COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.985   3.459  -0.068  1.00  0.00           O  
HETATM    2  C   UNL     1      -5.510  -0.047   1.031  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.673   1.052   1.044  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.220   1.591  -0.147  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.307   2.790  -0.130  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.851   2.322  -0.083  1.00  0.00           C  
HETATM    7  C   UNL     1       2.193   1.669   0.042  1.00  0.00           C  
HETATM    8  C   UNL     1       2.618   4.035   0.033  1.00  0.00           C  
HETATM    9  C   UNL     1       1.771   6.599  -0.015  1.00  0.00           C  
HETATM   10  C   UNL     1       2.695   0.283   0.064  1.00  0.00           C  
HETATM   11  C   UNL     1       2.206  -3.312   0.067  1.00  0.00           C  
HETATM   12  C   UNL     1       1.357  -3.486   1.237  1.00  0.00           C  
HETATM   13  C   UNL     1       0.789  -4.915   1.344  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.388  -5.034   0.414  1.00  0.00           C  
HETATM   15  C   UNL     1       0.004  -5.601  -0.964  1.00  0.00           C  
HETATM   16  C   UNL     1       1.326  -5.015  -1.496  1.00  0.00           C  
HETATM   17  C   UNL     1       4.069  -1.663   0.111  1.00  0.00           C  
HETATM   18  C   UNL     1       4.824   0.361   1.377  1.00  0.00           C  
HETATM   19  C   UNL     1       4.893   0.347  -1.136  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.429  -0.075  -1.369  1.00  0.00           C  
HETATM   21  N   UNL     1       1.981  -0.796   0.046  1.00  0.00           N  
HETATM   22  C   UNL     1      -7.149  -2.196   1.075  1.00  0.00           C  
HETATM   23  O   UNL     1      -6.713  -1.695  -0.191  1.00  0.00           O  
HETATM   24  C   UNL     1      -5.891  -0.614  -0.176  1.00  0.00           C  
HETATM   25  C   UNL     1       3.090   2.740   0.059  1.00  0.00           C  
HETATM   26  C   UNL     1       1.253   4.279  -0.010  1.00  0.00           C  
HETATM   27  C   UNL     1       1.440  -3.535  -1.253  1.00  0.00           C  
HETATM   28  C   UNL     1       4.146  -0.149   0.104  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.602   1.031  -1.352  1.00  0.00           C  
HETATM   30  C   UNL     1       0.352   3.216  -0.027  1.00  0.00           C  
HETATM   31  C   UNL     1       0.818   1.915  -0.001  1.00  0.00           C  
HETATM   32  N   UNL     1       2.753  -1.953   0.075  1.00  0.00           N  
HETATM   33  O   UNL     1       0.793   5.558  -0.034  1.00  0.00           O  
HETATM   34  O   UNL     1       4.995  -2.446   0.141  1.00  0.00           O  
HETATM   35  H   UNL     1      -5.864  -0.467   1.961  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.372   1.491   1.984  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.469   3.382  -1.031  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.521   3.398   0.748  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.636   1.714  -0.962  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.689   1.729   0.817  1.00  0.00           H  
HETATM   41  H   UNL     1       3.312   4.862   0.047  1.00  0.00           H  
HETATM   42  H   UNL     1       1.271   7.568  -0.038  1.00  0.00           H  
HETATM   43  H   UNL     1       2.367   6.520   0.894  1.00  0.00           H  
HETATM   44  H   UNL     1       2.420   6.505  -0.885  1.00  0.00           H  
HETATM   45  H   UNL     1       3.029  -4.024   0.120  1.00  0.00           H  
HETATM   46  H   UNL     1       1.941  -3.269   2.131  1.00  0.00           H  
HETATM   47  H   UNL     1       0.528  -2.780   1.179  1.00  0.00           H  
HETATM   48  H   UNL     1       1.555  -5.636   1.059  1.00  0.00           H  
HETATM   49  H   UNL     1       0.471  -5.107   2.369  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.131  -5.690   0.868  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.828  -4.046   0.276  1.00  0.00           H  
HETATM   52  H   UNL     1       0.106  -6.683  -0.882  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.790  -5.375  -1.675  1.00  0.00           H  
HETATM   54  H   UNL     1       2.158  -5.519  -1.004  1.00  0.00           H  
HETATM   55  H   UNL     1       1.388  -5.203  -2.568  1.00  0.00           H  
HETATM   56  H   UNL     1       5.843  -0.023   1.425  1.00  0.00           H  
HETATM   57  H   UNL     1       4.847   1.451   1.365  1.00  0.00           H  
HETATM   58  H   UNL     1       4.266   0.019   2.248  1.00  0.00           H  
HETATM   59  H   UNL     1       4.383  -0.006  -2.033  1.00  0.00           H  
HETATM   60  H   UNL     1       4.915   1.436  -1.136  1.00  0.00           H  
