COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.585  -0.195  -1.179  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.640   0.658  -0.912  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.321   0.561   0.287  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.470   1.491   0.579  1.00  0.00           C  
HETATM    5  C   UNL     1      -8.340  -0.872   0.018  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.213  -0.178   0.784  1.00  0.00           C  
HETATM    7  C   UNL     1      -7.721   1.995  -0.157  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.216  -1.150  -0.250  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.070  -2.083  -0.544  1.00  0.00           C  
HETATM   10  C   UNL     1       1.344  -2.149  -0.223  1.00  0.00           C  
HETATM   11  C   UNL     1       3.777  -2.294   0.053  1.00  0.00           C  
HETATM   12  N   UNL     1       0.180  -1.488  -0.067  1.00  0.00           N  
HETATM   13  C   UNL     1       4.761  -1.224  -0.431  1.00  0.00           C  
HETATM   14  C   UNL     1       2.450  -0.454   1.161  1.00  0.00           C  
HETATM   15  C   UNL     1       3.487   0.543   0.634  1.00  0.00           C  
HETATM   16  N   UNL     1       2.478  -1.652   0.309  1.00  0.00           N  
HETATM   17  C   UNL     1       5.789   0.789   0.219  1.00  0.00           C  
HETATM   18  C   UNL     1       6.907   2.738   0.716  1.00  0.00           C  
HETATM   19  N   UNL     1       4.794  -0.120   0.537  1.00  0.00           N  
HETATM   20  C   UNL     1       7.720   2.541  -0.390  1.00  0.00           C  
HETATM   21  C   UNL     1       7.511   1.416  -1.173  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.897  -1.247   0.949  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.948  -0.391   1.218  1.00  0.00           C  
HETATM   24  N   UNL     1       5.963   1.854   0.988  1.00  0.00           N  
HETATM   25  O   UNL     1       1.371  -3.194  -0.845  1.00  0.00           O  
HETATM   26  N   UNL     1       6.548   0.571  -0.845  1.00  0.00           N  
HETATM   27  N   UNL     1      -6.701   0.947  -0.010  1.00  0.00           N  
HETATM   28  C   UNL     1      -7.313   2.950  -1.280  1.00  0.00           C  
HETATM   29  H   UNL     1      -2.053  -0.119  -2.116  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.931   1.401  -1.640  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.595   1.587   1.657  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.263   2.470   0.148  1.00  0.00           H  
HETATM   33  H   UNL     1      -9.146  -0.162  -0.167  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.958  -1.243  -0.934  1.00  0.00           H  
HETATM   35  H   UNL     1      -8.719  -1.707   0.607  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.595   0.193   1.735  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.407  -0.888   0.969  1.00  0.00           H  
HETATM   38  H   UNL     1      -8.680   1.537  -0.400  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.810   2.549   0.777  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.237  -3.034  -0.037  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.005  -2.252  -1.619  1.00  0.00           H  
HETATM   42  H   UNL     1       3.662  -3.060  -0.714  1.00  0.00           H  
HETATM   43  H   UNL     1       4.151  -2.748   0.970  1.00  0.00           H  
HETATM   44  H   UNL     1       0.170  -0.618   0.362  1.00  0.00           H  
HETATM   45  H   UNL     1       5.757  -1.660  -0.520  1.00  0.00           H  
HETATM   46  H   UNL     1       4.440  -0.847  -1.402  1.00  0.00           H  
HETATM   47  H   UNL     1       2.696  -0.729   2.187  1.00  0.00           H  
HETATM   48  H   UNL     1       1.459  -0.002   1.130  1.00  0.00           H  
HETATM   49  H   UNL     1       3.184   0.896  -0.352  1.00  0.00           H  
HETATM   50  H   UNL     1       3.558   1.390   1.317  1.00  0.00           H  
HETATM   51  H   UNL     1       7.044   3.604   1.346  1.00  0.00           H  
HETATM   52  H   UNL     1       8.498   3.247  -0.636  1.00  0.00           H  
HETATM   53  H   UNL     1       8.127   1.233  -2.042  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.608  -1.993   1.675  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.480  -0.467   2.155  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.111   3.672  -1.451  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.401   3.476  -0.997  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.135   2.382  -2.194  1.00  0.00           H  
CONECT    1    8    8    2   29                                       
CONECT    2    3    3    1   30                                       
CONECT    3   23    4    2    2                                       
CONECT    4   27    3   31   32                                       
CONECT    5    6   33   34   35                                       
CONECT    6    5   27   36   37                                       
CONECT    7   28   27   38   39                                       
CONECT    8   22    9    1    1                                       
CONECT    9    8   12   40   41                                       
CONECT   10   25   25   12   16                                       
CONECT   11   16   13   42   43                                       
CONECT   12    9   10   44                                            
CONECT   13   11   19   45   46                                       
CONECT   14   16   15   47   48                                       
CONECT   15   14   19   49   50                                       
CONECT   16   10   11   14                                            
CONECT   17   19   24   24   26                                       
CONECT   18   24   20   20   51                                       
CONECT   19   13   15   17                                            
CONECT   20   18   18   21   52                                       
CONECT   21   26   26   20   53                                       
CONECT   22   23   23    8   54                                       
CONECT   23   22   22    3   55                                       
CONECT   24   17   17   18                                            
CONECT   25   10   10                                                 
CONECT   26   17   21   21                                            
CONECT   27    6    7    4                                            
CONECT   28    7   56   57   58                                       
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    4                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    9                                                      
CONECT   41    9                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   14                                                      
CONECT   49   15                                                      
CONECT   50   15                                                      
CONECT   51   18                                                      
CONECT   52   20                                                      
CONECT   53   21                                                      
CONECT   54   22                                                      
CONECT   55   23                                                      
CONECT   56   28                                                      
CONECT   57   28                                                      
CONECT   58   28                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
