COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.080   0.851  -0.135  1.00  0.00           C  
HETATM    2  N   UNL     1       6.393  -0.488  -0.164  1.00  0.00           N  
HETATM    3  O   UNL     1       7.017   4.366  -0.276  1.00  0.00           O  
HETATM    4  C   UNL     1       6.853   2.004  -0.239  1.00  0.00           C  
HETATM    5  N   UNL     1       2.286  -2.083   0.380  1.00  0.00           N  
HETATM    6  O   UNL     1       4.918   5.689  -0.022  1.00  0.00           O  
HETATM    7  C   UNL     1       6.257   3.247  -0.174  1.00  0.00           C  
HETATM    8  N   UNL     1       1.011  -2.036   0.544  1.00  0.00           N  
HETATM    9  O   UNL     1       2.902   4.795   0.235  1.00  0.00           O  
HETATM   10  C   UNL     1       4.864   3.359  -0.001  1.00  0.00           C  
HETATM   11  N   UNL     1       0.606  -0.816   0.587  1.00  0.00           N  
HETATM   12  O   UNL     1      -3.374   0.182   0.770  1.00  0.00           O  
HETATM   13  C   UNL     1       4.082   2.211   0.105  1.00  0.00           C  
HETATM   14  N   UNL     1      -4.045  -1.028  -0.965  1.00  0.00           N  
HETATM   15  C   UNL     1       4.686   0.960   0.044  1.00  0.00           C  
HETATM   16  C   UNL     1       4.235   4.688   0.069  1.00  0.00           C  
HETATM   17  C   UNL     1       4.172  -0.417   0.122  1.00  0.00           C  
HETATM   18  C   UNL     1       5.251  -1.245  -0.017  1.00  0.00           C  
HETATM   19  C   UNL     1       7.744  -1.030  -0.329  1.00  0.00           C  
HETATM   20  C   UNL     1       5.202  -2.720   0.000  1.00  0.00           C  
HETATM   21  C   UNL     1       5.920  -3.456  -0.945  1.00  0.00           C  
HETATM   22  C   UNL     1       5.870  -4.835  -0.923  1.00  0.00           C  
HETATM   23  C   UNL     1       5.110  -5.488   0.031  1.00  0.00           C  
HETATM   24  C   UNL     1       4.395  -4.764   0.970  1.00  0.00           C  
HETATM   25  C   UNL     1       4.441  -3.386   0.964  1.00  0.00           C  
HETATM   26  C   UNL     1       2.760  -0.826   0.308  1.00  0.00           C  
HETATM   27  C   UNL     1       1.678  -0.003   0.441  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.781  -0.381   0.763  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.659  -1.029  -0.309  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.087  -0.581  -0.128  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.384  -0.701  -0.732  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.250  -0.516  -1.803  1.00  0.00           C  
HETATM   33  C   UNL     1      -7.571  -0.194  -1.576  1.00  0.00           C  
HETATM   34  C   UNL     1      -8.038  -0.054  -0.270  1.00  0.00           C  
HETATM   35  C   UNL     1      -7.168  -0.241   0.803  1.00  0.00           C  
HETATM   36  C   UNL     1      -5.849  -0.568   0.571  1.00  0.00           C  
HETATM   37  C   UNL     1      -9.459   0.293  -0.023  1.00  0.00           C  
HETATM   38  C   UNL     1      -9.928   0.433   1.282  1.00  0.00           C  
HETATM   39  C   UNL     1     -11.251   0.756   1.506  1.00  0.00           C  
HETATM   40  C   UNL     1     -12.111   0.941   0.439  1.00  0.00           C  
HETATM   41  C   UNL     1     -11.651   0.803  -0.858  1.00  0.00           C  
HETATM   42  C   UNL     1     -10.329   0.485  -1.094  1.00  0.00           C  
HETATM   43  H   UNL     1       7.128   4.685  -1.182  1.00  0.00           H  
HETATM   44  H   UNL     1       7.922   1.926  -0.372  1.00  0.00           H  
HETATM   45  H   UNL     1       3.013   2.292   0.238  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.805  -1.576  -1.728  1.00  0.00           H  
HETATM   47  H   UNL     1       8.206  -1.158   0.650  1.00  0.00           H  
HETATM   48  H   UNL     1       7.689  -1.995  -0.833  1.00  0.00           H  
HETATM   49  H   UNL     1       8.342  -0.342  -0.926  1.00  0.00           H  
HETATM   50  H   UNL     1       6.513  -2.948  -1.691  1.00  0.00           H  
HETATM   51  H   UNL     1       6.425  -5.405  -1.653  1.00  0.00           H  
HETATM   52  H   UNL     1       5.074  -6.567   0.043  1.00  0.00           H  
HETATM   53  H   UNL     1       3.804  -5.280   1.711  1.00  0.00           H  
HETATM   54  H   UNL     1       3.887  -2.823   1.700  1.00  0.00           H  
HETATM   55  H   UNL     1       1.678   1.077   0.432  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.133  -0.679   1.750  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.836   0.704   0.670  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.307  -0.730  -1.297  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.605  -2.114  -0.217  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.887  -0.624  -2.814  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.243  -0.050  -2.408  1.00  0.00           H  
HETATM   62  H   UNL     1      -7.528  -0.133   1.816  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.176  -0.717   1.403  1.00  0.00           H  
