COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.007  -0.837   0.023  1.00  0.00           C  
HETATM    2  C   UNL     1       1.895   0.567  -0.012  1.00  0.00           C  
HETATM    3  C   UNL     1       0.619   1.129  -0.060  1.00  0.00           C  
HETATM    4  C   UNL     1       4.017   0.085   0.058  1.00  0.00           C  
HETATM    5  N   UNL     1      -0.430   0.324  -0.070  1.00  0.00           N  
HETATM    6  N   UNL     1      -1.420  -1.794  -0.050  1.00  0.00           N  
HETATM    7  N   UNL     1       0.904  -1.573   0.009  1.00  0.00           N  
HETATM    8  C   UNL     1      -7.403  -0.254  -0.992  1.00  0.00           C  
HETATM    9  C   UNL     1      -8.755   0.459  -1.063  1.00  0.00           C  
HETATM   10  N   UNL     1      -9.285   0.635   0.297  1.00  0.00           N  
HETATM   11  C   UNL     1     -10.619   1.249   0.267  1.00  0.00           C  
HETATM   12  C   UNL     1      -8.359   1.426   1.121  1.00  0.00           C  
HETATM   13  C   UNL     1      -7.007   0.713   1.191  1.00  0.00           C  
HETATM   14  N   UNL     1      -6.477   0.537  -0.168  1.00  0.00           N  
HETATM   15  C   UNL     1      -5.206  -0.048  -0.140  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.184   0.548   0.587  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.930  -0.030   0.616  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.969  -1.227  -0.833  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.716  -1.807  -0.801  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.691  -1.206  -0.082  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.286  -0.994  -0.036  1.00  0.00           C  
HETATM   22  N   UNL     1       3.156   1.070   0.012  1.00  0.00           N  
HETATM   23  N   UNL     1       3.354  -1.112   0.062  1.00  0.00           N  
HETATM   24  C   UNL     1       3.966  -2.442   0.108  1.00  0.00           C  
HETATM   25  C   UNL     1       4.864  -2.568   1.357  1.00  0.00           C  
HETATM   26  C   UNL     1       6.069  -3.412   0.874  1.00  0.00           C  
HETATM   27  C   UNL     1       6.302  -2.885  -0.564  1.00  0.00           C  
HETATM   28  C   UNL     1       4.881  -2.644  -1.113  1.00  0.00           C  
HETATM   29  N   UNL     1       5.390   0.232   0.098  1.00  0.00           N  
HETATM   30  C   UNL     1       5.960   1.503  -0.021  1.00  0.00           C  
HETATM   31  C   UNL     1       7.147   1.797   0.639  1.00  0.00           C  
HETATM   32  C   UNL     1       7.708   3.053   0.520  1.00  0.00           C  
HETATM   33  C   UNL     1       7.090   4.017  -0.255  1.00  0.00           C  
HETATM   34  C   UNL     1       5.909   3.728  -0.913  1.00  0.00           C  
HETATM   35  C   UNL     1       5.345   2.472  -0.803  1.00  0.00           C  
HETATM   36  H   UNL     1       0.491   2.201  -0.088  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.333  -2.760  -0.036  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.534  -1.240  -0.547  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.995  -0.360  -1.997  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.628   1.434  -1.533  1.00  0.00           H  
HETATM   41  H   UNL     1      -9.452  -0.140  -1.649  1.00  0.00           H  
HETATM   42  H   UNL     1     -11.301   0.609  -0.294  1.00  0.00           H  
HETATM   43  H   UNL     1     -10.987   1.368   1.286  1.00  0.00           H  
HETATM   44  H   UNL     1     -10.559   2.225  -0.214  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.228   2.412   0.675  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.768   1.532   2.126  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.310   1.312   1.778  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.134  -0.262   1.662  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.370   1.463   1.130  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.135   0.434   1.181  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.764  -1.691  -1.398  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.530  -2.722  -1.344  1.00  0.00           H  
HETATM   53  H   UNL     1       3.192  -3.209   0.125  1.00  0.00           H  
HETATM   54  H   UNL     1       5.195  -1.584   1.689  1.00  0.00           H  
HETATM   55  H   UNL     1       4.333  -3.084   2.157  1.00  0.00           H  
HETATM   56  H   UNL     1       6.944  -3.229   1.499  1.00  0.00           H  
HETATM   57  H   UNL     1       5.819  -4.473   0.864  1.00  0.00           H  
HETATM   58  H   UNL     1       6.866  -1.953  -0.541  1.00  0.00           H  
HETATM   59  H   UNL     1       6.824  -3.631  -1.163  1.00  0.00           H  
HETATM   60  H   UNL     1       4.551  -3.509  -1.688  1.00  0.00           H  
HETATM   61  H   UNL     1       4.869  -1.752  -1.739  1.00  0.00           H  
HETATM   62  H   UNL     1       5.958  -0.547   0.207  1.00  0.00           H  
HETATM   63  H   UNL     1       7.629   1.044   1.245  1.00  0.00           H  
HETATM   64  H   UNL     1       8.630   3.283   1.033  1.00  0.00           H  
HETATM   65  H   UNL     1       7.529   5.001  -0.343  1.00  0.00           H  
HETATM   66  H   UNL     1       5.429   4.483  -1.517  1.00  0.00           H  
HETATM   67  H   UNL     1       4.423   2.246  -1.317  1.00  0.00           H  
CONECT    1    2   23    7    7                                       
CONECT    2   22    3    3    1                                       
CONECT    3    2    2    5   36                                       
CONECT    4   29   22   22   23                                       
CONECT    5    3   21   21                                            
CONECT    6   21   20   37                                            
CONECT    7    1    1   21                                            
CONECT    8   14    9   38   39                                       
CONECT    9    8   10   40   41                                       
CONECT   10    9   12   11                                            
CONECT   11   10   42   43   44                                       
CONECT   12   13   10   45   46                                       
CONECT   13   14   12   47   48                                       
CONECT   14   15    8   13                                            
CONECT   15   18   18   16   14                                       
CONECT   16   17   17   15   49                                       
CONECT   17   20   16   16   50                                       
CONECT   18   19   15   15   51                                       
CONECT   19   20   20   18   52                                       
CONECT   20    6   19   19   17                                       
CONECT   21    5    5    7    6                                       
CONECT   22    4    4    2                                            
CONECT   23    4   24    1                                            
CONECT   24   23   28   25   53                                       
CONECT   25   24   26   54   55                                       
CONECT   26   25   27   56   57                                       
CONECT   27   28   26   58   59                                       
CONECT   28   24   27   60   61                                       
CONECT   29   30    4   62                                            
CONECT   30   35   35   31   29                                       
CONECT   31   32   32   30   63                                       
CONECT   32   33   31   31   64                                       
CONECT   33   34   34   32   65                                       
CONECT   34   33   33   35   66                                       
CONECT   35   34   30   30   67                                       
CONECT   36    3                                                      
CONECT   37    6                                                      
CONECT   38    8                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41    9                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   12                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   24                                                      
CONECT   54   25                                                      
CONECT   55   25                                                      
CONECT   56   26                                                      
CONECT   57   26                                                      
CONECT   58   27                                                      
CONECT   59   27                                                      
CONECT   60   28                                                      
CONECT   61   28                                                      
CONECT   62   29                                                      
CONECT   63   31                                                      
CONECT   64   32                                                      
CONECT   65   33                                                      
CONECT   66   34                                                      
CONECT   67   35                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
