COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.910  -0.308  -2.636  1.00  0.00           O  
HETATM    2  C   UNL     1       2.683   0.120  -1.626  1.00  0.00           C  
HETATM    3  O   UNL     1       3.802   0.518  -1.849  1.00  0.00           O  
HETATM    4  C   UNL     1       2.157   0.103  -0.214  1.00  0.00           C  
HETATM    5  O   UNL     1       3.196   0.491   0.686  1.00  0.00           O  
HETATM    6  C   UNL     1       3.981  -0.599   1.173  1.00  0.00           C  
HETATM    7  C   UNL     1       4.648  -1.313  -0.005  1.00  0.00           C  
HETATM    8  C   UNL     1       5.057  -0.069   2.123  1.00  0.00           C  
HETATM    9  C   UNL     1       3.079  -1.583   1.921  1.00  0.00           C  
HETATM   10  C   UNL     1       1.004   1.067  -0.097  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.319   0.642  -0.018  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.709  -0.781  -0.043  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.984  -1.415  -1.375  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.791  -1.419   1.102  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.166  -2.867   1.225  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.834  -3.351  -0.064  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.218  -2.711  -0.197  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.972  -4.874  -0.031  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.951  -2.940  -1.250  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.227   1.666   0.085  1.00  0.00           C  
HETATM   21  S   UNL     1      -0.372   3.203   0.082  1.00  0.00           S  
HETATM   22  C   UNL     1       1.178   2.386  -0.054  1.00  0.00           C  
HETATM   23  C   UNL     1       2.514   3.080  -0.117  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.689   1.504   0.183  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.508   2.632   0.277  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.877   2.463   0.368  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.387   1.171   0.362  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.521   0.098   0.265  1.00  0.00           C  
HETATM   29  N   UNL     1      -3.220   0.285   0.174  1.00  0.00           N  
HETATM   30  H   UNL     1       2.291  -0.278  -3.524  1.00  0.00           H  
HETATM   31  H   UNL     1       1.817  -0.902   0.035  1.00  0.00           H  
HETATM   32  H   UNL     1       5.290  -0.612  -0.538  1.00  0.00           H  
HETATM   33  H   UNL     1       5.246  -2.145   0.366  1.00  0.00           H  
HETATM   34  H   UNL     1       3.881  -1.691  -0.682  1.00  0.00           H  
HETATM   35  H   UNL     1       4.582   0.440   2.962  1.00  0.00           H  
HETATM   36  H   UNL     1       5.655  -0.901   2.494  1.00  0.00           H  
HETATM   37  H   UNL     1       5.699   0.632   1.590  1.00  0.00           H  
HETATM   38  H   UNL     1       2.313  -1.960   1.245  1.00  0.00           H  
HETATM   39  H   UNL     1       3.678  -2.414   2.293  1.00  0.00           H  
HETATM   40  H   UNL     1       2.604  -1.074   2.760  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.968  -1.103  -1.727  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.226  -1.096  -2.090  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.576  -0.871   2.007  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.269  -3.458   1.411  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.860  -2.991   2.057  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.835  -3.001   0.654  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.116  -1.626  -0.219  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.688  -3.052  -1.119  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.583  -5.165   0.824  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.448  -5.215  -0.951  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.985  -5.327   0.056  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.332  -3.391  -2.165  1.00  0.00           H  
HETATM   53  H   UNL     1       0.073  -3.270  -1.074  1.00  0.00           H  
HETATM   54  H   UNL     1       2.766   3.290  -1.156  1.00  0.00           H  
HETATM   55  H   UNL     1       2.464   4.016   0.440  1.00  0.00           H  
HETATM   56  H   UNL     1       3.278   2.438   0.320  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.077   3.623   0.280  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.535   3.316   0.443  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.452   1.006   0.432  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.916  -0.907   0.260  1.00  0.00           H  
CONECT    1    2   30                                                 
CONECT    2    3    3    1    4                                       
CONECT    3    2    2                                                 
CONECT    4    2   10    5   31                                       
CONECT    5    4    6                                                 
CONECT    6    5    9    7    8                                       
CONECT    7    6   32   33   34                                       
CONECT    8    6   35   36   37                                       
CONECT    9    6   38   39   40                                       
CONECT   10    4   11   22   22                                       
CONECT   11   12   10   20   20                                       
CONECT   12   13   11   14   14                                       
CONECT   13   19   12   41   42                                       
CONECT   14   12   12   15   43                                       
CONECT   15   16   14   44   45                                       
CONECT   16   19   17   18   15                                       
CONECT   17   16   46   47   48                                       
CONECT   18   16   49   50   51                                       
CONECT   19   13   16   52   53                                       
CONECT   20   11   11   24   21                                       
CONECT   21   20   22                                                 
CONECT   22   10   10   23   21                                       
CONECT   23   22   54   55   56                                       
CONECT   24   25   20   29   29                                       
CONECT   25   26   26   24   57                                       
CONECT   26   25   25   27   58                                       
CONECT   27   26   28   28   59                                       
CONECT   28   27   27   29   60                                       
CONECT   29   24   24   28                                            
CONECT   30    1                                                      
CONECT   31    4                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39    9                                                      
CONECT   40    9                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   17                                                      
CONECT   47   17                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   18                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   19                                                      
CONECT   54   23                                                      
CONECT   55   23                                                      
CONECT   56   23                                                      
CONECT   57   25                                                      
CONECT   58   26                                                      
CONECT   59   27                                                      
CONECT   60   28                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
