COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.398   3.077  -1.573  1.00  0.00           C  
HETATM    2  N   UNL     1       4.938  -2.582   0.697  1.00  0.00           N  
HETATM    3  O   UNL     1       7.238   1.937  -1.383  1.00  0.00           O  
HETATM    4  C   UNL     1       6.658   0.821  -0.866  1.00  0.00           C  
HETATM    5  N   UNL     1      -1.014   0.646   0.130  1.00  0.00           N  
HETATM    6  O   UNL     1       8.752  -0.318  -0.973  1.00  0.00           O  
HETATM    7  C   UNL     1       5.329   0.833  -0.556  1.00  0.00           C  
HETATM    8  N   UNL     1      -2.628   0.558   1.836  1.00  0.00           N  
HETATM    9  O   UNL     1       2.573   0.748   0.124  1.00  0.00           O  
HETATM   10  C   UNL     1       4.729  -0.318  -0.023  1.00  0.00           C  
HETATM   11  N   UNL     1      -4.903   0.719   1.337  1.00  0.00           N  
HETATM   12  O   UNL     1      -3.357   0.697  -0.258  1.00  0.00           O  
HETATM   13  C   UNL     1       3.356  -0.343   0.309  1.00  0.00           C  
HETATM   14  C   UNL     1       2.836  -1.515   0.830  1.00  0.00           C  
HETATM   15  C   UNL     1       3.663  -2.616   1.009  1.00  0.00           C  
HETATM   16  C   UNL     1       5.507  -1.482   0.189  1.00  0.00           C  
HETATM   17  C   UNL     1       6.873  -1.464  -0.140  1.00  0.00           C  
HETATM   18  C   UNL     1       7.430  -0.331  -0.657  1.00  0.00           C  
HETATM   19  C   UNL     1       9.487  -1.520  -0.738  1.00  0.00           C  
HETATM   20  C   UNL     1       1.293   0.700   0.582  1.00  0.00           C  
HETATM   21  C   UNL     1       1.036   0.659   1.950  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.281   0.611   2.371  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.296   0.606   1.421  1.00  0.00           C  
HETATM   24  C   UNL     1       0.230   0.692  -0.307  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.620   0.659   0.928  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.981   0.829   0.351  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.107   1.823   0.643  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.365   0.319   0.757  1.00  0.00           C  
HETATM   29  C   UNL     1      -8.211  -0.325  -0.310  1.00  0.00           C  
HETATM   30  C   UNL     1      -8.626  -1.636  -0.167  1.00  0.00           C  
HETATM   31  C   UNL     1      -9.402  -2.227  -1.146  1.00  0.00           C  
HETATM   32  C   UNL     1      -9.763  -1.507  -2.270  1.00  0.00           C  
HETATM   33  C   UNL     1      -9.349  -0.196  -2.413  1.00  0.00           C  
HETATM   34  C   UNL     1      -8.577   0.396  -1.431  1.00  0.00           C  
HETATM   35  H   UNL     1      -5.682   0.698  -0.689  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.474  -0.098   1.759  1.00  0.00           H  
HETATM   37  H   UNL     1       5.590   2.822  -2.259  1.00  0.00           H  
HETATM   38  H   UNL     1       5.979   3.382  -0.615  1.00  0.00           H  
HETATM   39  H   UNL     1       6.985   3.895  -1.991  1.00  0.00           H  
HETATM   40  H   UNL     1       4.741   1.724  -0.720  1.00  0.00           H  
HETATM   41  H   UNL     1       1.791  -1.573   1.096  1.00  0.00           H  
HETATM   42  H   UNL     1       3.247  -3.526   1.416  1.00  0.00           H  
HETATM   43  H   UNL     1       7.479  -2.343   0.016  1.00  0.00           H  
HETATM   44  H   UNL     1       9.054  -2.332  -1.323  1.00  0.00           H  
HETATM   45  H   UNL     1      10.526  -1.375  -1.033  1.00  0.00           H  
HETATM   46  H   UNL     1       9.442  -1.773   0.322  1.00  0.00           H  
HETATM   47  H   UNL     1       1.845   0.663   2.665  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.517   0.579   3.424  1.00  0.00           H  
HETATM   49  H   UNL     1       0.423   0.723  -1.369  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.840   0.452   2.776  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.113   0.689   2.283  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.046   2.395   1.569  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.549   2.346  -0.205  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.343  -2.199   0.711  1.00  0.00           H  
HETATM   55  H   UNL     1      -9.725  -3.251  -1.035  1.00  0.00           H  
HETATM   56  H   UNL     1     -10.369  -1.969  -3.036  1.00  0.00           H  
HETATM   57  H   UNL     1      -9.631   0.367  -3.291  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.257   1.422  -1.541  1.00  0.00           H  
CONECT    1    3   37   38   39                                       
CONECT    2   15   15   16                                            
CONECT    3    1    4                                                 
CONECT    4    3    7    7   18                                       
CONECT    5   23   23   24                                            
CONECT    6   18   19                                                 
CONECT    7    4    4   10   40                                       
CONECT    8   23   25   50                                            
CONECT    9   13   20                                                 
CONECT   10    7   13   16   16                                       
CONECT   11   25   26   51                                            
CONECT   12   25   25                                                 
CONECT   13    9   10   14   14                                       
CONECT   14   13   13   15   41                                       
CONECT   15    2    2   14   42                                       
CONECT   16    2   10   10   17                                       
CONECT   17   16   18   18   43                                       
CONECT   18    4    6   17   17                                       
CONECT   19    6   44   45   46                                       
CONECT   20    9   21   24   24                                       
CONECT   21   20   22   22   47                                       
CONECT   22   21   21   23   48                                       
CONECT   23    5    5    8   22                                       
CONECT   24    5   20   20   49                                       
CONECT   25    8   11   12   12                                       
CONECT   26   11   27   28   35                                       
CONECT   27   26   28   52   53                                       
CONECT   28   26   27   29   36                                       
CONECT   29   28   30   30   34                                       
CONECT   30   29   29   31   54                                       
CONECT   31   30   32   32   55                                       
CONECT   32   31   31   33   56                                       
CONECT   33   32   34   34   57                                       
CONECT   34   29   33   33   58                                       
CONECT   35   26                                                      
CONECT   36   28                                                      
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    7                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   17                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   19                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   24                                                      
CONECT   50    8                                                      
CONECT   51   11                                                      
CONECT   52   27                                                      
CONECT   53   27                                                      
CONECT   54   30                                                      
CONECT   55   31                                                      
CONECT   56   32                                                      
CONECT   57   33                                                      
CONECT   58   34                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
