COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1     -11.498 -15.596  -2.625  1.00  0.00           C  
HETATM    2  C   UNL     1     -12.123 -14.686  -3.641  1.00  0.00           C  
HETATM    3  C   UNL     1     -12.998 -13.659  -2.934  1.00  0.00           C  
HETATM    4  C   UNL     1     -13.944 -14.373  -1.989  1.00  0.00           C  
HETATM    5  C   UNL     1     -13.159 -15.251  -1.048  1.00  0.00           C  
HETATM    6  C   UNL     1     -14.114 -16.062  -0.140  1.00  0.00           C  
HETATM    7  O   UNL     1     -11.103 -14.074  -4.401  1.00  0.00           O  
HETATM    8  O   UNL     1     -13.708 -12.927  -3.900  1.00  0.00           O  
HETATM    9  O   UNL     1     -14.644 -13.362  -1.240  1.00  0.00           O  
HETATM   10  O   UNL     1     -12.393 -16.190  -1.763  1.00  0.00           O  
HETATM   11  O   UNL     1     -14.929 -16.940  -0.925  1.00  0.00           O  
HETATM   12  C   UNL     1     -16.042 -13.206  -1.578  1.00  0.00           C  
HETATM   13  C   UNL     1     -16.388 -11.743  -1.732  1.00  0.00           C  
HETATM   14  C   UNL     1     -16.253 -11.024  -0.404  1.00  0.00           C  
HETATM   15  C   UNL     1     -16.985 -11.731   0.712  1.00  0.00           C  
HETATM   16  C   UNL     1     -16.688 -13.221   0.727  1.00  0.00           C  
HETATM   17  C   UNL     1     -17.645 -14.068   1.568  1.00  0.00           C  
HETATM   18  O   UNL     1     -15.520 -11.155  -2.715  1.00  0.00           O  
HETATM   19  O   UNL     1     -16.750  -9.695  -0.554  1.00  0.00           O  
HETATM   20  O   UNL     1     -16.507 -11.027   1.897  1.00  0.00           O  
HETATM   21  O   UNL     1     -16.838 -13.769  -0.587  1.00  0.00           O  
HETATM   22  O   UNL     1     -17.570 -15.430   1.210  1.00  0.00           O  
HETATM   23  C   UNL     1     -17.158 -11.346   3.141  1.00  0.00           C  
HETATM   24  C   UNL     1     -17.172 -10.115   4.020  1.00  0.00           C  
HETATM   25  C   UNL     1     -15.794  -9.768   4.548  1.00  0.00           C  
HETATM   26  C   UNL     1     -15.154 -11.021   5.148  1.00  0.00           C  
HETATM   27  C   UNL     1     -15.164 -12.148   4.139  1.00  0.00           C  
HETATM   28  C   UNL     1     -14.590 -13.455   4.695  1.00  0.00           C  
HETATM   29  O   UNL     1     -17.805  -9.000   3.387  1.00  0.00           O  
HETATM   30  O   UNL     1     -15.935  -8.749   5.521  1.00  0.00           O  
HETATM   31  O   UNL     1     -13.809 -10.682   5.540  1.00  0.00           O  
HETATM   32  O   UNL     1     -16.517 -12.409   3.781  1.00  0.00           O  
HETATM   33  O   UNL     1     -14.509 -14.403   3.641  1.00  0.00           O  
HETATM   34  C   UNL     1     -13.510 -10.857   6.902  1.00  0.00           C  
HETATM   35  C   UNL     1     -12.803  -9.614   7.433  1.00  0.00           C  
HETATM   36  C   UNL     1     -11.391  -9.504   6.875  1.00  0.00           C  
HETATM   37  C   UNL     1     -10.629 -10.790   7.022  1.00  0.00           C  
HETATM   38  C   UNL     1     -11.399 -11.974   6.486  1.00  0.00           C  
HETATM   39  C   UNL     1     -10.720 -13.298   6.837  1.00  0.00           C  
HETATM   40  O   UNL     1     -13.583  -8.487   7.093  1.00  0.00           O  
HETATM   41  O   UNL     1     -10.728  -8.436   7.555  1.00  0.00           O  
HETATM   42  O   UNL     1      -9.384 -10.658   6.254  1.00  0.00           O  
HETATM   43  O   UNL     1     -12.693 -12.028   7.104  1.00  0.00           O  
HETATM   44  O   UNL     1     -11.341 -14.418   6.225  1.00  0.00           O  
HETATM   45  C   UNL     1      -8.215 -10.502   6.996  1.00  0.00           C  
HETATM   46  C   UNL     1      -7.386  -9.370   6.384  1.00  0.00           C  
HETATM   47  C   UNL     1      -6.930  -9.729   4.986  1.00  0.00           C  
HETATM   48  C   UNL     1      -6.240 -11.067   4.965  1.00  0.00           C  
HETATM   49  C   UNL     1      -7.068 -12.122   5.673  1.00  0.00           C  
HETATM   50  C   UNL     1      -6.262 -13.422   5.876  1.00  0.00           C  
HETATM   51  O   UNL     1      -8.181  -8.189   6.400  1.00  0.00           O  
HETATM   52  O   UNL     1      -6.084  -8.707   4.413  1.00  0.00           O  
HETATM   53  O   UNL     1      -6.108 -11.432   3.556  1.00  0.00           O  
HETATM   54  O   UNL     1      -7.449 -11.700   6.976  1.00  0.00           O  
HETATM   55  O   UNL     1      -7.070 -14.499   6.248  1.00  0.00           O  
