COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.557  -2.211   1.718  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.819   5.647   0.625  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.501  -4.246   0.449  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.882  -4.274   0.430  1.00  0.00           C  
HETATM    5  C   UNL     1       4.702   0.221  -1.607  1.00  0.00           C  
HETATM    6  C   UNL     1       5.661   0.063  -0.423  1.00  0.00           C  
HETATM    7  C   UNL     1       3.265   0.287  -1.084  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.826  -3.070   0.178  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.592  -3.123   0.141  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.248   3.144   0.154  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.142   2.111  -0.054  1.00  0.00           C  
HETATM   12  C   UNL     1       1.532  -0.908   0.263  1.00  0.00           C  
HETATM   13  C   UNL     1       5.288  -1.195   0.364  1.00  0.00           C  
HETATM   14  C   UNL     1       0.545  -0.879  -0.906  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.422   1.587   0.005  1.00  0.00           C  
HETATM   16  C   UNL     1       2.962  -0.978  -0.278  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.885   2.883   0.185  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.531  -1.907  -0.115  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.319   0.545  -0.206  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.922  -1.938  -0.130  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.684   0.813  -0.233  1.00  0.00           C  
HETATM   22  N   UNL     1       3.904  -1.083   0.843  1.00  0.00           N  
HETATM   23  N   UNL     1      -0.819  -0.742  -0.390  1.00  0.00           N  
HETATM   24  S   UNL     1       0.258   4.197   0.453  1.00  0.00           S  
HETATM   25  S   UNL     1      -3.848  -0.484  -0.486  1.00  0.00           S  
HETATM   26  H   UNL     1       4.292  -2.287   2.520  1.00  0.00           H  
HETATM   27  H   UNL     1       2.568  -2.047   2.146  1.00  0.00           H  
HETATM   28  H   UNL     1       3.555  -3.134   1.138  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.401   5.777  -0.288  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.494   5.500   1.468  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.210   6.534   0.797  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.947  -5.143   0.680  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.406  -5.194   0.641  1.00  0.00           H  
HETATM   34  H   UNL     1       4.937   1.140  -2.145  1.00  0.00           H  
HETATM   35  H   UNL     1       4.808  -0.632  -2.277  1.00  0.00           H  
HETATM   36  H   UNL     1       6.682  -0.027  -0.791  1.00  0.00           H  
HETATM   37  H   UNL     1       5.583   0.935   0.227  1.00  0.00           H  
HETATM   38  H   UNL     1       3.149   1.162  -0.445  1.00  0.00           H  
HETATM   39  H   UNL     1       2.575   0.357  -1.925  1.00  0.00           H  
HETATM   40  H   UNL     1       0.254  -3.054   0.194  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.672  -3.147   0.125  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.609   4.153   0.293  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.203   2.315  -0.079  1.00  0.00           H  
HETATM   44  H   UNL     1       1.414  -0.004   0.860  1.00  0.00           H  
HETATM   45  H   UNL     1       1.335  -1.782   0.883  1.00  0.00           H  
HETATM   46  H   UNL     1       5.379  -2.068  -0.283  1.00  0.00           H  
HETATM   47  H   UNL     1       5.959  -1.303   1.216  1.00  0.00           H  
HETATM   48  H   UNL     1       0.775  -0.033  -1.555  1.00  0.00           H  
HETATM   49  H   UNL     1       0.628  -1.805  -1.474  1.00  0.00           H  
HETATM   50  H   UNL     1       0.639   1.387   0.028  1.00  0.00           H  
HETATM   51  H   UNL     1       3.064  -1.852  -0.922  1.00  0.00           H  
CONECT    1   22   26   27   28                                       
CONECT    2   24   29   30   31                                       
CONECT    3    4    4    8   32                                       
CONECT    4    3    3    9   33                                       
CONECT    5    6    7   34   35                                       
CONECT    6    5   13   36   37                                       
CONECT    7    5   16   38   39                                       
CONECT    8    3   18   18   40                                       
CONECT    9    4   20   20   41                                       
CONECT   10   11   11   17   42                                       
CONECT   11   10   10   21   43                                       
CONECT   12   14   16   44   45                                       
CONECT   13    6   22   46   47                                       
CONECT   14   12   23   48   49                                       
CONECT   15   17   17   19   50                                       
CONECT   16    7   12   22   51                                       
CONECT   17   10   15   15   24                                       
CONECT   18    8    8   20   23                                       
CONECT   19   15   21   21   23                                       
CONECT   20    9    9   18   25                                       
CONECT   21   11   19   19   25                                       
CONECT   22    1   13   16                                            
CONECT   23   14   18   19                                            
CONECT   24    2   17                                                 
CONECT   25   20   21                                                 
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    2                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   13                                                      
CONECT   48   14                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   16                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
