COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.071  -2.140  -2.375  1.00  0.00           C  
HETATM    2  O   UNL     1       0.090  -1.324  -3.304  1.00  0.00           O  
HETATM    3  N   UNL     1       0.374  -1.773  -1.041  1.00  0.00           N  
HETATM    4  C   UNL     1       0.724  -0.393  -0.720  1.00  0.00           C  
HETATM    5  C   UNL     1       2.235  -0.149  -0.826  1.00  0.00           C  
HETATM    6  C   UNL     1       2.774  -0.448  -2.226  1.00  0.00           C  
HETATM    7  C   UNL     1       2.620   1.265  -0.391  1.00  0.00           C  
HETATM    8  C   UNL     1       0.337  -2.737  -0.032  1.00  0.00           C  
HETATM    9  N   UNL     1       0.595  -2.551   1.268  1.00  0.00           N  
HETATM   10  N   UNL     1       0.422  -3.776   1.799  1.00  0.00           N  
HETATM   11  C   UNL     1       0.622  -3.954   3.220  1.00  0.00           C  
HETATM   12  C   UNL     1       1.875  -3.266   3.689  1.00  0.00           C  
HETATM   13  C   UNL     1       1.865  -1.937   4.131  1.00  0.00           C  
HETATM   14  C   UNL     1       0.684  -1.177   4.159  1.00  0.00           C  
HETATM   15  C   UNL     1       0.699   0.145   4.604  1.00  0.00           C  
HETATM   16  C   UNL     1       1.891   0.725   5.025  1.00  0.00           C  
HETATM   17  C   UNL     1       3.074  -0.015   5.003  1.00  0.00           C  
HETATM   18  C   UNL     1       3.078  -1.347   4.559  1.00  0.00           C  
HETATM   19  C   UNL     1       4.259  -2.106   4.530  1.00  0.00           C  
HETATM   20  C   UNL     1       4.244  -3.429   4.086  1.00  0.00           C  
HETATM   21  C   UNL     1       3.051  -4.009   3.665  1.00  0.00           C  
HETATM   22  C   UNL     1       0.065  -4.728   0.890  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.171  -6.110   1.237  1.00  0.00           C  
HETATM   24  C   UNL     1       0.876  -7.023   1.210  1.00  0.00           C  
HETATM   25  C   UNL     1       0.597  -8.337   1.551  1.00  0.00           C  
HETATM   26  N   UNL     1      -0.628  -8.783   1.908  1.00  0.00           N  
HETATM   27  C   UNL     1      -1.620  -7.865   1.922  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.446  -6.529   1.598  1.00  0.00           C  
HETATM   29  C   UNL     1       0.004  -4.071  -0.312  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.320  -4.555  -1.621  1.00  0.00           C  
HETATM   31  O   UNL     1      -0.606  -5.728  -1.838  1.00  0.00           O  
HETATM   32  N   UNL     1      -0.262  -3.524  -2.591  1.00  0.00           N  
HETATM   33  C   UNL     1      -0.572  -3.887  -3.971  1.00  0.00           C  
HETATM   34  H   UNL     1       0.367  -0.171   0.291  1.00  0.00           H  
HETATM   35  H   UNL     1       0.188   0.265  -1.413  1.00  0.00           H  
HETATM   36  H   UNL     1       2.721  -0.849  -0.134  1.00  0.00           H  
HETATM   37  H   UNL     1       2.392   0.258  -2.970  1.00  0.00           H  
HETATM   38  H   UNL     1       3.868  -0.381  -2.237  1.00  0.00           H  
HETATM   39  H   UNL     1       2.500  -1.460  -2.541  1.00  0.00           H  
HETATM   40  H   UNL     1       2.212   2.023  -1.068  1.00  0.00           H  
HETATM   41  H   UNL     1       3.709   1.381  -0.379  1.00  0.00           H  
HETATM   42  H   UNL     1       2.251   1.476   0.618  1.00  0.00           H  
HETATM   43  H   UNL     1       0.659  -5.030   3.428  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.262  -3.567   3.741  1.00  0.00           H  
HETATM   45  H   UNL     1       3.053  -5.040   3.321  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.268  -1.595   3.838  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.221   0.722   4.622  1.00  0.00           H  
HETATM   48  H   UNL     1       1.902   1.755   5.372  1.00  0.00           H  
HETATM   49  H   UNL     1       3.995   0.459   5.338  1.00  0.00           H  
HETATM   50  H   UNL     1       5.203  -1.673   4.855  1.00  0.00           H  
HETATM   51  H   UNL     1       5.164  -4.006   4.069  1.00  0.00           H  
HETATM   52  H   UNL     1       1.884  -6.732   0.935  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.288  -5.845   1.628  1.00  0.00           H  
HETATM   54  H   UNL     1       1.379  -9.090   1.547  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.596  -8.243   2.210  1.00  0.00           H  
HETATM   56  H   UNL     1       0.348  -3.963  -4.555  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.217  -3.130  -4.425  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.089  -4.850  -4.001  1.00  0.00           H  
CONECT    1    2    2    3   32                                       
CONECT    2    1    1                                                 
CONECT    3    1    4    8                                            
CONECT    4    3    5   34   35                                       
CONECT    5    4    6    7   36                                       
CONECT    6    5   37   38   39                                       
CONECT    7    5   40   41   42                                       
CONECT    8    3    9    9   29                                       
CONECT    9    8    8   10                                            
CONECT   10    9   11   22                                            
CONECT   11   10   12   43   44                                       
CONECT   12   11   13   21   21                                       
CONECT   13   12   14   18   18                                       
CONECT   14   13   15   15   46                                       
CONECT   15   14   14   16   47                                       
CONECT   16   15   17   17   48                                       
CONECT   17   16   16   18   49                                       
CONECT   18   13   13   17   19                                       
CONECT   19   18   20   20   50                                       
CONECT   20   19   19   21   51                                       
CONECT   21   12   12   20   45                                       
CONECT   22   10   23   29   29                                       
CONECT   23   22   24   28   28                                       
CONECT   24   23   25   25   52                                       
CONECT   25   24   24   26   54                                       
CONECT   26   25   27   27                                            
CONECT   27   26   26   28   55                                       
CONECT   28   23   23   27   53                                       
CONECT   29    8   22   22   30                                       
CONECT   30   29   31   31   32                                       
CONECT   31   30   30                                                 
CONECT   32    1   30   33                                            
CONECT   33   32   56   57   58                                       
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42    7                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   21                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   19                                                      
CONECT   51   20                                                      
CONECT   52   24                                                      
CONECT   53   28                                                      
CONECT   54   25                                                      
CONECT   55   27                                                      
CONECT   56   33                                                      
CONECT   57   33                                                      
CONECT   58   33                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