HETATM   56  C   UNL     1      -4.823 -11.788   3.061  1.00  0.00           C  
HETATM   57  C   UNL     1      -4.709 -11.196   1.686  1.00  0.00           C  
HETATM   58  C   UNL     1      -5.688 -11.802   0.706  1.00  0.00           C  
HETATM   59  C   UNL     1      -5.582 -13.320   0.746  1.00  0.00           C  
HETATM   60  C   UNL     1      -5.670 -13.833   2.195  1.00  0.00           C  
HETATM   61  C   UNL     1      -5.470 -15.331   2.347  1.00  0.00           C  
HETATM   62  O   UNL     1      -4.863  -9.777   1.742  1.00  0.00           O  
HETATM   63  O   UNL     1      -5.400 -11.275  -0.605  1.00  0.00           O  
HETATM   64  O   UNL     1      -6.643 -13.780  -0.094  1.00  0.00           O  
HETATM   65  O   UNL     1      -4.673 -13.194   3.001  1.00  0.00           O  
HETATM   66  O   UNL     1      -4.145 -15.740   1.910  1.00  0.00           O  
HETATM   67  C   UNL     1      -6.444 -15.044  -0.708  1.00  0.00           C  
HETATM   68  C   UNL     1      -6.706 -14.858  -2.198  1.00  0.00           C  
HETATM   69  C   UNL     1      -8.145 -14.426  -2.415  1.00  0.00           C  
HETATM   70  C   UNL     1      -9.084 -15.363  -1.706  1.00  0.00           C  
HETATM   71  C   UNL     1      -8.707 -15.570  -0.266  1.00  0.00           C  
HETATM   72  C   UNL     1      -9.620 -16.621   0.401  1.00  0.00           C  
HETATM   73  O   UNL     1      -5.821 -13.918  -2.753  1.00  0.00           O  
HETATM   74  O   UNL     1      -8.413 -14.381  -3.812  1.00  0.00           O  
HETATM   75  O   UNL     1     -10.446 -14.901  -1.878  1.00  0.00           O  
HETATM   76  O   UNL     1      -7.351 -15.980  -0.158  1.00  0.00           O  
HETATM   77  O   UNL     1      -9.433 -17.870  -0.219  1.00  0.00           O  
HETATM   78  H   UNL     1     -11.002 -16.396  -3.194  1.00  0.00           H  
HETATM   79  H   UNL     1     -12.765 -15.288  -4.300  1.00  0.00           H  
HETATM   80  H   UNL     1     -12.351 -12.990  -2.348  1.00  0.00           H  
HETATM   81  H   UNL     1     -14.650 -14.987  -2.568  1.00  0.00           H  
HETATM   82  H   UNL     1     -12.515 -14.623  -0.415  1.00  0.00           H  
HETATM   83  H   UNL     1     -13.520 -16.657   0.569  1.00  0.00           H  
HETATM   84  H   UNL     1     -14.761 -15.368   0.416  1.00  0.00           H  
HETATM   85  H   UNL     1     -10.579 -14.743  -4.826  1.00  0.00           H  
HETATM   86  H   UNL     1     -14.257 -12.283  -3.469  1.00  0.00           H  
HETATM   87  H   UNL     1     -15.509 -17.430  -0.354  1.00  0.00           H  
HETATM   88  H   UNL     1     -16.235 -13.706  -2.539  1.00  0.00           H  
HETATM   89  H   UNL     1     -17.433 -11.663  -2.068  1.00  0.00           H  
HETATM   90  H   UNL     1     -15.185 -10.985  -0.143  1.00  0.00           H  
HETATM   91  H   UNL     1     -18.068 -11.578   0.593  1.00  0.00           H  
HETATM   92  H   UNL     1     -15.661 -13.378   1.090  1.00  0.00           H  
HETATM   93  H   UNL     1     -17.380 -13.961   2.630  1.00  0.00           H  
HETATM   94  H   UNL     1     -18.674 -13.712   1.409  1.00  0.00           H  
HETATM   95  H   UNL     1     -15.733 -10.235  -2.816  1.00  0.00           H  
HETATM   96  H   UNL     1     -16.671  -9.232   0.272  1.00  0.00           H  
HETATM   97  H   UNL     1     -18.173 -15.932   1.746  1.00  0.00           H  
HETATM   98  H   UNL     1     -18.202 -11.622   2.933  1.00  0.00           H  
HETATM   99  H   UNL     1     -17.779 -10.375   4.900  1.00  0.00           H  
HETATM  100  H   UNL     1     -15.170  -9.416   3.713  1.00  0.00           H  
HETATM  101  H   UNL     1     -15.736 -11.327   6.030  1.00  0.00           H  
HETATM  102  H   UNL     1     -14.582 -11.849   3.255  1.00  0.00           H  
HETATM  103  H   UNL     1     -13.586 -13.273   5.107  1.00  0.00           H  
HETATM  104  H   UNL     1     -15.247 -13.840   5.489  1.00  0.00           H  
HETATM  105  H   UNL     1     -17.791  -8.252   3.973  1.00  0.00           H  
HETATM  106  H   UNL     1     -15.080  -8.518   5.864  1.00  0.00           H  
HETATM  107  H   UNL     1     -14.154 -15.219   3.975  1.00  0.00           H  
HETATM  108  H   UNL     1     -14.446 -10.977   7.467  1.00  0.00           H  
HETATM  109  H   UNL     1     -12.734  -9.700   8.528  1.00  0.00           H  
HETATM  110  H   UNL     1     -11.464  -9.264   5.804  1.00  0.00           H  
