COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.167  -1.410  -0.124  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.455  -0.719  -0.354  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.849   0.420   0.239  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.010  -2.729  -0.337  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.005  -1.478   0.462  1.00  0.00           C  
HETATM    6  C   UNL     1       3.528  -1.507   1.520  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.764  -0.396  -1.979  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.818   2.696   1.198  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.335   2.600   1.371  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.930   1.906   0.154  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.193   0.718  -0.296  1.00  0.00           C  
HETATM   12  C   UNL     1       2.217  -2.068   0.964  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.493  -0.276  -1.178  1.00  0.00           C  
HETATM   14  C   UNL     1       7.174  -0.700  -1.301  1.00  0.00           C  
HETATM   15  C   UNL     1       6.685   0.689  -0.982  1.00  0.00           C  
HETATM   16  C   UNL     1       6.970   1.813  -1.680  1.00  0.00           C  
HETATM   17  C   UNL     1       5.853   1.044   0.084  1.00  0.00           C  
HETATM   18  C   UNL     1       5.291   0.103   1.118  1.00  0.00           C  
HETATM   19  C   UNL     1       2.995   0.663   0.590  1.00  0.00           C  
HETATM   20  C   UNL     1       1.684   0.103   0.033  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.167   1.309   1.242  1.00  0.00           C  
HETATM   22  N   UNL     1       6.344   2.843  -1.074  1.00  0.00           N  
HETATM   23  N   UNL     1       5.649   2.336   0.031  1.00  0.00           N  
HETATM   24  N   UNL     1       3.995  -0.412   0.659  1.00  0.00           N  
HETATM   25  N   UNL     1       1.217  -0.992   0.895  1.00  0.00           N  
HETATM   26  N   UNL     1      -1.079  -0.768   0.302  1.00  0.00           N  
HETATM   27  N   UNL     1      -4.447  -1.134  -1.215  1.00  0.00           N  
HETATM   28  O   UNL     1      -6.934   2.303  -0.401  1.00  0.00           O  
HETATM   29  S   UNL     1      -0.343  -3.155   0.043  1.00  0.00           S  
HETATM   30  H   UNL     1      -2.774  -3.410  -0.680  1.00  0.00           H  
HETATM   31  H   UNL     1       3.362  -1.131   2.530  1.00  0.00           H  
HETATM   32  H   UNL     1       4.279  -2.296   1.545  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.644   0.121  -2.931  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.981  -1.448  -2.161  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.587   0.054  -1.423  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.596   3.164   0.240  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.405   3.310   1.999  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.565   2.024   2.268  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.756   3.602   1.462  1.00  0.00           H  
HETATM   40  H   UNL     1       2.388  -2.469  -0.035  1.00  0.00           H  
HETATM   41  H   UNL     1       1.854  -2.861   1.617  1.00  0.00           H  
HETATM   42  H   UNL     1       8.119  -0.879  -0.789  1.00  0.00           H  
HETATM   43  H   UNL     1       6.436  -1.430  -0.968  1.00  0.00           H  
HETATM   44  H   UNL     1       7.319  -0.796  -2.377  1.00  0.00           H  
HETATM   45  H   UNL     1       7.587   1.875  -2.564  1.00  0.00           H  
HETATM   46  H   UNL     1       5.981  -0.728   1.265  1.00  0.00           H  
HETATM   47  H   UNL     1       5.158   0.635   2.060  1.00  0.00           H  
HETATM   48  H   UNL     1       3.359   1.456  -0.063  1.00  0.00           H  
HETATM   49  H   UNL     1       2.824   1.065   1.589  1.00  0.00           H  
HETATM   50  H   UNL     1       0.933   0.892   0.009  1.00  0.00           H  
HETATM   51  H   UNL     1       1.850  -0.274  -0.976  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.278   0.885   2.241  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.109   1.394   0.995  1.00  0.00           H  
HETATM   54  H   UNL     1       6.368   3.772  -1.355  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.404  -1.930  -1.768  1.00  0.00           H  
CONECT    1    2    4    4   26                                       
CONECT    2    3    3    1   27                                       
CONECT    3   21   11    2    2                                       
CONECT    4    1    1   29   30                                       
CONECT    5   26   26   29   25                                       
CONECT    6   12   24   31   32                                       
CONECT    7   13   33   34   35                                       
CONECT    8    9   21   36   37                                       
CONECT    9    8   10   38   39                                       
CONECT   10    9   28   28   11                                       
CONECT   11   10    3   13   13                                       
CONECT   12   25    6   40   41                                       
CONECT   13   11   11    7   27                                       
CONECT   14   15   42   43   44                                       
CONECT   15   17   14   16   16                                       
CONECT   16   15   15   22   45                                       
CONECT   17   18   23   23   15                                       
CONECT   18   24   17   46   47                                       
CONECT   19   20   24   48   49                                       
CONECT   20   25   19   50   51                                       
CONECT   21    8    3   52   53                                       
CONECT   22   23   16   54                                            
CONECT   23   17   17   22                                            
CONECT   24   19    6   18                                            
CONECT   25    5   12   20                                            
CONECT   26    1    5    5                                            
CONECT   27    2   13   55                                            
CONECT   28   10   10                                                 
CONECT   29    4    5                                                 
CONECT   30    4                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39    9                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   16                                                      
CONECT   46   18                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49   19                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   21                                                      
CONECT   54   22                                                      
CONECT   55   27                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