HETATM   64  H   UNL     1      -9.258   0.288   2.117  1.00  0.00           H  
HETATM   65  H   UNL     1     -11.616   0.865   2.517  1.00  0.00           H  
HETATM   66  H   UNL     1     -13.146   1.193   0.619  1.00  0.00           H  
HETATM   67  H   UNL     1     -12.327   0.947  -1.688  1.00  0.00           H  
HETATM   68  H   UNL     1      -9.970   0.382  -2.108  1.00  0.00           H  
HETATM   69  H   UNL     1       2.535   5.689   0.275  1.00  0.00           H  
CONECT    1    2    4   15   15                                       
CONECT    2    1   18   19                                            
CONECT    3    7   43                                                 
CONECT    4    1    7    7   44                                       
CONECT    5    8    8   26                                            
CONECT    6   16   16                                                 
CONECT    7    3    4    4   10                                       
CONECT    8    5    5   11                                            
CONECT    9   16   69                                                 
CONECT   10    7   13   13   16                                       
CONECT   11    8   27   28                                            
CONECT   12   30   30                                                 
CONECT   13   10   10   15   45                                       
CONECT   14   30   31   46                                            
CONECT   15    1    1   13   17                                       
CONECT   16    6    6    9   10                                       
CONECT   17   15   18   18   26                                       
CONECT   18    2   17   17   20                                       
CONECT   19    2   47   48   49                                       
CONECT   20   18   21   21   25                                       
CONECT   21   20   20   22   50                                       
CONECT   22   21   23   23   51                                       
CONECT   23   22   22   24   52                                       
CONECT   24   23   25   25   53                                       
CONECT   25   20   24   24   54                                       
CONECT   26    5   17   27   27                                       
CONECT   27   11   26   26   55                                       
CONECT   28   11   29   56   57                                       
CONECT   29   28   30   58   59                                       
CONECT   30   12   12   14   29                                       
CONECT   31   14   32   32   36                                       
CONECT   32   31   31   33   60                                       
CONECT   33   32   34   34   61                                       
CONECT   34   33   33   35   37                                       
CONECT   35   34   36   36   62                                       
CONECT   36   31   35   35   63                                       
CONECT   37   34   38   38   42                                       
CONECT   38   37   37   39   64                                       
CONECT   39   38   40   40   65                                       
CONECT   40   39   39   41   66                                       
CONECT   41   40   42   42   67                                       
CONECT   42   37   41   41   68                                       
CONECT   43    3                                                      
CONECT   44    4                                                      
CONECT   45   13                                                      
CONECT   46   14                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   19                                                      
CONECT   50   21                                                      
CONECT   51   22                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   25                                                      
CONECT   55   27                                                      
CONECT   56   28                                                      
CONECT   57   28                                                      
CONECT   58   29                                                      
CONECT   59   29                                                      
CONECT   60   32                                                      
CONECT   61   33                                                      
CONECT   62   35                                                      
CONECT   63   36                                                      
CONECT   64   38                                                      
CONECT   65   39                                                      
CONECT   66   40                                                      
CONECT   67   41                                                      
CONECT   68   42                                                      
CONECT   69    9                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