HETATM  111  H   UNL     1     -10.397 -10.958   8.084  1.00  0.00           H  
HETATM  112  H   UNL     1     -11.493 -11.890   5.393  1.00  0.00           H  
HETATM  113  H   UNL     1      -9.672 -13.253   6.505  1.00  0.00           H  
HETATM  114  H   UNL     1     -10.754 -13.431   7.928  1.00  0.00           H  
HETATM  115  H   UNL     1     -14.456  -8.585   7.454  1.00  0.00           H  
HETATM  116  H   UNL     1     -11.227  -7.634   7.449  1.00  0.00           H  
HETATM  117  H   UNL     1     -10.882 -15.211   6.475  1.00  0.00           H  
HETATM  118  H   UNL     1      -8.457 -10.232   8.035  1.00  0.00           H  
HETATM  119  H   UNL     1      -6.495  -9.222   7.011  1.00  0.00           H  
HETATM  120  H   UNL     1      -7.831  -9.816   4.361  1.00  0.00           H  
HETATM  121  H   UNL     1      -5.251 -10.988   5.439  1.00  0.00           H  
HETATM  122  H   UNL     1      -7.958 -12.348   5.067  1.00  0.00           H  
HETATM  123  H   UNL     1      -5.752 -13.672   4.934  1.00  0.00           H  
HETATM  124  H   UNL     1      -5.513 -13.254   6.664  1.00  0.00           H  
HETATM  125  H   UNL     1      -8.447  -7.998   7.292  1.00  0.00           H  
HETATM  126  H   UNL     1      -6.536  -7.872   4.435  1.00  0.00           H  
HETATM  127  H   UNL     1      -6.533 -15.274   6.361  1.00  0.00           H  
HETATM  128  H   UNL     1      -4.041 -11.353   3.701  1.00  0.00           H  
HETATM  129  H   UNL     1      -3.697 -11.419   1.316  1.00  0.00           H  
HETATM  130  H   UNL     1      -6.707 -11.515   1.003  1.00  0.00           H  
HETATM  131  H   UNL     1      -4.610 -13.619   0.326  1.00  0.00           H  
HETATM  132  H   UNL     1      -6.668 -13.580   2.583  1.00  0.00           H  
HETATM  133  H   UNL     1      -5.597 -15.603   3.405  1.00  0.00           H  
HETATM  134  H   UNL     1      -6.224 -15.855   1.741  1.00  0.00           H  
HETATM  135  H   UNL     1      -4.241  -9.415   2.362  1.00  0.00           H  
HETATM  136  H   UNL     1      -5.476 -10.328  -0.590  1.00  0.00           H  
HETATM  137  H   UNL     1      -4.052 -16.679   2.017  1.00  0.00           H  
HETATM  138  H   UNL     1      -5.407 -15.382  -0.566  1.00  0.00           H  
HETATM  139  H   UNL     1      -6.565 -15.831  -2.691  1.00  0.00           H  
HETATM  140  H   UNL     1      -8.270 -13.421  -1.986  1.00  0.00           H  
HETATM  141  H   UNL     1      -8.998 -16.340  -2.204  1.00  0.00           H  
HETATM  142  H   UNL     1      -8.844 -14.618   0.268  1.00  0.00           H  
HETATM  143  H   UNL     1      -9.367 -16.701   1.469  1.00  0.00           H  
HETATM  144  H   UNL     1     -10.671 -16.313   0.295  1.00  0.00           H  
HETATM  145  H   UNL     1      -4.926 -14.202  -2.609  1.00  0.00           H  
HETATM  146  H   UNL     1      -9.313 -14.111  -3.954  1.00  0.00           H  
HETATM  147  H   UNL     1      -9.995 -18.516   0.192  1.00  0.00           H  
CONECT    1    2   75   10   78                                       
CONECT    2    7    3    1   79                                       
CONECT    3    8    2    4   80                                       
CONECT    4    3    9    5   81                                       
CONECT    5    4   10    6   82                                       
CONECT    6    5   11   83   84                                       
CONECT    7    2   85                                                 
CONECT    8    3   86                                                 
CONECT    9    4   12                                                 
CONECT   10    1    5                                                 
CONECT   11    6   87                                                 
CONECT   12   13    9   21   88                                       
CONECT   13   18   12   14   89                                       
CONECT   14   13   19   15   90                                       
CONECT   15   14   16   20   91                                       
CONECT   16   21   15   17   92                                       
CONECT   17   16   22   93   94                                       
CONECT   18   13   95                                                 
CONECT   19   14   96                                                 
CONECT   20   15   23                                                 
CONECT   21   12   16                                                 
CONECT   22   17   97                                                 
