COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.903  -0.325   2.674  1.00  0.00           C  
HETATM    2  C   UNL     1       4.516   0.093   1.363  1.00  0.00           C  
HETATM    3  N   UNL     1       5.782   0.118   1.066  1.00  0.00           N  
HETATM    4  O   UNL     1       5.974   0.500  -0.064  1.00  0.00           O  
HETATM    5  C   UNL     1       4.828   0.790  -0.694  1.00  0.00           C  
HETATM    6  C   UNL     1       4.675   1.291  -2.108  1.00  0.00           C  
HETATM    7  C   UNL     1       3.825   0.535   0.199  1.00  0.00           C  
HETATM    8  C   UNL     1       2.363   0.685   0.003  1.00  0.00           C  
HETATM    9  C   UNL     1       1.597  -0.394  -0.488  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.347   0.854  -0.396  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.746   0.954  -0.599  1.00  0.00           C  
HETATM   12  N   UNL     1      -2.472  -0.113  -1.084  1.00  0.00           N  
HETATM   13  C   UNL     1      -2.026  -1.419  -0.866  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.447  -2.140  -1.903  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.007  -3.430  -1.684  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.141  -4.005  -0.433  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.717  -3.291   0.601  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.155  -1.998   0.390  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.777  -1.218   1.520  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.141  -0.684   1.080  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.954  -2.132   2.734  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.866  -0.046   1.893  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.369   2.172  -0.289  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.594   3.236   0.204  1.00  0.00           C  
HETATM   25  N   UNL     1      -0.304   3.116   0.381  1.00  0.00           N  
HETATM   26  C   UNL     1       0.349   1.979   0.104  1.00  0.00           C  
HETATM   27  C   UNL     1       1.738   1.883   0.306  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.818   2.335  -0.479  1.00  0.00           C  
HETATM   29  C   UNL     1       1.372  -2.663  -1.149  1.00  0.00           C  
HETATM   30  O   UNL     1      -4.466   1.447  -0.998  1.00  0.00           O  
HETATM   31  O   UNL     1      -4.428   3.468  -0.078  1.00  0.00           O  
HETATM   32  O   UNL     1       2.211  -1.567  -0.780  1.00  0.00           O  
HETATM   33  N   UNL     1       0.302  -0.281  -0.669  1.00  0.00           N  
HETATM   34  H   UNL     1       3.815   0.543   3.328  1.00  0.00           H  
HETATM   35  H   UNL     1       2.914  -0.747   2.495  1.00  0.00           H  
HETATM   36  H   UNL     1       4.537  -1.074   3.149  1.00  0.00           H  
HETATM   37  H   UNL     1       5.659   1.390  -2.567  1.00  0.00           H  
HETATM   38  H   UNL     1       4.076   0.583  -2.681  1.00  0.00           H  
HETATM   39  H   UNL     1       4.180   2.262  -2.097  1.00  0.00           H  
HETATM   40  H   UNL     1       2.302   2.721   0.688  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.293   0.043  -1.578  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.342  -1.691  -2.880  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.557  -3.991  -2.490  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.796  -5.015  -0.264  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.821  -3.743   1.577  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.982  -2.513   3.047  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.404  -1.569   3.551  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.603  -2.967   2.468  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.832  -1.517   0.947  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.530  -0.009   1.842  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.035  -0.146   0.138  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.146   0.831   1.309  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.974   0.174   2.955  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.830  -0.309   1.679  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.075   4.173   0.442  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.382   3.529  -0.224  1.00  0.00           H  
HETATM   57  H   UNL     1       0.602  -2.804  -0.390  1.00  0.00           H  
HETATM   58  H   UNL     1       0.900  -2.453  -2.109  1.00  0.00           H  
HETATM   59  H   UNL     1       1.972  -3.569  -1.230  1.00  0.00           H  
CONECT    1    2   34   35   36                                       
CONECT    2    1    3    3    7                                       
CONECT    3    2    2    4                                            
CONECT    4    3    5                                                 
CONECT    5    4    6    7    7                                       
CONECT    6    5   37   38   39                                       
CONECT    7    2    5    5    8                                       
CONECT    8    7    9   27   27                                       
CONECT    9    8   32   33   33                                       
CONECT   10   11   11   26   33                                       
CONECT   11   10   10   12   23                                       
CONECT   12   11   13   41                                            
CONECT   13   12   14   18   18                                       
CONECT   14   13   15   15   42                                       
CONECT   15   14   14   16   43                                       
CONECT   16   15   17   17   44                                       
CONECT   17   16   16   18   45                                       
CONECT   18   13   13   17   19                                       
CONECT   19   18   21   20   22                                       
CONECT   20   19   49   50   51                                       
CONECT   21   19   46   47   48                                       
CONECT   22   19   52   53   54                                       
CONECT   23   11   24   24   28                                       
CONECT   24   23   23   25   55                                       
CONECT   25   24   26   26                                            
CONECT   26   10   25   25   27                                       
CONECT   27    8    8   26   40                                       
CONECT   28   23   31   30   30                                       
CONECT   29   32   57   58   59                                       
CONECT   30   28   28                                                 
CONECT   31   28   56                                                 
CONECT   32    9   29                                                 
CONECT   33    9    9   10                                            
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40   27                                                      
CONECT   41   12                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   21                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   22                                                      
CONECT   53   22                                                      
CONECT   54   22                                                      
CONECT   55   24                                                      
CONECT   56   31                                                      
CONECT   57   29                                                      
CONECT   58   29                                                      
CONECT   59   29                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
