COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.944   2.196   1.064  1.00  0.00           C  
HETATM    2  N   UNL     1       1.121   1.597  -0.072  1.00  0.00           N  
HETATM    3  O   UNL     1      -1.732   1.885   1.932  1.00  0.00           O  
HETATM    4  C   UNL     1       0.495   1.805   1.242  1.00  0.00           C  
HETATM    5  C   UNL     1       1.233   2.927   1.976  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.892  -2.800  -2.008  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.590  -3.163   2.510  1.00  0.00           C  
HETATM    8  O   UNL     1       8.348  -2.750   0.147  1.00  0.00           O  
HETATM    9  O   UNL     1       0.065  -0.629  -0.220  1.00  0.00           O  
HETATM   10  O   UNL     1       1.288   0.325  -2.180  1.00  0.00           O  
HETATM   11  C   UNL     1      -5.378   0.253  -0.984  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.221  -0.793  -1.310  1.00  0.00           C  
HETATM   13  C   UNL     1       2.621  -1.479   0.892  1.00  0.00           C  
HETATM   14  C   UNL     1       3.764  -2.117   1.312  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.588  -0.973   0.925  1.00  0.00           C  
HETATM   16  C   UNL     1       3.788  -0.567  -0.982  1.00  0.00           C  
HETATM   17  C   UNL     1       2.704   2.940   1.576  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.757   2.338  -0.408  1.00  0.00           C  
HETATM   19  C   UNL     1       2.864   3.319   0.108  1.00  0.00           C  
HETATM   20  C   UNL     1       0.645   3.824  -0.961  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.768   3.385   0.107  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.688   3.109  -1.229  1.00  0.00           C  
HETATM   23  N   UNL     1       6.187  -2.569   0.869  1.00  0.00           N  
HETATM   24  O   UNL     1      -7.084  -2.959  -0.840  1.00  0.00           O  
HETATM   25  O   UNL     1      -5.466  -3.135   1.381  1.00  0.00           O  
HETATM   26  O   UNL     1      -3.733   1.196   0.452  1.00  0.00           O  
HETATM   27  S   UNL     1       6.578  -1.271  -1.229  1.00  0.00           S  
HETATM   28  C   UNL     1      -4.561   0.166   0.133  1.00  0.00           C  
HETATM   29  C   UNL     1       2.621  -0.703  -0.255  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.254  -1.929  -0.518  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.439  -2.017   0.606  1.00  0.00           C  
HETATM   32  C   UNL     1       7.211  -2.328   0.044  1.00  0.00           C  
HETATM   33  C   UNL     1       4.959  -1.997   0.587  1.00  0.00           C  
HETATM   34  C   UNL     1       4.939  -1.212  -0.566  1.00  0.00           C  
HETATM   35  C   UNL     1       1.723   2.760  -0.728  1.00  0.00           C  
HETATM   36  N   UNL     1      -1.405   2.857   0.012  1.00  0.00           N  
HETATM   37  S   UNL     1       1.146   0.102  -0.784  1.00  0.00           S  
HETATM   38  H   UNL     1       0.554   0.885   1.823  1.00  0.00           H  
HETATM   39  H   UNL     1       0.780   3.885   1.719  1.00  0.00           H  
HETATM   40  H   UNL     1       1.152   2.769   3.051  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.504  -3.691  -2.150  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.538  -1.931  -1.888  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.250  -2.659  -2.878  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.559  -3.066   2.171  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.832  -2.336   3.178  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.712  -4.107   3.040  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.353   1.138  -1.602  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.854  -0.725  -2.182  1.00  0.00           H  
HETATM   49  H   UNL     1       1.709  -1.587   1.462  1.00  0.00           H  
HETATM   50  H   UNL     1       3.741  -2.717   2.210  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.951  -1.041   1.795  1.00  0.00           H  
HETATM   52  H   UNL     1       3.799   0.035  -1.878  1.00  0.00           H  
HETATM   53  H   UNL     1       3.236   3.663   2.194  1.00  0.00           H  
HETATM   54  H   UNL     1       3.128   1.949   1.738  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.761   2.762  -0.420  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.477   2.038  -1.418  1.00  0.00           H  
HETATM   57  H   UNL     1       2.874   4.406   0.018  1.00  0.00           H  
HETATM   58  H   UNL     1       3.808   2.921  -0.264  1.00  0.00           H  
HETATM   59  H   UNL     1       0.914   4.435  -1.823  1.00  0.00           H  
HETATM   60  H   UNL     1       0.555   4.456  -0.077  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.850   4.289  -0.496  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.995   3.619   1.147  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.304   3.733  -1.876  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.490   2.161  -1.730  1.00  0.00           H  
HETATM   65  H   UNL     1       6.303  -3.133   1.650  1.00  0.00           H  
HETATM   66  H   UNL     1       2.127   2.450  -1.692  1.00  0.00           H  
CONECT    1   36    3    3    4                                       
CONECT    2   37   35    4                                            
CONECT    3    1    1                                                 
CONECT    4    1    2    5   38                                       
CONECT    5    4   17   39   40                                       
CONECT    6   24   41   42   43                                       
CONECT    7   25   44   45   46                                       
CONECT    8   32   32                                                 
CONECT    9   37   37                                                 
CONECT   10   37   37                                                 
CONECT   11   28   28   12   47                                       
CONECT   12   11   30   30   48                                       
CONECT   13   14   14   29   49                                       
CONECT   14   13   13   33   50                                       
CONECT   15   28   31   31   51                                       
CONECT   16   34   29   29   52                                       
CONECT   17    5   19   53   54                                       
CONECT   18   26   21   55   56                                       
CONECT   19   17   35   57   58                                       
CONECT   20   22   35   59   60                                       
CONECT   21   18   36   61   62                                       
CONECT   22   20   36   63   64                                       
CONECT   23   32   33   65                                            
CONECT   24    6   30                                                 
CONECT   25    7   31                                                 
CONECT   26   18   28                                                 
CONECT   27   32   34                                                 
CONECT   28   11   11   15   26                                       
CONECT   29   13   16   16   37                                       
CONECT   30   12   12   24   31                                       
CONECT   31   15   15   25   30                                       
CONECT   32    8    8   23   27                                       
CONECT   33   14   23   34   34                                       
CONECT   34   16   27   33   33                                       
CONECT   35    2   19   20   66                                       
CONECT   36    1   21   22                                            
CONECT   37    2    9    9   10                                       
CONECT   37   10   29                                                 
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    7                                                      
CONECT   46    7                                                      
CONECT   47   11                                                      
CONECT   48   12                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   17                                                      
CONECT   54   17                                                      
CONECT   55   18                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   19                                                      
CONECT   59   20                                                      
CONECT   60   20                                                      
CONECT   61   21                                                      
CONECT   62   21                                                      
CONECT   63   22                                                      
CONECT   64   22                                                      
CONECT   65   23                                                      
CONECT   66   35                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
