COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.319   1.128   0.034  1.00  0.00           N  
HETATM    2  N   UNL     1       2.290   0.349  -0.426  1.00  0.00           N  
HETATM    3  C   UNL     1      -2.065   0.129   3.519  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.326   0.943   3.815  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.031   1.767  -0.915  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.815   3.175  -1.643  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.924   2.253  -2.155  1.00  0.00           C  
HETATM    8  C   UNL     1       1.135  -1.717   0.370  1.00  0.00           C  
HETATM    9  C   UNL     1       3.520   0.969  -0.927  1.00  0.00           C  
HETATM   10  C   UNL     1       5.584   2.218  -0.280  1.00  0.00           C  
HETATM   11  C   UNL     1       6.498   1.139  -0.864  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.277  -5.654  -0.780  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.433   4.474  -1.120  1.00  0.00           C  
HETATM   14  O   UNL     1      -3.095   2.516  -0.568  1.00  0.00           O  
HETATM   15  O   UNL     1      -1.713   1.668  -2.084  1.00  0.00           O  
HETATM   16  O   UNL     1      -1.685   1.240   1.401  1.00  0.00           O  
HETATM   17  C   UNL     1      -1.910  -0.040   2.006  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.733  -0.931   1.716  1.00  0.00           C  
HETATM   19  O   UNL     1      -0.469  -1.822   2.495  1.00  0.00           O  
HETATM   20  N   UNL     1       0.032  -0.775   0.630  1.00  0.00           N  
HETATM   21  C   UNL     1      -0.165   0.309  -0.337  1.00  0.00           C  
HETATM   22  C   UNL     1       1.095   1.178  -0.350  1.00  0.00           C  
HETATM   23  C   UNL     1       4.300   1.571   0.243  1.00  0.00           C  
HETATM   24  C   UNL     1       6.303   2.928   0.870  1.00  0.00           C  
HETATM   25  C   UNL     1       2.344  -0.936  -0.071  1.00  0.00           C  
HETATM   26  O   UNL     1       3.416  -1.501  -0.105  1.00  0.00           O  
HETATM   27  C   UNL     1       0.725  -2.696  -0.732  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.432  -3.566  -0.237  1.00  0.00           C  
HETATM   29  S   UNL     1      -0.918  -4.726  -1.544  1.00  0.00           S  
HETATM   30  H   UNL     1      -1.194   0.650   3.917  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.146  -0.852   3.987  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.244   1.923   3.347  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.196   0.421   3.417  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.436   1.063   4.893  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.126   3.402  -2.456  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.613   2.026  -1.341  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.464   2.748  -2.962  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.484   1.328  -2.527  1.00  0.00           H  
HETATM   39  H   UNL     1       1.367  -2.269   1.281  1.00  0.00           H  
HETATM   40  H   UNL     1       4.131   0.215  -1.422  1.00  0.00           H  
HETATM   41  H   UNL     1       3.266   1.755  -1.637  1.00  0.00           H  
HETATM   42  H   UNL     1       5.336   2.943  -1.055  1.00  0.00           H  
HETATM   43  H   UNL     1       6.747   0.415  -0.089  1.00  0.00           H  
HETATM   44  H   UNL     1       5.986   0.634  -1.683  1.00  0.00           H  
HETATM   45  H   UNL     1       7.413   1.601  -1.237  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.915  -6.159   0.115  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.079  -4.967  -0.511  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.654  -6.393  -1.487  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.644   5.131  -0.756  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.974   4.969  -1.927  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.122   4.247  -0.307  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.815  -0.484   1.593  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.324  -0.114  -1.329  1.00  0.00           H  
HETATM   54  H   UNL     1       1.129   1.775   0.561  1.00  0.00           H  
HETATM   55  H   UNL     1       1.064   1.843  -1.213  1.00  0.00           H  
HETATM   56  H   UNL     1       3.689   2.325   0.739  1.00  0.00           H  
HETATM   57  H   UNL     1       4.554   0.784   0.954  1.00  0.00           H  
HETATM   58  H   UNL     1       6.551   2.203   1.645  1.00  0.00           H  
HETATM   59  H   UNL     1       7.217   3.389   0.497  1.00  0.00           H  
HETATM   60  H   UNL     1       5.651   3.696   1.286  1.00  0.00           H  
HETATM   61  H   UNL     1       0.409  -2.138  -1.614  1.00  0.00           H  
HETATM   62  H   UNL     1       1.573  -3.330  -0.988  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.115  -4.123   0.645  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.280  -2.931   0.020  1.00  0.00           H  
CONECT    1    5   16   21                                            
CONECT    2    9   22   25                                            
CONECT    3    4   17   30   31                                       
CONECT    4    3   32   33   34                                       
CONECT    5   14   15   15    1                                       
CONECT    6    7   13   14   35                                       
CONECT    7    6   36   37   38                                       
CONECT    8   25   20   27   39                                       
CONECT    9   23    2   40   41                                       
CONECT   10   24   11   23   42                                       
CONECT   11   10   43   44   45                                       
CONECT   12   29   46   47   48                                       
CONECT   13    6   49   50   51                                       
CONECT   14    6    5                                                 
CONECT   15    5    5                                                 
CONECT   16    1   17                                                 
CONECT   17   16   18    3   52                                       
CONECT   18   20   17   19   19                                       
CONECT   19   18   18                                                 
CONECT   20   21    8   18                                            
CONECT   21   22    1   20   53                                       
CONECT   22    2   21   54   55                                       
CONECT   23   10    9   56   57                                       
CONECT   24   10   58   59   60                                       
CONECT   25    2   26   26    8                                       
CONECT   26   25   25                                                 
CONECT   27    8   28   61   62                                       
CONECT   28   27   29   63   64                                       
CONECT   29   28   12                                                 
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   12                                                      
CONECT   48   12                                                      
CONECT   49   13                                                      
CONECT   50   13                                                      
CONECT   51   13                                                      
CONECT   52   17                                                      
CONECT   53   21                                                      
CONECT   54   22                                                      
CONECT   55   22                                                      
CONECT   56   23                                                      
CONECT   57   23                                                      
CONECT   58   24                                                      
CONECT   59   24                                                      
CONECT   60   24                                                      
CONECT   61   27                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   28                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
