COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.611   1.445   0.390  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.302   0.133   1.114  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.790  -0.072   1.201  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.835   0.267   2.558  1.00  0.00           C  
HETATM    5  N   UNL     1      -5.970  -0.997   0.493  1.00  0.00           N  
HETATM    6  C   UNL     1      -5.407  -1.580  -0.711  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.776  -0.769  -1.957  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.018  -2.990  -0.887  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.891  -1.746  -0.632  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.231  -0.447  -0.171  1.00  0.00           C  
HETATM   11  N   UNL     1      -1.781  -0.654  -0.062  1.00  0.00           N  
HETATM   12  C   UNL     1      -0.917   0.423  -0.175  1.00  0.00           C  
HETATM   13  N   UNL     1       0.376   0.357  -0.100  1.00  0.00           N  
HETATM   14  S   UNL     1      -1.404   2.093  -0.450  1.00  0.00           S  
HETATM   15  C   UNL     1       0.286   2.592  -0.433  1.00  0.00           C  
HETATM   16  C   UNL     1       1.046   1.501  -0.234  1.00  0.00           C  
HETATM   17  C   UNL     1       2.526   1.566  -0.169  1.00  0.00           C  
HETATM   18  C   UNL     1       3.173   2.801  -0.209  1.00  0.00           C  
HETATM   19  C   UNL     1       4.551   2.863  -0.149  1.00  0.00           C  
HETATM   20  C   UNL     1       5.296   1.704  -0.048  1.00  0.00           C  
HETATM   21  C   UNL     1       3.272   0.396  -0.061  1.00  0.00           C  
HETATM   22  C   UNL     1       4.660   0.464  -0.006  1.00  0.00           C  
HETATM   23  C   UNL     1       5.462  -0.779   0.109  1.00  0.00           C  
HETATM   24  C   UNL     1       4.827  -2.019   0.155  1.00  0.00           C  
HETATM   25  C   UNL     1       5.577  -3.172   0.256  1.00  0.00           C  
HETATM   26  C   UNL     1       6.852  -0.712   0.165  1.00  0.00           C  
HETATM   27  C   UNL     1       7.593  -1.872   0.271  1.00  0.00           C  
HETATM   28  C   UNL     1       6.958  -3.100   0.311  1.00  0.00           C  
HETATM   29  H   UNL     1      -5.194   1.411  -0.616  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.691   1.583   0.333  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.168   2.276   0.940  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.319   0.851   1.546  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.572  -0.870   1.913  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.910   0.446   2.534  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.633  -0.653   3.107  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.338   1.102   3.052  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.967  -0.862   0.424  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.393   0.246  -1.855  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.337  -1.237  -2.838  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.860  -0.740  -2.063  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.101  -2.908  -0.978  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.611  -3.452  -1.786  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.771  -3.603  -0.020  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.650  -2.544   0.074  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.504  -2.020  -1.616  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.420   0.349  -0.888  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.429  -1.545   0.089  1.00  0.00           H  
HETATM   48  H   UNL     1       0.649   3.600  -0.564  1.00  0.00           H  
HETATM   49  H   UNL     1       2.596   3.710  -0.289  1.00  0.00           H  
HETATM   50  H   UNL     1       5.049   3.821  -0.182  1.00  0.00           H  
HETATM   51  H   UNL     1       6.374   1.759  -0.001  1.00  0.00           H  
HETATM   52  H   UNL     1       2.774  -0.562  -0.029  1.00  0.00           H  
HETATM   53  H   UNL     1       3.749  -2.076   0.113  1.00  0.00           H  
HETATM   54  H   UNL     1       5.086  -4.134   0.292  1.00  0.00           H  
HETATM   55  H   UNL     1       7.350   0.246   0.124  1.00  0.00           H  
HETATM   56  H   UNL     1       8.671  -1.821   0.314  1.00  0.00           H  
HETATM   57  H   UNL     1       7.541  -4.005   0.390  1.00  0.00           H  
CONECT    1    2   29   30   31                                       
CONECT    2    1    5    3    4                                       
CONECT    3   10    2   32   33                                       
CONECT    4    2   34   35   36                                       
CONECT    5    6    2   37                                            
CONECT    6    7    5    9    8                                       
CONECT    7    6   38   39   40                                       
CONECT    8    6   41   42   43                                       
CONECT    9    6   10   44   45                                       
CONECT   10    9   11    3   46                                       
CONECT   11   10   12   47                                            
CONECT   12   11   13   13   14                                       
CONECT   13   12   12   16                                            
CONECT   14   12   15                                                 
CONECT   15   16   16   14   48                                       
CONECT   16   13   17   15   15                                       
CONECT   17   21   16   18   18                                       
CONECT   18   17   17   19   49                                       
CONECT   19   20   20   18   50                                       
CONECT   20   22   19   19   51                                       
CONECT   21   22   22   17   52                                       
CONECT   22   23   21   21   20                                       
CONECT   23   24   26   26   22                                       
CONECT   24   25   25   23   53                                       
CONECT   25   24   24   28   54                                       
CONECT   26   23   23   27   55                                       
CONECT   27   28   28   26   56                                       
CONECT   28   25   27   27   57                                       
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45    9                                                      
CONECT   46   10                                                      
CONECT   47   11                                                      
CONECT   48   15                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   24                                                      
CONECT   54   25                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   28                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
