COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.174  -0.212   8.939  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.468   0.917   7.335  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.521   2.202   6.499  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.782   2.213   5.595  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.307   1.921   4.161  1.00  0.00           C  
HETATM    6  O   UNL     1      -0.300   0.952   8.128  1.00  0.00           O  
HETATM    7  C   UNL     1      -0.841   1.520   4.313  1.00  0.00           C  
HETATM    8  C   UNL     1       0.061   1.595   3.076  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.548   0.770   1.927  1.00  0.00           C  
HETATM   10  C   UNL     1       0.469   0.560   0.818  1.00  0.00           C  
HETATM   11  C   UNL     1       1.661  -0.170   1.373  1.00  0.00           C  
HETATM   12  C   UNL     1       2.166  -1.238   0.734  1.00  0.00           C  
HETATM   13  C   UNL     1       3.297  -2.008   1.309  1.00  0.00           C  
HETATM   14  O   UNL     1       3.737  -2.990   0.717  1.00  0.00           O  
HETATM   15  C   UNL     1       3.823  -1.586   2.660  1.00  0.00           C  
HETATM   16  C   UNL     1       3.650  -0.086   2.860  1.00  0.00           C  
HETATM   17  C   UNL     1       2.214   0.343   2.634  1.00  0.00           C  
HETATM   18  C   UNL     1       1.500   1.172   3.441  1.00  0.00           C  
HETATM   19  C   UNL     1       2.072   1.761   4.748  1.00  0.00           C  
HETATM   20  C   UNL     1       1.027   1.863   5.904  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.350   2.398   5.480  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.237   3.907   5.128  1.00  0.00           C  
HETATM   23  C   UNL     1       2.920   3.023   4.576  1.00  0.00           C  
HETATM   24  C   UNL     1       3.540   3.595   5.683  1.00  0.00           C  
HETATM   25  C   UNL     1       4.313   4.745   5.526  1.00  0.00           C  
HETATM   26  C   UNL     1       4.464   5.318   4.263  1.00  0.00           C  
HETATM   27  C   UNL     1       5.270   6.518   4.100  1.00  0.00           C  
HETATM   28  N   UNL     1       5.449   7.098   2.948  1.00  0.00           N  
HETATM   29  O   UNL     1       6.266   8.219   3.118  1.00  0.00           O  
HETATM   30  C   UNL     1       3.841   4.740   3.157  1.00  0.00           C  
HETATM   31  C   UNL     1       3.068   3.590   3.313  1.00  0.00           C  
HETATM   32  O   UNL     1      -1.578   3.286   7.425  1.00  0.00           O  
HETATM   33  C   UNL     1      -2.724   3.194   8.258  1.00  0.00           C  
HETATM   34  H   UNL     1       0.648  -0.828   8.568  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.109  -0.778   8.913  1.00  0.00           H  
HETATM   36  H   UNL     1       0.037   0.092   9.967  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.435   0.055   6.673  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.345   0.863   7.975  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.297   3.181   5.630  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.508   1.456   5.917  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.904   1.129   3.697  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.408   2.821   3.543  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.841   0.469   4.645  1.00  0.00           H  
HETATM   44  H   UNL     1       0.119   2.638   2.735  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.425   1.287   1.522  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.897  -0.204   2.296  1.00  0.00           H  
HETATM   47  H   UNL     1       0.787   1.525   0.404  1.00  0.00           H  
HETATM   48  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   49  H   UNL     1       1.750  -1.599  -0.201  1.00  0.00           H  
HETATM   50  H   UNL     1       3.290  -2.154   3.432  1.00  0.00           H  
HETATM   51  H   UNL     1       4.887  -1.839   2.713  1.00  0.00           H  
HETATM   52  H   UNL     1       4.284   0.451   2.140  1.00  0.00           H  
HETATM   53  H   UNL     1       4.035   0.171   3.848  1.00  0.00           H  
HETATM   54  H   UNL     1       2.797   1.044   5.152  1.00  0.00           H  
HETATM   55  H   UNL     1       0.906   0.849   6.310  1.00  0.00           H  
HETATM   56  H   UNL     1       1.428   2.470   6.727  1.00  0.00           H  
HETATM   57  H   UNL     1       0.156   4.472   5.978  1.00  0.00           H  
HETATM   58  H   UNL     1       0.435   4.054   4.277  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.218   4.315   4.867  1.00  0.00           H  
HETATM   60  H   UNL     1       3.428   3.156   6.670  1.00  0.00           H  
HETATM   61  H   UNL     1       4.795   5.186   6.395  1.00  0.00           H  
HETATM   62  H   UNL     1       5.749   6.947   5.009  1.00  0.00           H  
HETATM   63  H   UNL     1       6.329   8.555   2.208  1.00  0.00           H  
HETATM   64  H   UNL     1       3.952   5.177   2.168  1.00  0.00           H  
HETATM   65  H   UNL     1       2.586   3.147   2.446  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.415   2.950   9.277  1.00  0.00           H  
HETATM   67  H   UNL     1      -3.394   2.422   7.873  1.00  0.00           H  
HETATM   68  H   UNL     1      -3.242   4.156   8.257  1.00  0.00           H  
CONECT    1    6   34   35   36                                       
CONECT    2    6    3   37   38                                       
CONECT    3    2    4   32   21                                       
CONECT    4    3    5   39   40                                       
CONECT    5    4    7   41   42                                       
CONECT    6    1    2                                                 
CONECT    7    5   21    8   43                                       
CONECT    8    7    9   18   44                                       
CONECT    9    8   10   45   46                                       
CONECT   10    9   11   47   48                                       
CONECT   11   10   12   12   17                                       
CONECT   12   11   11   13   49                                       
CONECT   13   12   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15   13   16   50   51                                       
CONECT   16   15   17   52   53                                       
CONECT   17   11   16   18   18                                       
CONECT   18    8   17   17   19                                       
CONECT   19   18   20   23   54                                       
CONECT   20   19   21   55   56                                       
CONECT   21    3    7   20   22                                       
CONECT   22   21   57   58   59                                       
CONECT   23   19   24   24   31                                       
CONECT   24   23   23   25   60                                       
CONECT   25   24   26   26   61                                       
CONECT   26   25   25   30   27                                       
CONECT   27   26   28   28   62                                       
CONECT   28   27   27   29                                            
CONECT   29   28   63                                                 
CONECT   30   26   31   31   64                                       
CONECT   31   23   30   30   65                                       
CONECT   32    3   33                                                 
CONECT   33   32   66   67   68                                       
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    2                                                      
CONECT   39    4                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    5                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45    9                                                      
CONECT   46    9                                                      
CONECT   47   10                                                      
CONECT   48   10                                                      
CONECT   49   12                                                      
CONECT   50   15                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   16                                                      
CONECT   54   19                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   22                                                      
CONECT   58   22                                                      
CONECT   59   22                                                      
CONECT   60   24                                                      
CONECT   61   25                                                      
CONECT   62   27                                                      
CONECT   63   29                                                      
CONECT   64   30                                                      
CONECT   65   31                                                      
CONECT   66   33                                                      
CONECT   67   33                                                      
CONECT   68   33                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
