COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.416   3.669  -0.078  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.256   2.573  -0.075  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.734   1.299   0.113  1.00  0.00           C  
HETATM    4  C   UNL     1       0.632   1.133   0.298  1.00  0.00           C  
HETATM    5  C   UNL     1       1.467   2.233   0.294  1.00  0.00           C  
HETATM    6  C   UNL     1       0.945   3.499   0.107  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.585   0.296   1.185  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.441  -0.973   1.206  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.083  -1.254  -1.171  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.227   0.015  -1.192  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.977  -2.315  -0.098  1.00  0.00           C  
HETATM   12  C   UNL     1       1.203  -0.247   0.503  1.00  0.00           C  
HETATM   13  C   UNL     1       3.546  -1.043  -0.450  1.00  0.00           C  
HETATM   14  N   UNL     1       4.485  -0.142  -0.802  1.00  0.00           N  
HETATM   15  S   UNL     1       3.737  -1.963   0.981  1.00  0.00           S  
HETATM   16  N   UNL     1       2.457  -1.219  -1.224  1.00  0.00           N  
HETATM   17  N   UNL     1       1.334  -0.919  -0.792  1.00  0.00           N  
HETATM   18  N   UNL     1      -1.582   0.189   0.117  1.00  0.00           N  
HETATM   19  N   UNL     1      -4.086  -1.147  -0.102  1.00  0.00           N  
HETATM   20  H   UNL     1      -0.820   4.659  -0.229  1.00  0.00           H  
HETATM   21  H   UNL     1      -2.318   2.706  -0.219  1.00  0.00           H  
HETATM   22  H   UNL     1       2.530   2.104   0.438  1.00  0.00           H  
HETATM   23  H   UNL     1       1.600   4.358   0.104  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.221   1.161   1.001  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.082   0.411   2.146  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.808  -1.835   1.417  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.204  -0.884   1.979  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.586  -1.369  -2.131  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.446  -2.119  -0.987  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.464  -0.074  -1.965  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.860   0.877  -1.403  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.751  -2.179   0.658  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.442  -2.421  -1.079  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.400  -3.211   0.129  1.00  0.00           H  
HETATM   35  H   UNL     1       2.184  -0.168   0.973  1.00  0.00           H  
HETATM   36  H   UNL     1       0.538  -0.823   1.146  1.00  0.00           H  
HETATM   37  H   UNL     1       5.269  -0.016  -0.245  1.00  0.00           H  
HETATM   38  H   UNL     1       4.377   0.379  -1.613  1.00  0.00           H  
CONECT    1    2    2    6   20                                       
CONECT    2    1    1    3   21                                       
CONECT    3    2    4    4   18                                       
CONECT    4    3    3    5   12                                       
CONECT    5    4    6    6   22                                       
CONECT    6    1    5    5   23                                       
CONECT    7    8   18   24   25                                       
CONECT    8    7   19   26   27                                       
CONECT    9   10   19   28   29                                       
CONECT   10    9   18   30   31                                       
CONECT   11   19   32   33   34                                       
CONECT   12    4   17   35   36                                       
CONECT   13   14   15   15   16                                       
CONECT   14   13   37   38                                            
CONECT   15   13   13                                                 
CONECT   16   13   17   17                                            
CONECT   17   12   16   16                                            
CONECT   18    3    7   10                                            
CONECT   19    8    9   11                                            
CONECT   20    1                                                      
CONECT   21    2                                                      
CONECT   22    5                                                      
CONECT   23    6                                                      
CONECT   24    7                                                      
CONECT   25    7                                                      
CONECT   26    8                                                      
CONECT   27    8                                                      
CONECT   28    9                                                      
CONECT   29    9                                                      
CONECT   30   10                                                      
CONECT   31   10                                                      
CONECT   32   11                                                      
CONECT   33   11                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   12                                                      
CONECT   37   14                                                      
CONECT   38   14                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
