COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.710  -1.248  -0.740  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.773  -0.179  -0.302  1.00  0.00           C  
HETATM    3  N   UNL     1      -6.048  -0.511  -0.280  1.00  0.00           N  
HETATM    4  C   UNL     1      -4.716  -3.711  -1.208  1.00  0.00           C  
HETATM    5  C   UNL     1       1.563  -0.070  -0.086  1.00  0.00           C  
HETATM    6  C   UNL     1       2.845  -0.108   0.443  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.844  -1.627   2.023  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.718   4.098  -0.889  1.00  0.00           C  
HETATM    9  C   UNL     1       7.324   1.174   0.459  1.00  0.00           C  
HETATM   10  C   UNL     1       3.926   0.013  -0.417  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.991  -2.282  -0.816  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.059  -0.325   1.847  1.00  0.00           C  
HETATM   13  C   UNL     1       1.409   0.097  -1.479  1.00  0.00           C  
HETATM   14  C   UNL     1       2.552   0.212  -2.271  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.058  -0.080  -0.498  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.952   3.463   0.483  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.757   4.425   1.359  1.00  0.00           C  
HETATM   18  C   UNL     1       5.932   1.233  -0.176  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.585  -0.041  -0.614  1.00  0.00           C  
HETATM   20  C   UNL     1       7.358  -1.208   0.207  1.00  0.00           C  
HETATM   21  C   UNL     1       5.966  -1.173  -0.431  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.649  -4.007   1.813  1.00  0.00           C  
HETATM   23  C   UNL     1       5.149   2.406   0.418  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.919   0.854   2.306  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.031   1.052  -0.041  1.00  0.00           C  
HETATM   26  N   UNL     1      -2.718   1.043  -0.156  1.00  0.00           N  
HETATM   27  N   UNL     1      -4.696   2.212   0.321  1.00  0.00           N  
HETATM   28  N   UNL     1      -6.170  -1.753  -0.598  1.00  0.00           N  
HETATM   29  N   UNL     1       3.749   0.164  -1.723  1.00  0.00           N  
HETATM   30  N   UNL     1       5.219  -0.023   0.099  1.00  0.00           N  
HETATM   31  N   UNL     1       0.079   0.106  -1.734  1.00  0.00           N  
HETATM   32  N   UNL     1       0.292  -0.154   0.435  1.00  0.00           N  
HETATM   33  N   UNL     1      -4.071  -1.311  -0.645  1.00  0.00           N  
HETATM   34  O   UNL     1       8.023   0.032  -0.045  1.00  0.00           O  
HETATM   35  O   UNL     1      -0.009  -2.736   1.683  1.00  0.00           O  
HETATM   36  H   UNL     1      -2.149  -2.130  -1.013  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.716  -3.796  -2.295  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.743  -4.013  -0.821  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.489  -4.357  -0.793  1.00  0.00           H  
HETATM   40  H   UNL     1       2.997  -0.229   1.505  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.165  -1.720   3.061  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.717  -1.616   1.372  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.675   4.376  -1.329  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.098   4.988  -0.776  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.213   3.383  -1.539  1.00  0.00           H  
HETATM   46  H   UNL     1       7.877   2.079   0.209  1.00  0.00           H  
HETATM   47  H   UNL     1       7.227   1.093   1.541  1.00  0.00           H  
HETATM   48  H   UNL     1       0.851  -0.366   2.445  1.00  0.00           H  
HETATM   49  H   UNL     1       2.454   0.339  -3.339  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.993   3.257   0.957  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.717   4.632   0.885  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.925   3.973   2.337  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.204   5.356   1.480  1.00  0.00           H  
HETATM   54  H   UNL     1       6.028   1.368  -1.253  1.00  0.00           H  
HETATM   55  H   UNL     1       7.262  -1.358   1.282  1.00  0.00           H  
HETATM   56  H   UNL     1       7.935  -2.026  -0.225  1.00  0.00           H  
HETATM   57  H   UNL     1       6.063  -1.076  -1.512  1.00  0.00           H  
HETATM   58  H   UNL     1       5.434  -2.094  -0.194  1.00  0.00           H  
HETATM   59  H   UNL     1       0.050  -4.796   1.537  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.967  -4.149   2.846  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.519  -4.045   1.157  1.00  0.00           H  
HETATM   62  H   UNL     1       5.678   3.336   0.215  1.00  0.00           H  
HETATM   63  H   UNL     1       4.157   2.446  -0.032  1.00  0.00           H  
HETATM   64  H   UNL     1       5.053   2.270   1.496  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.069   0.797   3.384  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.415   1.789   2.058  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.885   0.818   1.802  1.00  0.00           H  
HETATM   68  H   UNL     1      -5.655   2.195   0.467  1.00  0.00           H  
CONECT    1   33   15   15   36                                       
CONECT    2   33    3    3   25                                       
CONECT    3   28    2    2                                            
CONECT    4   11   37   38   39                                       
CONECT    5   13   32    6    6                                       
CONECT    6    5    5   10   40                                       
CONECT    7   12   35   41   42                                       
CONECT    8   16   43   44   45                                       
CONECT    9   18   34   46   47                                       
CONECT   10   29   29   30    6                                       
CONECT   11    4   28   28   33                                       
CONECT   12   32   24    7   48                                       
CONECT   13   14   14   31    5                                       
CONECT   14   13   13   29   49                                       
CONECT   15    1    1   19   26                                       
CONECT   16   27   17    8   50                                       
CONECT   17   16   51   52   53                                       
CONECT   18    9   30   23   54                                       
CONECT   19   31   31   15   32                                       
CONECT   20   34   21   55   56                                       
CONECT   21   30   20   57   58                                       
CONECT   22   35   59   60   61                                       
CONECT   23   18   62   63   64                                       
CONECT   24   12   65   66   67                                       
CONECT   25    2   26   26   27                                       
CONECT   26   15   25   25                                            
CONECT   27   25   16   68                                            
CONECT   28   11   11    3                                            
CONECT   29   14   10   10                                            
CONECT   30   18   10   21                                            
CONECT   31   13   19   19                                            
CONECT   32   19    5   12                                            
CONECT   33   11    1    2                                            
CONECT   34    9   20                                                 
CONECT   35    7   22                                                 
CONECT   36    1                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    7                                                      
CONECT   43    8                                                      
CONECT   44    8                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47    9                                                      
CONECT   48   12                                                      
CONECT   49   14                                                      
CONECT   50   16                                                      
CONECT   51   17                                                      
CONECT   52   17                                                      
CONECT   53   17                                                      
CONECT   54   18                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   22                                                      
CONECT   61   22                                                      
CONECT   62   23                                                      
CONECT   63   23                                                      
CONECT   64   23                                                      
CONECT   65   24                                                      
CONECT   66   24                                                      
CONECT   67   24                                                      
CONECT   68   27                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
