COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.125  -3.052   0.203  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.163   0.717  -0.181  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.200   1.400   0.792  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.680   2.763   0.416  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.562   3.811   0.228  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.085   5.063  -0.112  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.726   5.267  -0.264  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.845   4.220  -0.075  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.322   2.967   0.264  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.685   1.281   1.142  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.440   0.144  -1.441  1.00  0.00           C  
HETATM   12  C   UNL     1       3.042  -3.060  -0.993  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.165   0.659  -1.571  1.00  0.00           C  
HETATM   14  C   UNL     1       0.896   0.059  -0.920  1.00  0.00           C  
HETATM   15  C   UNL     1       4.029  -0.160   0.872  1.00  0.00           C  
HETATM   16  C   UNL     1       3.968   1.092   0.292  1.00  0.00           C  
HETATM   17  C   UNL     1       5.088   1.619  -0.335  1.00  0.00           C  
HETATM   18  C   UNL     1       6.221   3.331  -1.535  1.00  0.00           C  
HETATM   19  C   UNL     1       6.265   0.887  -0.379  1.00  0.00           C  
HETATM   20  C   UNL     1       6.320  -0.365   0.203  1.00  0.00           C  
HETATM   21  C   UNL     1       5.205  -0.886   0.832  1.00  0.00           C  
HETATM   22  C   UNL     1       0.682  -1.065  -0.132  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.598  -1.585   0.000  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.661  -0.976  -0.650  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.590  -2.968  -0.417  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.128  -1.672  -0.243  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.545  -1.336  -0.026  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.075  -0.781  -0.312  1.00  0.00           C  
HETATM   29  N   UNL     1       1.755  -1.672   0.525  1.00  0.00           N  
HETATM   30  N   UNL     1      -2.955  -1.498  -0.519  1.00  0.00           N  
HETATM   31  N   UNL     1      -3.301  -2.852  -0.580  1.00  0.00           N  
HETATM   32  O   UNL     1       3.086  -1.792   2.600  1.00  0.00           O  
HETATM   33  O   UNL     1       3.512  -4.223  -1.471  1.00  0.00           O  
HETATM   34  O   UNL     1       3.353  -2.020  -1.522  1.00  0.00           O  
HETATM   35  O   UNL     1      -7.473  -2.312   0.002  1.00  0.00           O  
HETATM   36  O   UNL     1      -6.878  -0.177   0.128  1.00  0.00           O  
HETATM   37  O   UNL     1       5.030   2.851  -0.907  1.00  0.00           O  
HETATM   38  O   UNL     1       1.797   0.275   2.041  1.00  0.00           O  
HETATM   39  S   UNL     1       2.608  -0.831   1.669  1.00  0.00           S  
HETATM   40  H   UNL     1       1.227  -3.626  -0.023  1.00  0.00           H  
HETATM   41  H   UNL     1       2.637  -3.499   1.056  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.422   1.255  -1.094  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.502   0.765   1.338  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.624   3.652   0.346  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.774   5.882  -0.260  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.354   6.246  -0.530  1.00  0.00           H  
HETATM   47  H   UNL     1       0.217   4.379  -0.193  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.632   2.150   0.415  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.286   2.190   1.100  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.964   0.568   1.918  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.267   0.615  -1.952  1.00  0.00           H  
HETATM   52  H   UNL     1       0.003   1.533  -2.184  1.00  0.00           H  
HETATM   53  H   UNL     1       1.891   0.464  -1.024  1.00  0.00           H  
HETATM   54  H   UNL     1       3.050   1.660   0.326  1.00  0.00           H  
HETATM   55  H   UNL     1       7.023   3.386  -0.799  1.00  0.00           H  
HETATM   56  H   UNL     1       6.509   2.649  -2.336  1.00  0.00           H  
HETATM   57  H   UNL     1       6.039   4.322  -1.950  1.00  0.00           H  
HETATM   58  H   UNL     1       7.138   1.296  -0.867  1.00  0.00           H  
HETATM   59  H   UNL     1       7.237  -0.935   0.170  1.00  0.00           H  
HETATM   60  H   UNL     1       5.250  -1.865   1.286  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.767  -2.459   0.612  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.149  -3.893  -0.412  1.00  0.00           H  
HETATM   63  H   UNL     1       4.096  -4.178  -2.240  1.00  0.00           H  
HETATM   64  H   UNL     1      -8.390  -2.043   0.147  1.00  0.00           H  
CONECT    1   12   29   40   41                                       
CONECT    2    3   10   28   42                                       
CONECT    3    4    2   10   43                                       
CONECT    4    5    5    9    3                                       
CONECT    5    6    4    4   44                                       
CONECT    6    7    7    5   45                                       
CONECT    7    6    6    8   46                                       
CONECT    8    7    9    9   47                                       
CONECT    9    8    8    4   48                                       
CONECT   10    3    2   49   50                                       
CONECT   11   24   13   13   51                                       
CONECT   12   34   34    1   33                                       
CONECT   13   11   11   14   52                                       
CONECT   14   22   22   13   53                                       
CONECT   15   16   16   21   39                                       
CONECT   16   17   15   15   54                                       
CONECT   17   37   19   19   16                                       
CONECT   18   37   55   56   57                                       
CONECT   19   17   17   20   58                                       
CONECT   20   19   21   21   59                                       
CONECT   21   20   20   15   60                                       
CONECT   22   23   29   14   14                                       
CONECT   23   24   24   22   61                                       
CONECT   24   30   23   23   11                                       
CONECT   25   26   31   31   62                                       
CONECT   26   27   25   28   28                                       
CONECT   27   36   36   35   26                                       
CONECT   28   26   26    2   30                                       
CONECT   29    1   22   39                                            
CONECT   30   28   31   24                                            
CONECT   31   25   25   30                                            
CONECT   32   39   39                                                 
CONECT   33   12   63                                                 
CONECT   34   12   12                                                 
CONECT   35   27   64                                                 
CONECT   36   27   27                                                 
CONECT   37   18   17                                                 
CONECT   38   39   39                                                 
CONECT   39   15   29   32   32                                       
CONECT   39   38   38                                                 
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    2                                                      
CONECT   43    3                                                      
CONECT   44    5                                                      
CONECT   45    6                                                      
CONECT   46    7                                                      
CONECT   47    8                                                      
CONECT   48    9                                                      
CONECT   49   10                                                      
CONECT   50   10                                                      
CONECT   51   11                                                      
CONECT   52   13                                                      
CONECT   53   14                                                      
CONECT   54   16                                                      
CONECT   55   18                                                      
CONECT   56   18                                                      
CONECT   57   18                                                      
CONECT   58   19                                                      
CONECT   59   20                                                      
CONECT   60   21                                                      
CONECT   61   23                                                      
CONECT   62   25                                                      
CONECT   63   33                                                      
CONECT   64   35                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