CONECT   23   20   32   24   98                                       
CONECT   24   23   29   25   99                                       
CONECT   25   24   26   30  100                                       
CONECT   26   27   25   31  101                                       
CONECT   27   32   28   26  102                                       
CONECT   28   33   27  104  103                                       
CONECT   29   24  105                                                 
CONECT   30   25  106                                                 
CONECT   31   26   34                                                 
CONECT   32   23   27                                                 
CONECT   33   28  107                                                 
CONECT   34   31   43   35  108                                       
CONECT   35   36   34   40  109                                       
CONECT   36   37   35   41  110                                       
CONECT   37   42   38   36  111                                       
CONECT   38   39   37   43  112                                       
CONECT   39   44   38  114  113                                       
CONECT   40   35  115                                                 
CONECT   41   36  116                                                 
CONECT   42   45   37                                                 
CONECT   43   38   34                                                 
CONECT   44   39  117                                                 
CONECT   45   42   46   54  118                                       
CONECT   46   47   51   45  119                                       
CONECT   47   52   48   46  120                                       
CONECT   48   53   47   49  121                                       
CONECT   49   48   50   54  122                                       
CONECT   50   49   55  123  124                                       
CONECT   51   46  125                                                 
CONECT   52   47  126                                                 
CONECT   53   56   48                                                 
CONECT   54   49   45                                                 
CONECT   55   50  127                                                 
CONECT   56   57   65   53  128                                       
CONECT   57   58   62   56  129                                       
CONECT   58   63   59   57  130                                       
CONECT   59   64   58   60  131                                       
CONECT   60   59   61   65  132                                       
CONECT   61   66   60  134  133                                       
CONECT   62   57  135                                                 
CONECT   63   58  136                                                 
CONECT   64   67   59                                                 
CONECT   65   60   56                                                 
CONECT   66   61  137                                                 
CONECT   67   68   76   64  138                                       
CONECT   68   73   69   67  139                                       
CONECT   69   74   68   70  140                                       
CONECT   70   69   75   71  141                                       
CONECT   71   70   76   72  142                                       
CONECT   72   71   77  143  144                                       
CONECT   73   68  145                                                 
CONECT   74   69  146                                                 
CONECT   75    1   70                                                 
CONECT   76   67   71                                                 
CONECT   77   72  147                                                 
CONECT   78    1                                                      
CONECT   79    2                                                      
CONECT   80    3                                                      
CONECT   81    4                                                      
CONECT   82    5                                                      
CONECT   83    6                                                      
CONECT   84    6                                                      
CONECT   85    7                                                      
