COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.247   0.896   0.000  1.00  0.00           C  
HETATM    2  N   UNL     1       3.552   0.747   0.095  1.00  0.00           N  
HETATM    3  C   UNL     1       1.623  -1.519   0.073  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.606   1.532   0.021  1.00  0.00           C  
HETATM    5  C   UNL     1       3.090  -1.867   0.060  1.00  0.00           C  
HETATM    6  C   UNL     1       3.752  -1.332   1.331  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.055  -0.939   0.099  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.568  -2.243   0.132  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.537  -3.396   0.184  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.515  -0.680   0.116  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.756   2.251   1.207  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.186   3.562   1.166  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.468   4.163  -0.047  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.321   3.455  -1.227  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.892   2.144  -1.200  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.274  -1.025   1.232  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.633  -0.780   1.242  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.240  -0.195   0.146  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.492   0.150  -0.965  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.132  -0.085  -0.984  1.00  0.00           C  
HETATM   21  N   UNL     1       2.008   2.222  -0.152  1.00  0.00           N  
HETATM   22  N   UNL     1       4.141   1.886   0.014  1.00  0.00           N  
HETATM   23  N   UNL     1       3.275   2.829  -0.137  1.00  0.00           N  
HETATM   24  N   UNL     1       0.728  -2.484   0.118  1.00  0.00           N  
HETATM   25  C   UNL     1       1.234  -0.181   0.044  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.140   0.128   0.057  1.00  0.00           C  
HETATM   27  C   UNL     1       3.253  -3.387   0.000  1.00  0.00           C  
HETATM   28  C   UNL     1       3.752  -1.234  -1.166  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.888  -3.831  -1.240  1.00  0.00           C  
HETATM   30  H   UNL     1       3.586  -2.032   2.149  1.00  0.00           H  
HETATM   31  H   UNL     1       4.823  -1.218   1.162  1.00  0.00           H  
HETATM   32  H   UNL     1       3.320  -0.365   1.587  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.081  -4.230   0.717  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.444  -3.086   0.703  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.536   1.783   2.155  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.302   4.119   2.084  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.804   5.189  -0.074  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.544   3.930  -2.171  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.778   1.593  -2.121  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.801  -1.482   2.089  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.222  -1.047   2.107  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.304  -0.006   0.158  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.972   0.606  -1.818  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.548   0.188  -1.850  1.00  0.00           H  
HETATM   45  H   UNL     1       1.147   2.658  -0.250  1.00  0.00           H  
HETATM   46  H   UNL     1       2.781  -3.768  -0.905  1.00  0.00           H  
HETATM   47  H   UNL     1       4.313  -3.638  -0.010  1.00  0.00           H  
HETATM   48  H   UNL     1       2.781  -3.837   0.873  1.00  0.00           H  
HETATM   49  H   UNL     1       3.265  -0.286  -1.393  1.00  0.00           H  
HETATM   50  H   UNL     1       4.808  -1.060  -0.958  1.00  0.00           H  
HETATM   51  H   UNL     1       3.656  -1.906  -2.019  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.345  -2.997  -1.773  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.982  -4.142  -1.760  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.589  -4.665  -1.203  1.00  0.00           H  
CONECT    1   25   21    2    2                                       
CONECT    2    1    1   22                                            
CONECT    3   25    5   24   24                                       
CONECT    4   11   11   15   26                                       
CONECT    5   27    6   28    3                                       
CONECT    6    5   30   31   32                                       
CONECT    7    8    8   10   26                                       
CONECT    8    7    7    9   24                                       
CONECT    9    8   29   33   34                                       
CONECT   10    7   16   16   20                                       
CONECT   11    4    4   12   35                                       
CONECT   12   11   13   13   36                                       
CONECT   13   12   12   14   37                                       
CONECT   14   13   15   15   38                                       
CONECT   15    4   14   14   39                                       
CONECT   16   10   10   17   40                                       
CONECT   17   16   18   18   41                                       
CONECT   18   17   17   19   42                                       
CONECT   19   18   20   20   43                                       
CONECT   20   10   19   19   44                                       
CONECT   21   45    1   23                                            
CONECT   22    2   23   23                                            
CONECT   23   21   22   22                                            
CONECT   24    8    3    3                                            
CONECT   25   26   26    3    1                                       
CONECT   26    7    4   25   25                                       
CONECT   27    5   46   47   48                                       
CONECT   28    5   49   50   51                                       
CONECT   29    9   52   53   54                                       
CONECT   30    6                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    9                                                      
CONECT   34    9                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   18                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   27                                                      
CONECT   47   27                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
CONECT   50   28                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
CONECT   54   29                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
