COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.075   2.622   5.254  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.163   3.292   4.195  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.967   3.302   1.882  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.870   2.048   1.879  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.389   0.290   0.986  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.578  -1.045   1.749  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.198  -0.281   4.050  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.932   0.158   5.335  1.00  0.00           C  
HETATM    9  C   UNL     1       0.890   1.493   6.288  1.00  0.00           C  
HETATM   10  C   UNL     1       1.185   0.405   7.275  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.410   5.367   2.984  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.269   6.097   1.997  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.697   1.676  -0.517  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.646   0.593  -1.550  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.436  -2.315   3.606  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.465  -2.916   2.698  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.486   3.652   6.321  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.753   3.243   7.013  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.979   3.655   6.503  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.157   3.274   7.146  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.101   2.484   8.294  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.867   2.075   8.800  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.689   2.455   8.157  1.00  0.00           C  
HETATM   24  N   UNL     1      -0.522   1.435   5.940  1.00  0.00           N  
HETATM   25  N   UNL     1      -0.961   4.022   3.180  1.00  0.00           N  
HETATM   26  N   UNL     1      -1.633   1.061   0.809  1.00  0.00           N  
HETATM   27  N   UNL     1      -1.111  -0.970   3.119  1.00  0.00           N  
HETATM   28  N   UNL     1      -6.300   2.097   8.948  1.00  0.00           N1+
HETATM   29  O   UNL     1       0.404  -0.071   8.085  1.00  0.00           O  
HETATM   30  O   UNL     1       2.476   0.003   7.148  1.00  0.00           O  
HETATM   31  O   UNL     1      -2.470   5.948   1.829  1.00  0.00           O  
HETATM   32  O   UNL     1      -0.514   6.978   1.290  1.00  0.00           O  
HETATM   33  O   UNL     1      -2.078  -0.544  -1.433  1.00  0.00           O  
HETATM   34  O   UNL     1      -1.038   1.054  -2.674  1.00  0.00           O  
HETATM   35  O   UNL     1      -3.308  -2.310   2.053  1.00  0.00           O  
HETATM   36  O   UNL     1      -2.336  -4.268   2.684  1.00  0.00           O  
HETATM   37  O   UNL     1      -6.228   1.386   9.980  1.00  0.00           O  
HETATM   38  O   UNL     1      -7.400   2.475   8.477  1.00  0.00           O1-
HETATM   39  H   UNL     1      -2.025   2.337   4.789  1.00  0.00           H  
HETATM   40  H   UNL     1       0.509   3.985   4.722  1.00  0.00           H  
HETATM   41  H   UNL     1       0.510   2.580   3.712  1.00  0.00           H  
HETATM   42  H   UNL     1       0.062   3.064   1.585  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.355   3.978   1.108  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.827   1.529   2.833  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.913   2.385   1.804  1.00  0.00           H  
HETATM   46  H   UNL     1       0.413   0.890   1.428  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.010   0.002  -0.005  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.265  -1.658   1.149  1.00  0.00           H  
HETATM   49  H   UNL     1       0.382  -1.578   1.754  1.00  0.00           H  
HETATM   50  H   UNL     1       0.220   0.594   3.559  1.00  0.00           H  
HETATM   51  H   UNL     1       0.661  -0.915   4.303  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.017   0.189   5.166  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.801  -0.633   6.087  1.00  0.00           H  
HETATM   54  H   UNL     1       1.105   2.466   6.738  1.00  0.00           H  
HETATM   55  H   UNL     1       1.487   1.347   5.384  1.00  0.00           H  
HETATM   56  H   UNL     1       0.607   5.281   2.593  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.411   5.896   3.941  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.840   2.343  -0.640  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.633   2.233  -0.607  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.840  -2.238   4.619  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.531  -2.927   3.598  1.00  0.00           H  
HETATM   62  H   UNL     1      -1.609   4.626   5.845  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.674   3.756   7.044  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.032   4.270   5.609  1.00  0.00           H  
HETATM   65  H   UNL     1      -6.112   3.600   6.741  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.810   1.459   9.694  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.732   2.131   8.558  1.00  0.00           H  
HETATM   68  H   UNL     1      -0.989   0.366  -3.372  1.00  0.00           H  
HETATM   69  H   UNL     1       2.700  -0.711   7.782  1.00  0.00           H  
HETATM   70  H   UNL     1      -1.050   7.473   0.634  1.00  0.00           H  
HETATM   71  H   UNL     1      -2.998  -4.692   2.096  1.00  0.00           H  
CONECT    1    2   17   24   39                                       
CONECT    2    1   25   40   41                                       
CONECT    3    4   25   42   43                                       
CONECT    4    3   26   44   45                                       
CONECT    5    6   26   46   47                                       
CONECT    6    5   27   48   49                                       
CONECT    7    8   27   50   51                                       
CONECT    8    7   24   52   53                                       
CONECT    9   10   24   54   55                                       
CONECT   10    9   29   29   30                                       
CONECT   11   12   25   56   57                                       
CONECT   12   11   31   31   32                                       
CONECT   13   14   26   58   59                                       
CONECT   14   13   33   33   34                                       
CONECT   15   16   27   60   61                                       
CONECT   16   15   35   35   36                                       
CONECT   17    1   18   62   63                                       
CONECT   18   17   19   19   23                                       
CONECT   19   18   18   20   64                                       
CONECT   20   19   21   21   65                                       
CONECT   21   20   20   22   28                                       
CONECT   22   21   23   23   66                                       
CONECT   23   18   22   22   67                                       
CONECT   24    1    8    9                                            
CONECT   25    2    3   11                                            
CONECT   26    4    5   13                                            
CONECT   27    6    7   15                                            
CONECT   28   21   37   37   38                                       
CONECT   29   10   10                                                 
CONECT   30   10   69                                                 
CONECT   31   12   12                                                 
CONECT   32   12   70                                                 
CONECT   33   14   14                                                 
CONECT   34   14   68                                                 
CONECT   35   16   16                                                 
CONECT   36   16   71                                                 
CONECT   37   28   28                                                 
CONECT   38   28                                                      
CONECT   39    1                                                      
CONECT   40    2                                                      
CONECT   41    2                                                      
CONECT   42    3                                                      
CONECT   43    3                                                      
CONECT   44    4                                                      
CONECT   45    4                                                      
CONECT   46    5                                                      
CONECT   47    5                                                      
CONECT   48    6                                                      
CONECT   49    6                                                      
CONECT   50    7                                                      
CONECT   51    7                                                      
CONECT   52    8                                                      
CONECT   53    8                                                      
CONECT   54    9                                                      
CONECT   55    9                                                      
CONECT   56   11                                                      
CONECT   57   11                                                      
CONECT   58   13                                                      
CONECT   59   13                                                      
CONECT   60   15                                                      
CONECT   61   15                                                      
CONECT   62   17                                                      
CONECT   63   17                                                      
CONECT   64   19                                                      
CONECT   65   20                                                      
CONECT   66   22                                                      
CONECT   67   23                                                      
CONECT   68   34                                                      
CONECT   69   30                                                      
CONECT   70   32                                                      
CONECT   71   36                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
