NP011


 41 44  0  0  0  0  0  0  0  0999 V2000
   42.5777  -69.7653   87.5926 C   0  0  0  0  0  0  0  0  0  0  0  0
   43.0070  -71.2260   87.4770 C   0  0  0  0  0  0  0  0  0  0  0  0
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   45.3808  -70.6329   87.5451 O   0  0  0  0  0  0  0  0  0  0  0  0
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   46.1037  -68.5798   88.4069 C   0  0  0  0  0  0  0  0  0  0  0  0
   45.8531  -67.2869   88.8530 C   0  0  0  0  0  0  0  0  0  0  0  0
   44.5603  -66.7793   88.8791 C   0  0  0  0  0  0  0  0  0  0  0  0
   43.5054  -67.5883   88.4632 C   0  0  0  0  0  0  0  0  0  0  0  0
   43.7256  -68.8984   88.0212 C   0  0  0  0  0  0  0  0  0  0  0  0
   42.2241  -67.1124   88.4861 O   0  0  0  0  0  0  0  0  0  0  0  0
   46.8624  -66.4730   89.2774 O   0  0  0  0  0  0  0  0  0  0  0  0
   42.2406  -66.1857   88.7784 H   0  0  0  0  0  0  0  0  0  0  0  0
   47.7008  -66.9604   89.2184 H   0  0  0  0  0  0  0  0  0  0  0  0
   44.5162  -70.9221   85.2885 C   0  0  0  0  0  0  0  0  0  0  0  0
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   42.6196  -69.5357   82.4718 O   0  0  0  0  0  0  0  0  0  0  0  0
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   41.6831  -76.1318   84.1826 C   0  0  0  0  0  0  0  0  0  0  0  0
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   40.9161  -75.3439   86.3265 C   0  0  0  0  0  0  0  0  0  0  0  0
   40.0889  -77.4002   85.3736 O   0  0  0  0  0  0  0  0  0  0  0  0
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   43.2896  -74.8708   82.9516 O   0  0  0  0  0  0  0  0  0  0  0  0
   39.5966  -77.3781   86.2136 H   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0
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 10  1  1  0  0  0
 10  5  1  0  0  0
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 36 39  1  0  0  0
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 38 41  1  0  0  0
M  END
> <minimizedAffinity>
-11.74094

$$$$
NP011


 41 44  0  0  0  0  0  0  0  0999 V2000
   42.5224  -69.7341   87.4574 C   0  0  0  0  0  0  0  0  0  0  0  0
   42.9431  -71.2013   87.4200 C   0  0  0  0  0  0  0  0  0  0  0  0
   44.3416  -71.3352   86.7723 C   0  0  0  0  0  0  0  0  0  0  0  0
   45.3167  -70.6233   87.5734 O   0  0  0  0  0  0  0  0  0  0  0  0
   44.9686  -69.3479   87.9372 C   0  0  0  0  0  0  0  0  0  0  0  0
   46.0183  -68.5425   88.3847 C   0  0  0  0  0  0  0  0  0  0  0  0
   45.7595  -67.2309   88.7669 C   0  0  0  0  0  0  0  0  0  0  0  0
   44.4716  -66.7133   88.7133 C   0  0  0  0  0  0  0  0  0  0  0  0
   43.4294  -67.5306   88.2820 C   0  0  0  0  0  0  0  0  0  0  0  0
   43.6574  -68.8590   87.9033 C   0  0  0  0  0  0  0  0  0  0  0  0
   42.1528  -67.0448   88.2271 O   0  0  0  0  0  0  0  0  0  0  0  0
   46.7558  -66.4080   89.2044 O   0  0  0  0  0  0  0  0  0  0  0  0
   42.1644  -66.1072   88.4826 H   0  0  0  0  0  0  0  0  0  0  0  0
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   42.5930  -69.5576   82.4989 O   0  0  0  0  0  0  0  0  0  0  0  0
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   47.1181  -70.9598   82.6712 O   0  0  0  0  0  0  0  0  0  0  0  0
   41.8093  -69.5122   83.0740 H   0  0  0  0  0  0  0  0  0  0  0  0
   44.1217  -69.5822   81.0130 H   0  0  0  0  0  0  0  0  0  0  0  0
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   41.9118  -71.9707   86.7726 O   0  0  0  0  0  0  0  0  0  0  0  0
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   41.5259  -73.5035   88.4319 O   0  0  0  0  0  0  0  0  0  0  0  0
   41.7257  -74.2249   86.1667 C   0  0  0  0  0  0  0  0  0  0  0  0
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   41.6817  -76.1693   84.1757 C   0  0  0  0  0  0  0  0  0  0  0  0
   40.8826  -76.3203   85.3023 C   0  0  0  0  0  0  0  0  0  0  0  0
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   40.0977  -77.4364   85.3815 O   0  0  0  0  0  0  0  0  0  0  0  0
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 10  1  1  0  0  0
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M  END
> <minimizedAffinity>
-11.66617

