       4.600   0.626  -0.501  1.00  0.00           C  
HETATM    4  C   UNL     1       5.018   1.335  -1.627  1.00  0.00           C  
HETATM    5  C   UNL     1       5.816   2.434  -1.477  1.00  0.00           C  
HETATM    6  C   UNL     1       6.214   2.850  -0.213  1.00  0.00           C  
HETATM    7  C   UNL     1       5.812   2.164   0.912  1.00  0.00           C  
HETATM    8  C   UNL     1       4.999   1.041   0.782  1.00  0.00           C  
HETATM    9  N   UNL     1       4.580   0.333   1.886  1.00  0.00           N  
HETATM   10  C   UNL     1       3.788  -0.760   1.770  1.00  0.00           C  
HETATM   11  C   UNL     1       3.368  -1.486   3.022  1.00  0.00           C  
HETATM   12  C   UNL     1       3.358  -1.221   0.577  1.00  0.00           C  
HETATM   13  C   UNL     1       2.479  -2.444   0.516  1.00  0.00           C  
HETATM   14  C   UNL     1       1.033  -2.021   0.469  1.00  0.00           C  
HETATM   15  C   UNL     1       0.285  -2.358  -0.552  1.00  0.00           C  
HETATM   16  C   UNL     1       0.876  -3.145  -1.692  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.168  -1.957  -0.586  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.319  -0.653  -1.372  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.771  -0.253  -1.406  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.149   0.886  -0.880  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.139   1.776  -0.205  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.595   1.304  -0.950  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.309   0.891   0.339  1.00  0.00           C  
HETATM   24  O   UNL     1      -4.759   1.614   1.442  1.00  0.00           O  
HETATM   25  C   UNL     1      -6.779   1.199   0.220  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.664   0.250   0.406  1.00  0.00           C  
HETATM   27  C   UNL     1      -9.134   0.557   0.281  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.212  -1.147   0.744  1.00  0.00           C  
HETATM   29  H   UNL     1       4.713   1.016  -2.613  1.00  0.00           H  
HETATM   30  H   UNL     1       6.140   2.984  -2.348  1.00  0.00           H  
HETATM   31  H   UNL     1       6.845   3.720  -0.111  1.00  0.00           H  
HETATM   32  H   UNL     1       6.127   2.495   1.890  1.00  0.00           H  
HETATM   33  H   UNL     1       3.793  -0.986   3.892  1.00  0.00           H  
HETATM   34  H   UNL     1       2.280  -1.481   3.096  1.00  0.00           H  
HETATM   35  H   UNL     1       3.725  -2.515   2.983  1.00  0.00           H  
HETATM   36  H   UNL     1       2.718  -3.019  -0.379  1.00  0.00           H  
HETATM   37  H   UNL     1       2.649  -3.059   1.399  1.00  0.00           H  
HETATM   38  H   UNL     1       0.614  -1.440   1.278  1.00  0.00           H  
HETATM   39  H   UNL     1       0.856  -4.208  -1.449  1.00  0.00           H  
HETATM   40  H   UNL     1       0.294  -2.969  -2.596  1.00  0.00           H  
HETATM   41  H   UNL     1       1.906  -2.830  -1.856  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.750  -2.742  -1.069  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.529  -1.811   0.432  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.737   0.132  -0.889  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.958  -0.799  -2.390  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.501  -0.905  -1.865  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.647   2.399  -0.952  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.643   2.412   0.523  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.395   1.162   0.303  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.655   2.387  -1.066  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.073   0.820  -1.801  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.174  -0.179   0.502  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.844   2.574   1.364  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.104   2.201  -0.018  1.00  0.00           H  
HETATM   55  H   UNL     1      -9.452   0.401  -0.750  1.00  0.00           H  
HETATM   56  H   UNL     1      -9.700  -0.102   0.939  1.00  0.00           H  
HETATM   57  H   UNL     1      -9.314   1.594   0.563  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.040  -1.223   1.817  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.982  -1.859   0.447  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.287  -1.368   0.211  1.00  0.00           H  
HETATM   61  H   UNL     1       4.858   0.625   2.768  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2   12    1    1    3                                       
CONECT    3    2    8    8    4                                       
CONECT    4    3    5    5   29                                       
CONECT    5    4    4    6   30                                       
CONECT    6    7    7    5   31                                       
CONECT    7    8    6    6   32                                       
CONECT    8    9    3    3    7                                       
CONECT    9   10    8   61                                            
CONECT   10   11   12   12    9                                       
CONECT   11   10   33   34   35                                       
CONECT   12   13   10   10    2                                       
CONECT   13   14   12   36   37                                       
CONECT   14   13   15   15   38                                       
CONECT   15   14   14   17   16                                       
CONECT   16   15   39   40   41                                       
CONECT   17   18   15   42   43                                       
CONECT   18   17   19   44   45                                       
CONECT   19   18   20   20   46                                       
CONECT   20   21   19   19   22                                       
CONECT   21   20   47   48   49                                       
CONECT   22   23   20   50   51                                       
CONECT   23   25   22   24   52                                       
CONECT   24   23   53                                                 
CONECT   25   23   26   26   54                                       
CONECT   26   27   25   25   28                                       
CONECT   27   26   55   56   57                                       
CONECT   28   26   58   59   60                                       
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33   11                                                      
CONECT   34   11                                                      
CONECT   35   11                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   16                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   21                                                      
CONECT   48   21                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   25                                                      
CONECT   55   27                                                      
CONECT   56   27                                                      
CONECT   57   27                                                      
CONECT   58   28                                                      
CONECT   59   28                                                      
CONECT   60   28                                                      
CONECT   61    9                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