HETATM   61  H   UNL     1       5.913  -0.038  -1.124  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.728  -0.513  -2.310  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.698  -1.418   1.604  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.798  -3.058   0.921  1.00  0.00           H  
HETATM   65  H   UNL     1      -6.283  -2.495   1.665  1.00  0.00           H  
HETATM   66  H   UNL     1       4.153   2.553   0.093  1.00  0.00           H  
HETATM   67  H   UNL     1       0.444  -3.099  -1.176  1.00  0.00           H  
HETATM   68  H   UNL     1       1.984  -3.070  -2.075  1.00  0.00           H  
HETATM   69  H   UNL     1      -4.243   1.450  -2.280  1.00  0.00           H  
HETATM   70  H   UNL     1       0.121   1.090  -0.014  1.00  0.00           H  
CONECT    1    6   30                                                 
CONECT    2   24    3    3   35                                       
CONECT    3    2    2    4   36                                       
CONECT    4   29   29    3    5                                       
CONECT    5    4    6   37   38                                       
CONECT    6    5    1   39   40                                       
CONECT    7   10   31   31   25                                       
CONECT    8   25   25   26   41                                       
CONECT    9   33   42   43   44                                       
CONECT   10   28   21   21    7                                       
CONECT   11   27   32   12   45                                       
CONECT   12   11   13   46   47                                       
CONECT   13   14   12   48   49                                       
CONECT   14   15   13   50   51                                       
CONECT   15   16   14   52   53                                       
CONECT   16   27   15   54   55                                       
CONECT   17   34   34   32   28                                       
CONECT   18   28   56   57   58                                       
CONECT   19   28   59   60   61                                       
CONECT   20   24   24   29   62                                       
CONECT   21   32   10   10                                            
CONECT   22   23   63   64   65                                       
CONECT   23   22   24                                                 
CONECT   24   23   20   20    2                                       
CONECT   25    7    8    8   66                                       
CONECT   26   30   30    8   33                                       
CONECT   27   16   11   67   68                                       
CONECT   28   19   17   10   18                                       
CONECT   29   20    4    4   69                                       
CONECT   30   31    1   26   26                                       
CONECT   31    7    7   30   70                                       
CONECT   32   11   17   21                                            
CONECT   33   26    9                                                 
CONECT   34   17   17                                                 
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   12                                                      
CONECT   48   13                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   14                                                      
CONECT   52   15                                                      
CONECT   53   15                                                      
CONECT   54   16                                                      
CONECT   55   16                                                      
CONECT   56   18                                                      
CONECT   57   18                                                      
CONECT   58   18                                                      
CONECT   59   19                                                      
CONECT   60   19                                                      
CONECT   61   19                                                      
CONECT   62   20                                                      
CONECT   63   22                                                      
CONECT   64   22                                                      
CONECT   65   22                                                      
CONECT   66   25                                                      
CONECT   67   27                                                      
CONECT   68   27                                                      
CONECT   69   29                                                      
CONECT   70   31                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
