COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.903   0.247  -0.023  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.081  -0.446   0.609  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.341   0.392   0.401  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.507  -0.245   1.160  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.188  -0.278   2.656  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.936  -1.130   2.888  1.00  0.00           C  
HETATM    7  N   UNL     1      -1.847  -0.609   2.050  1.00  0.00           N  
HETATM    8  O   UNL     1      -0.471   1.267   0.459  1.00  0.00           O  
HETATM    9  O   UNL     1      -0.332  -0.268  -1.123  1.00  0.00           O  
HETATM   10  C   UNL     1      -0.658  -0.282   2.594  1.00  0.00           C  
HETATM   11  O   UNL     1       0.345  -0.298   1.912  1.00  0.00           O  
HETATM   12  C   UNL     1      -0.576   0.100   4.033  1.00  0.00           C  
HETATM   13  O   UNL     1      -1.587   0.233   4.680  1.00  0.00           O  
HETATM   14  C   UNL     1       0.766   0.320   4.679  1.00  0.00           C  
HETATM   15  C   UNL     1       0.570   0.701   6.147  1.00  0.00           C  
HETATM   16  C   UNL     1       1.934   0.924   6.803  1.00  0.00           C  
HETATM   17  C   UNL     1       1.502   1.449   3.954  1.00  0.00           C  
HETATM   18  C   UNL     1       1.591  -0.964   4.590  1.00  0.00           C  
HETATM   19  C   UNL     1       0.803   0.400  -1.733  1.00  0.00           C  
HETATM   20  C   UNL     1       0.803   0.133  -3.239  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.492   0.669  -3.852  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.492   0.407  -5.336  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.018  -0.772  -5.829  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.018  -1.012  -7.190  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.492  -0.074  -8.058  1.00  0.00           C  
HETATM   26  C   UNL     1       0.032   1.105  -7.565  1.00  0.00           C  
HETATM   27  C   UNL     1       0.028   1.348  -6.204  1.00  0.00           C  
HETATM   28  C   UNL     1       2.080  -0.127  -1.129  1.00  0.00           C  
HETATM   29  C   UNL     1       2.139  -1.427  -0.665  1.00  0.00           C  
HETATM   30  C   UNL     1       3.310  -1.911  -0.112  1.00  0.00           C  
HETATM   31  C   UNL     1       4.421  -1.094  -0.023  1.00  0.00           C  
HETATM   32  C   UNL     1       4.362   0.206  -0.488  1.00  0.00           C  
HETATM   33  C   UNL     1       3.193   0.688  -1.045  1.00  0.00           C  
HETATM   34  H   UNL     1      -2.216  -1.426   0.153  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.579   0.437  -0.660  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.170   1.400   0.779  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.662  -1.262   0.799  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.412   0.339   0.994  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.028  -0.712   3.198  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.009   0.735   3.012  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.142  -2.165   2.617  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.646  -1.076   3.938  1.00  0.00           H  
HETATM   43  H   UNL     1       0.046  -0.103   6.664  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.017   1.616   6.210  1.00  0.00           H  
HETATM   45  H   UNL     1       1.794   1.195   7.850  1.00  0.00           H  
HETATM   46  H   UNL     1       2.522   0.009   6.741  1.00  0.00           H  
HETATM   47  H   UNL     1       2.458   1.729   6.287  1.00  0.00           H  
HETATM   48  H   UNL     1       0.914   2.365   4.016  1.00  0.00           H  
HETATM   49  H   UNL     1       2.473   1.609   4.421  1.00  0.00           H  
HETATM   50  H   UNL     1       1.642   1.179   2.907  1.00  0.00           H  
HETATM   51  H   UNL     1       1.068  -1.768   5.107  1.00  0.00           H  
HETATM   52  H   UNL     1       1.732  -1.235   3.544  1.00  0.00           H  
HETATM   53  H   UNL     1       2.563  -0.805   5.058  1.00  0.00           H  
HETATM   54  H   UNL     1       0.733   1.473  -1.553  1.00  0.00           H  
HETATM   55  H   UNL     1       1.656   0.635  -3.697  1.00  0.00           H  
HETATM   56  H   UNL     1       0.874  -0.938  -3.419  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.344   0.167  -3.394  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.562   1.742  -3.672  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.428  -1.505  -5.151  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.428  -1.934  -7.576  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.492  -0.262  -9.122  1.00  0.00           H  
HETATM   62  H   UNL     1       0.443   1.839  -8.243  1.00  0.00           H  
HETATM   63  H   UNL     1       0.438   2.269  -5.818  1.00  0.00           H  
HETATM   64  H   UNL     1       1.271  -2.066  -0.735  1.00  0.00           H  
HETATM   65  H   UNL     1       3.356  -2.927   0.250  1.00  0.00           H  
HETATM   66  H   UNL     1       5.336  -1.472   0.409  1.00  0.00           H  
HETATM   67  H   UNL     1       5.230   0.844  -0.418  1.00  0.00           H  
HETATM   68  H   UNL     1       3.146   1.704  -1.408  1.00  0.00           H  
CONECT    1    2    8    8    9                                       
CONECT    2    1    3    7   34                                       
CONECT    3    2    4   35   36                                       
CONECT    4    3    5   37   38                                       
CONECT    5    4    6   39   40                                       
CONECT    6    5    7   41   42                                       
CONECT    7    2    6   10                                            
CONECT    8    1    1                                                 
CONECT    9    1   19                                                 
CONECT   10    7   11   11   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14   12   15   17   18                                       
CONECT   15   14   16   43   44                                       
CONECT   16   15   45   46   47                                       
CONECT   17   14   48   49   50                                       
CONECT   18   14   51   52   53                                       
CONECT   19    9   20   28   54                                       
CONECT   20   19   21   55   56                                       
CONECT   21   20   22   57   58                                       
CONECT   22   21   23   23   27                                       
CONECT   23   22   22   24   59                                       
CONECT   24   23   25   25   60                                       
CONECT   25   24   24   26   61                                       
CONECT   26   25   27   27   62                                       
CONECT   27   22   26   26   63                                       
CONECT   28   19   29   29   33                                       
CONECT   29   28   28   30   64                                       
CONECT   30   29   31   31   65                                       
CONECT   31   30   30   32   66                                       
CONECT   32   31   33   33   67                                       
CONECT   33   28   32   32   68                                       
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   23                                                      
CONECT   60   24                                                      
CONECT   61   25                                                      
CONECT   62   26                                                      
CONECT   63   27                                                      
CONECT   64   29                                                      
CONECT   65   30                                                      
CONECT   66   31                                                      
CONECT   67   32                                                      
CONECT   68   33                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