CONECT   86    8                                                      
CONECT   87   11                                                      
CONECT   88   12                                                      
CONECT   89   13                                                      
CONECT   90   14                                                      
CONECT   91   15                                                      
CONECT   92   16                                                      
CONECT   93   17                                                      
CONECT   94   17                                                      
CONECT   95   18                                                      
CONECT   96   19                                                      
CONECT   97   22                                                      
CONECT   98   23                                                      
CONECT   99   24                                                      
CONECT  100   25                                                      
CONECT  101   26                                                      
CONECT  102   27                                                      
CONECT  103   28                                                      
CONECT  104   28                                                      
CONECT  105   29                                                      
CONECT  106   30                                                      
CONECT  107   33                                                      
CONECT  108   34                                                      
CONECT  109   35                                                      
CONECT  110   36                                                      
CONECT  111   37                                                      
CONECT  112   38                                                      
CONECT  113   39                                                      
CONECT  114   39                                                      
CONECT  115   40                                                      
CONECT  116   41                                                      
CONECT  117   44                                                      
CONECT  118   45                                                      
CONECT  119   46                                                      
CONECT  120   47                                                      
CONECT  121   48                                                      
CONECT  122   49                                                      
CONECT  123   50                                                      
CONECT  124   50                                                      
CONECT  125   51                                                      
CONECT  126   52                                                      
CONECT  127   55                                                      
CONECT  128   56                                                      
CONECT  129   57                                                      
CONECT  130   58                                                      
CONECT  131   59                                                      
CONECT  132   60                                                      
CONECT  133   61                                                      
CONECT  134   61                                                      
CONECT  135   62                                                      
CONECT  136   63                                                      
CONECT  137   66                                                      
CONECT  138   67                                                      
CONECT  139   68                                                      
CONECT  140   69                                                      
CONECT  141   70                                                      
CONECT  142   71                                                      
CONECT  143   72                                                      
CONECT  144   72                                                      
CONECT  145   73                                                      
CONECT  146   74                                                      
CONECT  147   77                                                      
MASTER        0    0    0    0    0    0    0    0  147    0  147    0
END
