COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -8.084  -0.114  -1.357  1.00  0.00           C  
HETATM    2  C   UNL     1      -7.533   1.637  -0.178  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.746   2.394   0.712  1.00  0.00           C  
HETATM    4  N   UNL     1       8.123   1.920  -0.334  1.00  0.00           N  
HETATM    5  C   UNL     1      -2.336  -1.514   0.627  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.381  -0.795   1.582  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.781   0.678   1.694  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.200   0.775   2.265  1.00  0.00           C  
HETATM    9  C   UNL     1       0.027  -0.893   1.053  1.00  0.00           C  
HETATM   10  C   UNL     1       0.337  -0.363  -0.186  1.00  0.00           C  
HETATM   11  C   UNL     1       1.627  -0.453  -0.673  1.00  0.00           C  
HETATM   12  C   UNL     1       2.611  -1.075   0.082  1.00  0.00           C  
HETATM   13  C   UNL     1       4.841  -1.817   0.435  1.00  0.00           C  
HETATM   14  C   UNL     1       6.202  -1.820  -0.264  1.00  0.00           C  
HETATM   15  C   UNL     1       8.758   3.239  -0.403  1.00  0.00           C  
HETATM   16  C   UNL     1       8.452   1.003  -1.250  1.00  0.00           C  
HETATM   17  C   UNL     1       7.886  -0.389  -1.246  1.00  0.00           C  
HETATM   18  C   UNL     1       8.933  -1.360  -0.696  1.00  0.00           C  
HETATM   19  C   UNL     1       1.007  -1.509   1.810  1.00  0.00           C  
HETATM   20  O   UNL     1       9.239   1.309  -2.120  1.00  0.00           O  
HETATM   21  C   UNL     1       7.163   1.664   0.737  1.00  0.00           C  
HETATM   22  C   UNL     1       6.969   0.158   0.918  1.00  0.00           C  
HETATM   23  N   UNL     1       6.684  -0.440  -0.403  1.00  0.00           N  
HETATM   24  O   UNL     1       3.880  -1.164  -0.396  1.00  0.00           O  
HETATM   25  C   UNL     1       2.297  -1.605   1.324  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.761  -1.442   1.186  1.00  0.00           C  
HETATM   27  N   UNL     1      -4.101  -0.034   1.433  1.00  0.00           N  
HETATM   28  C   UNL     1      -5.254   0.522   0.889  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.622   1.838   1.236  1.00  0.00           C  
HETATM   30  N   UNL     1      -5.986  -0.185   0.061  1.00  0.00           N  
HETATM   31  N   UNL     1      -7.147   0.354  -0.495  1.00  0.00           N  
HETATM   32  N   UNL     1      -8.649   1.878  -0.843  1.00  0.00           N  
HETATM   33  N   UNL     1      -8.967   0.842  -1.538  1.00  0.00           N  
HETATM   34  O   UNL     1      -8.103  -1.344  -1.933  1.00  0.00           O  
HETATM   35  C   UNL     1      -9.190  -1.630  -2.815  1.00  0.00           C  
HETATM   36  H   UNL     1      -7.031   3.402   0.974  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.304  -1.033  -0.350  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.036  -2.557   0.530  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.432  -1.261   2.566  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.087   1.195   2.356  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.754   1.138   0.706  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.209   0.398   3.287  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.526   1.815   2.256  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.429   0.120  -0.773  1.00  0.00           H  
HETATM   45  H   UNL     1       1.868  -0.040  -1.641  1.00  0.00           H  
HETATM   46  H   UNL     1       4.525  -2.844   0.619  1.00  0.00           H  
HETATM   47  H   UNL     1       4.922  -1.287   1.384  1.00  0.00           H  
HETATM   48  H   UNL     1       6.914  -2.395   0.328  1.00  0.00           H  
HETATM   49  H   UNL     1       6.102  -2.272  -1.251  1.00  0.00           H  
HETATM   50  H   UNL     1       9.446   3.266  -1.249  1.00  0.00           H  
HETATM   51  H   UNL     1       7.993   4.004  -0.532  1.00  0.00           H  
HETATM   52  H   UNL     1       9.308   3.426   0.519  1.00  0.00           H  
HETATM   53  H   UNL     1       7.626  -0.676  -2.264  1.00  0.00           H  
HETATM   54  H   UNL     1       9.198  -1.072   0.321  1.00  0.00           H  
HETATM   55  H   UNL     1       8.524  -2.371  -0.693  1.00  0.00           H  
HETATM   56  H   UNL     1       9.823  -1.330  -1.325  1.00  0.00           H  
HETATM   57  H   UNL     1       0.763  -1.918   2.779  1.00  0.00           H  
HETATM   58  H   UNL     1       7.534   2.096   1.666  1.00  0.00           H  
HETATM   59  H   UNL     1       6.207   2.122   0.482  1.00  0.00           H  
HETATM   60  H   UNL     1       7.875  -0.280   1.336  1.00  0.00           H  
HETATM   61  H   UNL     1       6.131  -0.025   1.590  1.00  0.00           H  
HETATM   62  H   UNL     1       3.062  -2.086   1.916  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.458  -1.865   0.463  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.816  -2.002   2.119  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.008   2.407   1.919  1.00  0.00           H  
HETATM   66  H   UNL     1     -10.131  -1.547  -2.271  1.00  0.00           H  
HETATM   67  H   UNL     1      -9.184  -0.920  -3.642  1.00  0.00           H  
HETATM   68  H   UNL     1      -9.085  -2.643  -3.204  1.00  0.00           H  
CONECT    1   33   33   34   31                                       
CONECT    2   32   32   31    3                                       
CONECT    3    2   29   29   36                                       
CONECT    4   21   16   15                                            
CONECT    5   26    6   37   38                                       
CONECT    6    5    7    9   39                                       
CONECT    7    8    6   40   41                                       
CONECT    8   27    7   42   43                                       
CONECT    9    6   19   19   10                                       
CONECT   10    9   11   11   44                                       
CONECT   11   10   10   12   45                                       
CONECT   12   25   25   11   24                                       
CONECT   13   24   14   46   47                                       
CONECT   14   13   23   48   49                                       
CONECT   15    4   50   51   52                                       
CONECT   16   17    4   20   20                                       
CONECT   17   23   16   18   53                                       
CONECT   18   17   54   55   56                                       
CONECT   19    9    9   25   57                                       
CONECT   20   16   16                                                 
CONECT   21   22    4   58   59                                       
CONECT   22   23   21   60   61                                       
CONECT   23   14   22   17                                            
CONECT   24   12   13                                                 
CONECT   25   19   12   12   62                                       
CONECT   26   27    5   63   64                                       
CONECT   27   28   26    8                                            
CONECT   28   30   30   29   27                                       
CONECT   29    3    3   28   65                                       
CONECT   30   31   28   28                                            
CONECT   31    1    2   30                                            
CONECT   32   33    2    2                                            
CONECT   33   32    1    1                                            
CONECT   34   35    1                                                 
CONECT   35   34   66   67   68                                       
CONECT   36    3                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   13                                                      
CONECT   47   13                                                      
CONECT   48   14                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   15                                                      
CONECT   52   15                                                      
CONECT   53   17                                                      
CONECT   54   18                                                      
CONECT   55   18                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   21                                                      
CONECT   59   21                                                      
CONECT   60   22                                                      
CONECT   61   22                                                      
CONECT   62   25                                                      
CONECT   63   26                                                      
CONECT   64   26                                                      
CONECT   65   29                                                      
CONECT   66   35                                                      
CONECT   67   35                                                      
CONECT   68   35                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
