COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.388  -4.606  -1.573  1.00  0.00           C  
HETATM    2  C   UNL     1       0.199  -5.257  -1.295  1.00  0.00           C  
HETATM    3  C   UNL     1       1.663  -3.387  -0.989  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.722  -4.690  -0.432  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.156  -0.202   0.206  1.00  0.00           C  
HETATM    6  C   UNL     1       3.912   1.707  -0.729  1.00  0.00           C  
HETATM    7  C   UNL     1       4.954   0.589   1.117  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.826   0.820  -0.447  1.00  0.00           C  
HETATM    9  C   UNL     1       5.146   2.161  -1.154  1.00  0.00           C  
HETATM   10  C   UNL     1       6.190   1.040   0.696  1.00  0.00           C  
HETATM   11  C   UNL     1       0.738  -2.809  -0.117  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.198   1.182   0.374  1.00  0.00           C  
HETATM   13  C   UNL     1       3.816   0.922   0.405  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.459  -3.471   0.158  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.853  -0.030   0.616  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.193   2.026  -0.695  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.875   2.215  -0.286  1.00  0.00           C  
HETATM   18  C   UNL     1       6.289   1.828  -0.442  1.00  0.00           C  
HETATM   19  C   UNL     1       1.026  -1.503   0.512  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.804   1.371   0.811  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.699   4.193  -0.909  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.034  -2.465  -0.675  1.00  0.00           C  
HETATM   23  C   UNL     1       8.637   1.891  -0.076  1.00  0.00           C  
HETATM   24  C   UNL     1       2.469   0.428   0.867  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.464  -2.855   1.097  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.132  -1.146   1.327  1.00  0.00           C  
HETATM   27  N   UNL     1       2.184  -0.866   0.244  1.00  0.00           N  
HETATM   28  N   UNL     1      -2.237  -1.830   0.384  1.00  0.00           N1+
HETATM   29  O   UNL     1      -1.540   1.753   2.077  1.00  0.00           O  
HETATM   30  O   UNL     1       0.219  -1.003   1.270  1.00  0.00           O  
HETATM   31  O   UNL     1      -0.891   1.183   0.031  1.00  0.00           O  
HETATM   32  O   UNL     1      -5.626   3.166  -1.309  1.00  0.00           O  
HETATM   33  O   UNL     1      -3.482   3.470  -0.642  1.00  0.00           O  
HETATM   34  O   UNL     1       7.504   2.273  -0.858  1.00  0.00           O  
HETATM   35  H   UNL     1       2.105  -5.056  -2.244  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.011  -6.212  -1.754  1.00  0.00           H  
HETATM   37  H   UNL     1       2.592  -2.880  -1.207  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.648  -5.203  -0.220  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.661  -1.137   0.399  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.848   0.675  -0.765  1.00  0.00           H  
HETATM   41  H   UNL     1       3.021   1.969  -1.280  1.00  0.00           H  
HETATM   42  H   UNL     1       5.220   2.774  -2.040  1.00  0.00           H  
HETATM   43  H   UNL     1       4.877  -0.024   2.003  1.00  0.00           H  
HETATM   44  H   UNL     1       7.078   0.780   1.253  1.00  0.00           H  
HETATM   45  H   UNL     1       2.475   0.316   1.951  1.00  0.00           H  
HETATM   46  H   UNL     1       1.701   1.147   0.580  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.138  -3.628   1.466  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.942  -2.397   1.938  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.548  -0.736   2.150  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.860  -1.858   1.717  1.00  0.00           H  
HETATM   51  H   UNL     1       2.828  -1.266  -0.362  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.610   1.864   2.317  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.549   4.909  -1.716  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.050   4.696  -0.008  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.609  -1.705  -1.203  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.369  -2.970  -1.376  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.713  -3.192  -0.230  1.00  0.00           H  
HETATM   58  H   UNL     1       9.541   2.311  -0.517  1.00  0.00           H  
HETATM   59  H   UNL     1       8.521   2.267   0.940  1.00  0.00           H  
HETATM   60  H   UNL     1       8.715   0.804  -0.055  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.606  -1.158  -0.028  1.00  0.00           H  
CONECT    1    2    3    3   35                                       
CONECT    2    1    4    4   36                                       
CONECT    3    1    1   11   37                                       
CONECT    4    2    2   14   38                                       
CONECT    5    8   15   15   39                                       
CONECT    6    9   13   13   41                                       
CONECT    7   10   10   13   43                                       
CONECT    8    5   16   16   40                                       
CONECT    9    6   18   18   42                                       
CONECT   10    7    7   18   44                                       
CONECT   11    3   14   14   19                                       
CONECT   12   15   17   17   20                                       
CONECT   13    6    6    7   24                                       
CONECT   14    4   11   11   25                                       
CONECT   15    5    5   12   26                                       
CONECT   16    8    8   17   32                                       
CONECT   17   12   12   16   33                                       
CONECT   18    9    9   10   34                                       
CONECT   19   11   27   30   30                                       
CONECT   20   12   29   31   31                                       
CONECT   21   32   33   53   54                                       
CONECT   22   28   55   56   57                                       
CONECT   23   34   58   59   60                                       
CONECT   24   13   27   45   46                                       
CONECT   25   14   28   47   48                                       
CONECT   26   15   28   49   50                                       
CONECT   27   19   24   51                                            
CONECT   28   22   25   26   61                                       
CONECT   29   20   52                                                 
CONECT   30   19   19                                                 
CONECT   31   20   20                                                 
CONECT   32   16   21                                                 
CONECT   33   17   21                                                 
CONECT   34   18   23                                                 
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    8                                                      
CONECT   41    6                                                      
CONECT   42    9                                                      
CONECT   43    7                                                      
CONECT   44   10                                                      
CONECT   45   24                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   29                                                      
CONECT   53   21                                                      
CONECT   54   21                                                      
CONECT   55   22                                                      
CONECT   56   22                                                      
CONECT   57   22                                                      
CONECT   58   23                                                      
CONECT   59   23                                                      
CONECT   60   23                                                      
CONECT   61   28                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
