COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.199  -3.023  -1.246  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.109  -2.908  -1.681  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.910  -1.886  -1.210  1.00  0.00           C  
HETATM    4  O   UNL     1       8.775  -0.058   0.626  1.00  0.00           O  
HETATM    5  C   UNL     1       7.268   1.612  -0.074  1.00  0.00           C  
HETATM    6  C   UNL     1       3.132  -2.237   0.148  1.00  0.00           C  
HETATM    7  C   UNL     1       1.701  -2.111  -0.336  1.00  0.00           C  
HETATM    8  C   UNL     1       3.936  -1.066  -0.425  1.00  0.00           C  
HETATM    9  C   UNL     1       4.824   1.099  -0.033  1.00  0.00           C  
HETATM   10  C   UNL     1       6.221   0.546   0.252  1.00  0.00           C  
HETATM   11  N   UNL     1       3.813   0.127   0.405  1.00  0.00           N1+
HETATM   12  C   UNL     1       8.645   1.068   0.207  1.00  0.00           C  
HETATM   13  O   UNL     1       9.726   1.833  -0.007  1.00  0.00           O  
HETATM   14  C   UNL     1      -0.403  -0.971  -0.296  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.527   0.097  -0.321  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.249   1.288   0.313  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.663   1.352  -0.205  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.967   2.149  -1.265  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.268   2.221  -1.758  1.00  0.00           C  
HETATM   20  C   UNL     1      -7.273   1.497  -1.194  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.997   0.662  -0.097  1.00  0.00           C  
HETATM   22  C   UNL     1      -8.008  -0.100   0.512  1.00  0.00           C  
HETATM   23  C   UNL     1      -7.704  -0.897   1.573  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.402  -0.969   2.066  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.398  -0.245   1.501  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.672   0.584   0.400  1.00  0.00           C  
HETATM   27  C   UNL     1       0.911  -1.090   0.131  1.00  0.00           C  
HETATM   28  C   UNL     1       1.473  -0.099   1.130  1.00  0.00           C  
HETATM   29  C   UNL     1       2.511   0.768   0.410  1.00  0.00           C  
HETATM   30  O   UNL     1      -1.186   0.036   0.171  1.00  0.00           O  
HETATM   31  H   UNL     1       1.824  -3.825  -1.611  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.505  -3.618  -2.392  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.931  -1.798  -1.552  1.00  0.00           H  
HETATM   34  H   UNL     1       7.194   1.885  -1.127  1.00  0.00           H  
HETATM   35  H   UNL     1       7.093   2.494   0.543  1.00  0.00           H  
HETATM   36  H   UNL     1       3.145  -2.195   1.237  1.00  0.00           H  
HETATM   37  H   UNL     1       3.564  -3.180  -0.189  1.00  0.00           H  
HETATM   38  H   UNL     1       4.987  -1.349  -0.483  1.00  0.00           H  
HETATM   39  H   UNL     1       3.572  -0.838  -1.427  1.00  0.00           H  
HETATM   40  H   UNL     1       4.686   2.035   0.507  1.00  0.00           H  
HETATM   41  H   UNL     1       4.715   1.278  -1.103  1.00  0.00           H  
HETATM   42  H   UNL     1       6.396  -0.336  -0.365  1.00  0.00           H  
HETATM   43  H   UNL     1       6.296   0.273   1.305  1.00  0.00           H  
HETATM   44  H   UNL     1       4.017  -0.130   1.360  1.00  0.00           H  
HETATM   45  H   UNL     1      10.588   1.440   0.188  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.050  -0.824  -0.064  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.512   0.216  -1.404  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.264   1.169   1.396  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.726   2.209   0.056  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.188   2.734  -1.732  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.483   2.862  -2.601  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.277   1.563  -1.587  1.00  0.00           H  
HETATM   53  H   UNL     1      -9.021  -0.054   0.141  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.482  -1.482   2.039  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.188  -1.609   2.909  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.394  -0.311   1.894  1.00  0.00           H  
HETATM   57  H   UNL     1       0.671   0.531   1.514  1.00  0.00           H  
HETATM   58  H   UNL     1       1.948  -0.634   1.952  1.00  0.00           H  
HETATM   59  H   UNL     1       2.587   1.730   0.917  1.00  0.00           H  
HETATM   60  H   UNL     1       2.189   0.932  -0.619  1.00  0.00           H  
CONECT    1    2    7    7   31                                       
CONECT    2    3    3    1   32                                       
CONECT    3    2    2   14   33                                       
CONECT    4   12   12                                                 
CONECT    5   10   12   34   35                                       
CONECT    6    7    8   36   37                                       
CONECT    7    1    1   27    6                                       
CONECT    8    6   11   38   39                                       
CONECT    9   11   10   40   41                                       
CONECT   10    9    5   42   43                                       
CONECT   11   29    8    9   44                                       
CONECT   12    5    4    4   13                                       
CONECT   13   12   45                                                 
CONECT   14    3   30   27   27                                       
CONECT   15   30   16   46   47                                       
CONECT   16   15   17   48   49                                       
CONECT   17   16   26   18   18                                       
CONECT   18   17   17   19   50                                       
CONECT   19   18   20   20   51                                       
CONECT   20   21   19   19   52                                       
CONECT   21   26   26   22   20                                       
CONECT   22   23   23   21   53                                       
CONECT   23   24   22   22   54                                       
CONECT   24   25   25   23   55                                       
CONECT   25   24   24   26   56                                       
CONECT   26   25   17   21   21                                       
CONECT   27   14   14    7   28                                       
CONECT   28   27   29   57   58                                       
CONECT   29   28   11   59   60                                       
CONECT   30   15   14                                                 
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    8                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   13                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   20                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   24                                                      
CONECT   56   25                                                      
CONECT   57   28                                                      
CONECT   58   28                                                      
CONECT   59   29                                                      
CONECT   60   29                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
