COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.910   0.928  -2.153  1.00  0.00           C  
HETATM    2  N   UNL     1      -5.345   0.528   0.225  1.00  0.00           N  
HETATM    3  O   UNL     1       7.890  -1.426  -0.871  1.00  0.00           O  
HETATM    4  C   UNL     1      -5.961  -0.065  -0.989  1.00  0.00           C  
HETATM    5  N   UNL     1      -4.265  -3.157   0.049  1.00  0.00           N  
HETATM    6  C   UNL     1      -7.424  -0.346  -0.586  1.00  0.00           C  
HETATM    7  N   UNL     1      -0.652  -2.531   0.004  1.00  0.00           N  
HETATM    8  C   UNL     1      -7.399  -0.471   0.951  1.00  0.00           C  
HETATM    9  N   UNL     1       0.501  -0.473   0.067  1.00  0.00           N  
HETATM   10  C   UNL     1      -5.923  -0.256   1.347  1.00  0.00           C  
HETATM   11  N   UNL     1       1.730   1.512   0.125  1.00  0.00           N  
HETATM   12  C   UNL     1      -3.972   0.406   0.193  1.00  0.00           C  
HETATM   13  N   UNL     1       5.055   0.250   0.006  1.00  0.00           N  
HETATM   14  C   UNL     1      -3.273  -0.789   0.129  1.00  0.00           C  
HETATM   15  N   UNL     1       4.307  -0.935  -0.024  1.00  0.00           N  
HETATM   16  C   UNL     1      -3.826  -2.109   0.085  1.00  0.00           C  
HETATM   17  N   UNL     1      -0.600   1.568   0.174  1.00  0.00           N  
HETATM   18  C   UNL     1      -1.844  -0.427   0.116  1.00  0.00           C  
HETATM   19  N   UNL     1      -3.085   1.442   0.218  1.00  0.00           N  
HETATM   20  C   UNL     1      -0.645  -1.147   0.062  1.00  0.00           C  
HETATM   21  C   UNL     1       0.511   0.853   0.122  1.00  0.00           C  
HETATM   22  C   UNL     1       2.928   0.775   0.070  1.00  0.00           C  
HETATM   23  C   UNL     1       4.184   1.291   0.067  1.00  0.00           C  
HETATM   24  C   UNL     1       4.546   2.753   0.122  1.00  0.00           C  
HETATM   25  C   UNL     1       3.037  -0.622   0.017  1.00  0.00           C  
HETATM   26  C   UNL     1       6.516   0.348  -0.019  1.00  0.00           C  
HETATM   27  C   UNL     1       7.134  -0.471   1.141  1.00  0.00           C  
HETATM   28  C   UNL     1       8.363  -1.123   0.459  1.00  0.00           C  
HETATM   29  C   UNL     1       7.080  -0.314  -1.291  1.00  0.00           C  
HETATM   30  C   UNL     1      -1.793   0.974   0.173  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.457   2.858   0.284  1.00  0.00           C  
HETATM   32  H   UNL     1      -4.872   1.181  -2.369  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.365   0.477  -3.035  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.455   1.832  -1.883  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.455  -0.992  -1.259  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.066   0.482  -0.888  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.769  -1.277  -1.036  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.495  -3.012   0.000  1.00  0.00           H  
HETATM   39  H   UNL     1       0.185  -3.019  -0.034  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.028   0.295   1.404  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.732  -1.464   1.256  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.412  -1.214   1.445  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.857   0.308   2.278  1.00  0.00           H  
HETATM   44  H   UNL     1       1.757   2.481   0.166  1.00  0.00           H  
HETATM   45  H   UNL     1       4.614   3.149  -0.891  1.00  0.00           H  
HETATM   46  H   UNL     1       3.780   3.297   0.675  1.00  0.00           H  
HETATM   47  H   UNL     1       5.507   2.870   0.623  1.00  0.00           H  
HETATM   48  H   UNL     1       2.214  -1.320   0.008  1.00  0.00           H  
HETATM   49  H   UNL     1       6.829   1.390   0.039  1.00  0.00           H  
HETATM   50  H   UNL     1       7.443   0.182   1.957  1.00  0.00           H  
HETATM   51  H   UNL     1       6.436  -1.230   1.496  1.00  0.00           H  
HETATM   52  H   UNL     1       8.652  -2.036   0.981  1.00  0.00           H  
HETATM   53  H   UNL     1       9.197  -0.423   0.420  1.00  0.00           H  
HETATM   54  H   UNL     1       7.690   0.401  -1.842  1.00  0.00           H  
HETATM   55  H   UNL     1       6.262  -0.668  -1.918  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.529   3.166   1.327  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.699   3.457  -0.220  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.420   3.003  -0.205  1.00  0.00           H  
CONECT    1    4   32   33   34                                       
CONECT    2    4   10   12                                            
CONECT    3   28   29                                                 
CONECT    4    6    1    2   35                                       
CONECT    5   16   16   16                                            
CONECT    6    8    4   36   37                                       
CONECT    7   20   38   39                                            
CONECT    8    6   10   40   41                                       
CONECT    9   20   20   21                                            
CONECT   10    8    2   42   43                                       
CONECT   11   21   22   44                                            
CONECT   12    2   19   14   14                                       
CONECT   13   15   23   26                                            
CONECT   14   12   12   16   18                                       
CONECT   15   25   25   13                                            
CONECT   16    5    5    5   14                                       
CONECT   17   30   21   21                                            
CONECT   18   14   30   30   20                                       
CONECT   19   31   12   30                                            
CONECT   20   18    7    9    9                                       
CONECT   21   17   17    9   11                                       
CONECT   22   25   11   23   23                                       
CONECT   23   22   22   13   24                                       
CONECT   24   23   45   46   47                                       
CONECT   25   15   15   22   48                                       
CONECT   26   27   13   29   49                                       
CONECT   27   28   26   50   51                                       
CONECT   28   27    3   52   53                                       
CONECT   29    3   26   54   55                                       
CONECT   30   19   18   18   17                                       
CONECT   31   19   56   57   58                                       
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    4                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42   10                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   24                                                      
CONECT   46   24                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
CONECT   51   27                                                      
CONECT   52   28                                                      
CONECT   53   28                                                      
CONECT   54   29                                                      
CONECT   55   29                                                      
CONECT   56   31                                                      
CONECT   57   31                                                      
CONECT   58   31                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