$$$$
NP011


 41 44  0  0  0  0  0  0  0  0999 V2000
   41.7362  -70.9156   84.7646 C   0  0  0  0  0  0  0  0  0  0  0  0
   41.5779  -71.4705   86.1781 C   0  0  0  0  0  0  0  0  0  0  0  0
   42.4395  -72.7442   86.3469 C   0  0  0  0  0  0  0  0  0  0  0  0
   43.8378  -72.4109   86.1645 O   0  0  0  0  0  0  0  0  0  0  0  0
   44.1289  -71.6596   85.0550 C   0  0  0  0  0  0  0  0  0  0  0  0
   45.4736  -71.6401   84.6779 C   0  0  0  0  0  0  0  0  0  0  0  0
   45.8600  -70.9106   83.5590 C   0  0  0  0  0  0  0  0  0  0  0  0
   44.9279  -70.1986   82.8149 C   0  0  0  0  0  0  0  0  0  0  0  0
   43.5922  -70.2107   83.2102 C   0  0  0  0  0  0  0  0  0  0  0  0
   43.1757  -70.9255   84.3396 C   0  0  0  0  0  0  0  0  0  0  0  0
   42.6582  -69.5123   82.4970 O   0  0  0  0  0  0  0  0  0  0  0  0
   47.1615  -70.8690   83.1519 O   0  0  0  0  0  0  0  0  0  0  0  0
   43.0927  -69.1043   81.7293 H   0  0  0  0  0  0  0  0  0  0  0  0
   47.6974  -71.3950   83.7685 H   0  0  0  0  0  0  0  0  0  0  0  0
   42.1130  -74.0185   85.5610 C   0  0  0  0  0  0  0  0  0  0  0  0
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   41.4176  -77.5095   83.3697 O   0  0  0  0  0  0  0  0  0  0  0  0
   39.9413  -76.9738   85.6132 O   0  0  0  0  0  0  0  0  0  0  0  0
   44.0006  -75.0669   82.3997 H   0  0  0  0  0  0  0  0  0  0  0  0
   42.0598  -77.4709   82.6315 H   0  0  0  0  0  0  0  0  0  0  0  0
   39.9677  -77.6901   84.9470 H   0  0  0  0  0  0  0  0  0  0  0  0
   40.1771  -71.6591   86.4560 O   0  0  0  0  0  0  0  0  0  0  0  0
   39.3148  -71.1164   85.5651 C   0  0  0  0  0  0  0  0  0  0  0  0
   39.2020  -69.9268   85.3158 O   0  0  0  0  0  0  0  0  0  0  0  0
   38.4922  -72.1683   84.9117 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0
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 10  1  1  0  0  0
 10  5  1  0  0  0
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 36 39  1  0  0  0
 37 40  1  0  0  0
 38 41  1  0  0  0
M  END
> <minimizedAffinity>
-10.85916

$$$$
NP011


 41 44  0  0  0  0  0  0  0  0999 V2000
   42.8890  -69.9801   84.4818 C   0  0  0  0  0  0  0  0  0  0  0  0
   43.1076  -70.3462   85.9478 C   0  0  0  0  0  0  0  0  0  0  0  0
   43.7819  -71.7346   86.0523 C   0  0  0  0  0  0  0  0  0  0  0  0
   45.0830  -71.6905   85.4162 O   0  0  0  0  0  0  0  0  0  0  0  0
   45.1140  -71.1261   84.1670 C   0  0  0  0  0  0  0  0  0  0  0  0
   46.2572  -71.3985   83.4122 C   0  0  0  0  0  0  0  0  0  0  0  0
   46.3713  -70.8742   82.1295 C   0  0  0  0  0  0  0  0  0  0  0  0
   45.3663  -70.0807   81.5912 C   0  0  0  0  0  0  0  0  0  0  0  0
   44.2383  -69.8008   82.3592 C   0  0  0  0  0  0  0  0  0  0  0  0
   44.1016  -70.3040   83.6585 C   0  0  0  0  0  0  0  0  0  0  0  0
   43.2394  -69.0170   81.8528 O   0  0  0  0  0  0  0  0  0  0  0  0
   47.4677  -71.1201   81.3557 O   0  0  0  0  0  0  0  0  0  0  0  0
   43.4628  -68.7795   80.9373 H   0  0  0  0  0  0  0  0  0  0  0  0
   48.0883  -71.6707   81.8614 H   0  0  0  0  0  0  0  0  0  0  0  0
   43.0399  -72.9993   85.6070 C   0  0  0  0  0  0  0  0  0  0  0  0
   41.9868  -73.5777   86.3371 C   0  0  0  0  0  0  0  0  0  0  0  0
   41.3797  -74.7481   85.8910 C   0  0  0  0  0  0  0  0  0  0  0  0
   41.8068  -75.3689   84.7284 C   0  0  0  0  0  0  0  0  0  0  0  0
   42.8533  -74.8270   83.9988 C   0  0  0  0  0  0  0  0  0  0  0  0
   43.4744  -73.6576   84.4313 C   0  0  0  0  0  0  0  0  0  0  0  0
   43.2448  -75.4786   82.8627 O   0  0  0  0  0  0  0  0  0  0  0  0
   41.1896  -76.5187   84.3173 O   0  0  0  0  0  0  0  0  0  0  0  0
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 10  1  1  0  0  0
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M  END
> <minimizedAffinity>
-10.84843

$$$$
NP011


 41 44  0  0  0  0  0  0  0  0999 V2000
   41.7429  -70.8917   84.6040 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  1  1  0  0  0
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M  END
> <minimizedAffinity>
-10.68145

$$$$
NP011


 41 44  0  0  0  0  0  0  0  0999 V2000
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M  END
> <minimizedAffinity>
-10.63231

$$$$
NP011


 41 44  0  0  0  0  0  0  0  0999 V2000
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M  END
> <minimizedAffinity>
-10.52379

$$$$
NP011


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> <minimizedAffinity>
-10.47567

$$$$
NP011


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M  END
> <minimizedAffinity>
-10.24340

$$$$
