COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.938   2.518  -1.608  1.00  0.00           C  
HETATM    2  O   UNL     1       2.534   2.751  -1.744  1.00  0.00           O  
HETATM    3  C   UNL     1       4.559   3.611  -0.732  1.00  0.00           C  
HETATM    4  O   UNL     1       4.422   4.674   1.432  1.00  0.00           O  
HETATM    5  C   UNL     1       3.947   3.563   0.668  1.00  0.00           C  
HETATM    6  O   UNL     1      -6.724   2.326  -1.451  1.00  0.00           O  
HETATM    7  C   UNL     1       4.345   2.258   1.365  1.00  0.00           C  
HETATM    8  C   UNL     1       3.878   1.098   0.508  1.00  0.00           C  
HETATM    9  C   UNL     1       3.228   0.043   1.040  1.00  0.00           C  
HETATM   10  C   UNL     1       2.793  -1.059   0.179  1.00  0.00           C  
HETATM   11  C   UNL     1       2.150  -2.102   0.705  1.00  0.00           C  
HETATM   12  C   UNL     1       1.840  -2.204   2.191  1.00  0.00           C  
HETATM   13  C   UNL     1       4.171   1.179  -0.938  1.00  0.00           C  
HETATM   14  C   UNL     1       0.367  -2.540   2.414  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.087  -3.721   1.541  1.00  0.00           C  
HETATM   16  C   UNL     1       0.145  -3.337   0.098  1.00  0.00           C  
HETATM   17  C   UNL     1       1.676  -3.256  -0.127  1.00  0.00           C  
HETATM   18  C   UNL     1       1.742  -3.081  -1.646  1.00  0.00           C  
HETATM   19  C   UNL     1       0.669  -4.085  -2.154  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.317  -4.297  -0.988  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.473  -1.962  -0.164  1.00  0.00           C  
HETATM   22  C   UNL     1       4.617   0.125  -1.621  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.973  -2.011   0.133  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.590  -0.636  -0.130  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.090  -0.685   0.168  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.707   0.690  -0.095  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.207   0.641   0.203  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.824   2.016  -0.060  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.076   3.075   0.753  1.00  0.00           C  
HETATM   30  C   UNL     1      -8.297   2.002   0.355  1.00  0.00           C  
HETATM   31  H   UNL     1       4.408   2.524  -2.592  1.00  0.00           H  
HETATM   32  H   UNL     1       2.078   2.094  -2.288  1.00  0.00           H  
HETATM   33  H   UNL     1       5.635   3.451  -0.663  1.00  0.00           H  
HETATM   34  H   UNL     1       4.367   4.586  -1.179  1.00  0.00           H  
HETATM   35  H   UNL     1       4.074   4.708   2.334  1.00  0.00           H  
HETATM   36  H   UNL     1       2.861   3.615   0.590  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.097   3.185  -1.691  1.00  0.00           H  
HETATM   38  H   UNL     1       5.428   2.218   1.479  1.00  0.00           H  
HETATM   39  H   UNL     1       3.870   2.205   2.345  1.00  0.00           H  
HETATM   40  H   UNL     1       3.028   0.010   2.101  1.00  0.00           H  
HETATM   41  H   UNL     1       2.993  -1.027  -0.882  1.00  0.00           H  
HETATM   42  H   UNL     1       2.457  -2.985   2.634  1.00  0.00           H  
HETATM   43  H   UNL     1       2.068  -1.252   2.671  1.00  0.00           H  
HETATM   44  H   UNL     1       0.215  -2.795   3.463  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.238  -1.666   2.171  1.00  0.00           H  
HETATM   46  H   UNL     1       0.496  -4.609   1.786  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.147  -3.918   1.706  1.00  0.00           H  
HETATM   48  H   UNL     1       2.162  -4.181   0.184  1.00  0.00           H  
HETATM   49  H   UNL     1       1.481  -2.062  -1.929  1.00  0.00           H  
HETATM   50  H   UNL     1       2.729  -3.348  -2.023  1.00  0.00           H  
HETATM   51  H   UNL     1       0.150  -3.673  -3.020  1.00  0.00           H  
HETATM   52  H   UNL     1       1.138  -5.034  -2.415  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.276  -5.325  -0.627  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.328  -4.047  -1.309  1.00  0.00           H  
HETATM   55  H   UNL     1       0.002  -1.222   0.480  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.318  -1.688  -1.208  1.00  0.00           H  
HETATM   57  H   UNL     1       4.823   0.213  -2.678  1.00  0.00           H  
HETATM   58  H   UNL     1       4.774  -0.818  -1.117  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.447  -2.751  -0.512  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.127  -2.286   1.176  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.116   0.104   0.515  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.435  -0.361  -1.173  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.564  -1.425  -0.477  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.245  -0.960   1.211  1.00  0.00           H  
HETATM   65  H   UNL     1      -4.233   1.430   0.550  1.00  0.00           H  
HETATM   66  H   UNL     1      -4.552   0.965  -1.138  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.681  -0.099  -0.442  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.362   0.367   1.246  1.00  0.00           H  
HETATM   69  H   UNL     1      -6.515   4.055   0.566  1.00  0.00           H  
HETATM   70  H   UNL     1      -6.152   2.839   1.814  1.00  0.00           H  
HETATM   71  H   UNL     1      -5.026   3.085   0.457  1.00  0.00           H  
HETATM   72  H   UNL     1      -8.830   1.248  -0.224  1.00  0.00           H  
HETATM   73  H   UNL     1      -8.373   1.766   1.417  1.00  0.00           H  
HETATM   74  H   UNL     1      -8.736   2.982   0.168  1.00  0.00           H  
CONECT    1    2    3   13   31                                       
CONECT    2    1   32                                                 
CONECT    3    1    5   33   34                                       
CONECT    4    5   35                                                 
CONECT    5    3    4    7   36                                       
CONECT    6   28   37                                                 
CONECT    7    5    8   38   39                                       
CONECT    8    7    9    9   13                                       
CONECT    9    8    8   10   40                                       
CONECT   10    9   11   11   41                                       
CONECT   11   10   10   12   17                                       
CONECT   12   11   14   42   43                                       
CONECT   13    1    8   22   22                                       
CONECT   14   12   15   44   45                                       
CONECT   15   14   16   46   47                                       
CONECT   16   15   17   20   21                                       
CONECT   17   11   16   18   48                                       
CONECT   18   17   19   49   50                                       
CONECT   19   18   20   51   52                                       
CONECT   20   16   19   53   54                                       
CONECT   21   16   23   55   56                                       
CONECT   22   13   13   57   58                                       
CONECT   23   21   24   59   60                                       
CONECT   24   23   25   61   62                                       
CONECT   25   24   26   63   64                                       
CONECT   26   25   27   65   66                                       
CONECT   27   26   28   67   68                                       
CONECT   28    6   27   29   30                                       
CONECT   29   28   69   70   71                                       
CONECT   30   28   72   73   74                                       
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   20                                                      
CONECT   55   21                                                      
CONECT   56   21                                                      
CONECT   57   22                                                      
CONECT   58   22                                                      
CONECT   59   23                                                      
CONECT   60   23                                                      
CONECT   61   24                                                      
CONECT   62   24                                                      
CONECT   63   25                                                      
CONECT   64   25                                                      
CONECT   65   26                                                      
CONECT   66   26                                                      
CONECT   67   27                                                      
CONECT   68   27                                                      
CONECT   69   29                                                      
CONECT   70   29                                                      
CONECT   71   29                                                      
CONECT   72   30                                                      
CONECT   73   30                                                      
CONECT   74   30                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
