COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.900   0.040   0.219  1.00  0.00           C  
HETATM    2  C   UNL     1       2.707  -0.895   0.447  1.00  0.00           C  
HETATM    3  C   UNL     1       4.059  -0.927   0.737  1.00  0.00           C  
HETATM    4  C   UNL     1       2.199   0.097  -0.371  1.00  0.00           C  
HETATM    5  C   UNL     1       0.729   0.123  -0.699  1.00  0.00           C  
HETATM    6  C   UNL     1       7.074  -0.798  -0.481  1.00  0.00           C  
HETATM    7  C   UNL     1       6.373   0.005   0.535  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.538   2.196  -0.594  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.806  -1.192  -0.435  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.445  -1.431  -0.152  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.432  -2.434   0.345  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.420  -0.140   0.078  1.00  0.00           C  
HETATM   13  C   UNL     1       4.391   1.036  -0.594  1.00  0.00           C  
HETATM   14  C   UNL     1       3.040   1.064  -0.889  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.798  -0.182  -0.176  1.00  0.00           C  
HETATM   16  N   UNL     1      -4.755   0.753  -0.466  1.00  0.00           N  
HETATM   17  N   UNL     1      -5.977   0.086  -0.623  1.00  0.00           N  
HETATM   18  N   UNL     1      -3.721  -2.526   0.113  1.00  0.00           N  
HETATM   19  N   UNL     1      -1.787  -1.280   0.331  1.00  0.00           N  
HETATM   20  N   UNL     1      -1.735   1.062   0.066  1.00  0.00           N  
HETATM   21  N   UNL     1       7.615  -1.417  -1.264  1.00  0.00           N  
HETATM   22  O   UNL     1      -0.138   0.463   1.802  1.00  0.00           O  
HETATM   23  O   UNL     1       0.205   2.487   0.423  1.00  0.00           O  
HETATM   24  S   UNL     1      -0.149   1.116   0.540  1.00  0.00           S  
HETATM   25  H   UNL     1       2.050  -1.651   0.851  1.00  0.00           H  
HETATM   26  H   UNL     1       4.457  -1.708   1.367  1.00  0.00           H  
HETATM   27  H   UNL     1       0.584   0.563  -1.685  1.00  0.00           H  
HETATM   28  H   UNL     1       0.336  -0.894  -0.693  1.00  0.00           H  
HETATM   29  H   UNL     1       6.769   1.021   0.532  1.00  0.00           H  
HETATM   30  H   UNL     1       6.523  -0.441   1.518  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.195   2.424  -1.603  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.473   2.722  -0.400  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.786   2.516   0.127  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.578  -1.945  -0.492  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.877  -3.336   0.555  1.00  0.00           H  
HETATM   36  H   UNL     1       5.048   1.791  -0.998  1.00  0.00           H  
HETATM   37  H   UNL     1       2.642   1.842  -1.523  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.183   1.873  -0.221  1.00  0.00           H  
CONECT    1    7   13   13    3                                       
CONECT    2    3    3    4   25                                       
CONECT    3    1    2    2   26                                       
CONECT    4   14   14    2    5                                       
CONECT    5    4   24   27   28                                       
CONECT    6   21   21   21    7                                       
CONECT    7    6    1   29   30                                       
CONECT    8   16   31   32   33                                       
CONECT    9   17   17   10   34                                       
CONECT   10   15    9   18   18                                       
CONECT   11   19   19   18   35                                       
CONECT   12   20   15   15   19                                       
CONECT   13    1    1   14   36                                       
CONECT   14   13    4    4   37                                       
CONECT   15   12   12   16   10                                       
CONECT   16    8   15   17                                            
CONECT   17   16    9    9                                            
CONECT   18   10   10   11                                            
CONECT   19   12   11   11                                            
CONECT   20   24   12   38                                            
CONECT   21    6    6    6                                            
CONECT   22   24   24                                                 
CONECT   23   24   24                                                 
CONECT   24   23   23    5   22                                       
CONECT   24   22   20                                                 
CONECT   25    2                                                      
CONECT   26    3                                                      
CONECT   27    5                                                      
CONECT   28    5                                                      
CONECT   29    7                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   11                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   20                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
