COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1       3.978   0.267  -0.916  1.00  0.00           C  
HETATM    2  C   UNL     1       4.826  -1.412   0.776  1.00  0.00           C  
HETATM    3  C   UNL     1       4.229  -0.570   1.911  1.00  0.00           C  
HETATM    4  C   UNL     1       3.381   1.109   0.218  1.00  0.00           C  
HETATM    5  C   UNL     1       1.893   0.163   1.916  1.00  0.00           C  
HETATM    6  C   UNL     1       0.767   0.897   1.300  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.470   0.285   1.184  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.537   0.986   0.598  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.325   2.309   0.136  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.059   2.903   0.268  1.00  0.00           C  
HETATM   11  C   UNL     1       0.959   2.212   0.842  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.749   1.068  -0.076  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.603   2.382  -0.553  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.398   3.010  -0.452  1.00  0.00           C  
HETATM   15  C   UNL     1       4.504   1.189  -2.018  1.00  0.00           C  
HETATM   16  C   UNL     1       6.313  -0.466  -0.922  1.00  0.00           C  
HETATM   17  C   UNL     1       8.641  -0.992  -0.989  1.00  0.00           C  
HETATM   18  C   UNL     1       9.680  -1.784  -0.194  1.00  0.00           C  
HETATM   19  C   UNL     1      11.045  -1.660  -0.874  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.066   0.397  -0.193  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.142   1.064  -0.776  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.365   0.433  -0.882  1.00  0.00           C  
HETATM   23  C   UNL     1      -7.524  -0.858  -0.412  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.459  -1.525   0.167  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.230  -0.906   0.274  1.00  0.00           C  
HETATM   26  C   UNL     1      -8.862  -1.541  -0.531  1.00  0.00           C  
HETATM   27  C   UNL     1      -8.868  -3.063  -0.681  1.00  0.00           C  
HETATM   28  C   UNL     1      -9.311  -2.422   0.636  1.00  0.00           C  
HETATM   29  N   UNL     1       5.084  -0.534  -0.374  1.00  0.00           N  
HETATM   30  N   UNL     1       3.122   0.232   1.369  1.00  0.00           N  
HETATM   31  N   UNL     1      -2.741   0.419   0.472  1.00  0.00           N  
HETATM   32  N   UNL     1      -9.898  -0.785  -1.248  1.00  0.00           N  
HETATM   33  O   UNL     1       1.710  -0.503   2.917  1.00  0.00           O  
HETATM   34  O   UNL     1       7.345  -1.110  -0.344  1.00  0.00           O  
HETATM   35  O   UNL     1       6.491   0.176  -1.938  1.00  0.00           O  
HETATM   36  H   UNL     1       3.213  -0.394  -1.323  1.00  0.00           H  
HETATM   37  H   UNL     1       5.760  -1.863   1.109  1.00  0.00           H  
HETATM   38  H   UNL     1       4.122  -2.194   0.492  1.00  0.00           H  
HETATM   39  H   UNL     1       3.854  -1.226   2.696  1.00  0.00           H  
HETATM   40  H   UNL     1       4.995   0.089   2.319  1.00  0.00           H  
HETATM   41  H   UNL     1       4.086   1.890   0.504  1.00  0.00           H  
HETATM   42  H   UNL     1       2.446   1.561  -0.114  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.613  -0.724   1.541  1.00  0.00           H  
HETATM   44  H   UNL     1       0.103   3.912  -0.083  1.00  0.00           H  
HETATM   45  H   UNL     1       1.930   2.674   0.941  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.444   2.892  -0.998  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.269   4.020  -0.813  1.00  0.00           H  
HETATM   48  H   UNL     1       5.319   1.797  -1.625  1.00  0.00           H  
HETATM   49  H   UNL     1       4.867   0.588  -2.852  1.00  0.00           H  
HETATM   50  H   UNL     1       3.699   1.839  -2.363  1.00  0.00           H  
HETATM   51  H   UNL     1       8.934   0.057  -1.027  1.00  0.00           H  
HETATM   52  H   UNL     1       8.579  -1.389  -2.003  1.00  0.00           H  
HETATM   53  H   UNL     1       9.742  -1.387   0.820  1.00  0.00           H  
HETATM   54  H   UNL     1       9.387  -2.833  -0.156  1.00  0.00           H  
HETATM   55  H   UNL     1      10.984  -2.057  -1.887  1.00  0.00           H  
HETATM   56  H   UNL     1      11.339  -0.611  -0.911  1.00  0.00           H  
HETATM   57  H   UNL     1      11.786  -2.224  -0.307  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.019   2.072  -1.143  1.00  0.00           H  
HETATM   59  H   UNL     1      -8.200   0.949  -1.333  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.589  -2.533   0.532  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.398  -1.430   0.722  1.00  0.00           H  
HETATM   62  H   UNL     1      -9.640  -3.504  -1.311  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.904  -3.571  -0.694  1.00  0.00           H  
HETATM   64  H   UNL     1      -8.639  -2.509   1.489  1.00  0.00           H  
HETATM   65  H   UNL     1     -10.375  -2.442   0.872  1.00  0.00           H  
HETATM   66  H   UNL     1      -9.804   0.206  -1.080  1.00  0.00           H  
HETATM   67  H   UNL     1      -9.874  -0.988  -2.236  1.00  0.00           H  
CONECT    1   15    4   29   36                                       
CONECT    2   29    3   37   38                                       
CONECT    3   30    2   39   40                                       
CONECT    4    1   30   41   42                                       
CONECT    5    6   30   33   33                                       
CONECT    6   11   11    7    5                                       
CONECT    7    8    8    6   43                                       
CONECT    8    9   31    7    7                                       
CONECT    9   14   10   10    8                                       
CONECT   10    9    9   11   44                                       
CONECT   11   10    6    6   45                                       
CONECT   12   13   20   31   31                                       
CONECT   13   14   14   12   46                                       
CONECT   14   13   13    9   47                                       
CONECT   15    1   48   49   50                                       
CONECT   16   35   35   29   34                                       
CONECT   17   18   34   51   52                                       
CONECT   18   19   17   53   54                                       
CONECT   19   18   55   56   57                                       
CONECT   20   21   12   25   25                                       
CONECT   21   22   22   20   58                                       
CONECT   22   21   21   23   59                                       
CONECT   23   22   26   24   24                                       
CONECT   24   23   23   25   60                                       
CONECT   25   20   20   24   61                                       
CONECT   26   32   23   27   28                                       
CONECT   27   26   28   62   63                                       
CONECT   28   26   27   64   65                                       
CONECT   29    1   16    2                                            
CONECT   30    4    5    3                                            
CONECT   31   12   12    8                                            
CONECT   32   26   66   67                                            
CONECT   33    5    5                                                 
CONECT   34   16   17                                                 
CONECT   35   16   16                                                 
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    4                                                      
CONECT   43    7                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   15                                                      
CONECT   50   15                                                      
CONECT   51   17                                                      
CONECT   52   17                                                      
CONECT   53   18                                                      
CONECT   54   18                                                      
CONECT   55   19                                                      
CONECT   56   19                                                      
CONECT   57   19                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   24                                                      
CONECT   61   25                                                      
CONECT   62   27                                                      
CONECT   63   27                                                      
CONECT   64   28                                                      
CONECT   65   28                                                      
CONECT   66   32                                                      
CONECT   67   32                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
