1809
*6 N1C=NN=N1    6.214
*34 NNC(N)=S    9.180
*56 N=C1NNC(=S)S1    8.656
*61 CC([N+]([O-])=O)[N+]([O-])=O    7.495
*72 O=C1NNC(=O)NN1   17.521
*85 OC(=O)CS(O)(=O)=O   13.029
*87 CC=NO    5.231
*99 NOCC(O)=O    9.932
*116 NCC(=O)NO   13.337
*160 CNOC    5.313
*164 NCCS    6.447
*189 O=C1OC=CO1    1.963
*261 NN1CC(=O)NC1=O   11.183
*272 NCCC#N    8.380
*275 N=C1NCCO1    8.588
*289 CCC([N+]([O-])=O)[N+]([O-])=O    7.373
*355 N[CH](CS)C(O)=O   10.276
*362 CC(=O)NCS(O)(=O)=O   11.708
*379 ON(O)NC1=NCCN1N=O   18.987
*383 CCC(=O)NN   10.208
*396 ON(O)NC1=NCCN1   18.079
*421 C[CH](CO)S(O)(=O)=O   12.091
*441 CCN(CC)N=O    5.440
*450 NNC(=O)CCCO   14.521
*457 C[CH](CO)OC(=O)NN   13.971
*482 CCOCCO    7.255
*495 CCCOS(C)(=O)=O    5.149
*513 CSSC(SSC)SSC    6.483
*526 C[CH](N)[CH](C)O    9.188
*529 CC(N)(CO)CO   10.625
*545 CNCCNC    8.302
*553 CN(C)N=NN(C)C    7.708
*554 NN1CCN(N)CC1   13.416
*581 O=NC1C(=O)NC(=O)NC1=O   14.151
*584 OC1=C2N=NNC2=NC=N1   14.082
*587 N=C1N=CN=C2NSN=C12    8.194
*652 CN1C(=O)CSC1=S    7.242
*661 O=C1CSCC(=O)N1    9.690
*676 NC(=O)N1C=CC=N1    9.426
*687 NC(=O)NC(=O)CC#N   13.349
*718 C[CH](C#N)C(N)=O   11.210
*733 CC(C)(O[N+]([O-])=O)C#N    6.839
*740 S=C1NCCNC(=S)SSSS1    5.234
*743 NC1=CN=C(N)N=C1    8.889
*747 NC(=O)C1=C(N)NC=N1   15.264
*811 OC(=O)C[CH](S)C(O)=O   12.717
*849 CC(=O)NCC(O)=O   11.439
*876 CNCCC#N    8.038
*884 CC(=O)CSC(N)=N   11.788
*903 CCC(C)([N+]([O-])=O)[N+]([O-])=O    7.249
*927 NC(=S)NN=CC=NNC(N)=S   11.492
*928 CC(C)C=O    3.921
*946 C[CH](O)C(C)=O    4.987
*957 O=S1CCOCC1    9.469
*1012 NCCCC(O)=O   10.003
*1014 CS(=O)(=O)N1CCC1    5.225
*1039 OCC(CO)(CO)[N+]([O-])=O   11.317
*1071 CC(CC(C)=NO)=NO    9.083
*1079 CCOC(=O)CNC(N)=O   10.297
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*1116 CC(C)(C)OC(S)=S    4.338
*1165 NCC1CCC1    4.983
*1166 C1CCNCC1    4.764
*1199 CC[C](C)(O)C(N)=O    8.389
*1201 CNC(=O)OC(C)C    6.815
*1218 CO[CH](C)[CH](N)C(O)=O   10.635
*1224 CC[CH]([CH](C)O)[N+]([O-])=O    8.321
*1226 C[CH](O)C(C)(C)[N+]([O-])=O    8.321
*1292 CS(=O)(=O)N(CCCN(N=O)S(C)(=O)=O)N=O   11.103
*1328 COS(=O)(=O)CCCS(=O)(=O)OC    9.410
*1334 CCCCCN    4.629
*1348 CN(C)CSCCO    8.053
*1366 CCCCN(N=O)C(=N)NN(O)O   18.604
*1376 N#CC1=CC=CO1    4.285
*1381 OC1=NC(=C(C=N1)C#N)O   15.516
*1406 ON=CC1=CC=C(O1)[N+]([O-])=O    8.851
*1449 SC1=NC(=C2N=CNC2=N1)S    8.550
*1472 [O-][N+]1=CC=CC=C1S    9.575
*1483 CC1=CC=C(O1)[N+]([O-])=O    4.631
*1485 ONC(=O)C1=CC=CO1   11.354
*1490 OCC1=CC=C(O1)[N+]([O-])=O    9.068
*1529 NC1=NC(=C2N=CNC2=N1)S    9.027
*1532 SC1=C2NC(=N)NC2=NC=N1   13.180
*1534 CC1=NC(=N)C2=NSNC2=N1    8.072
*1549 NC(=O)N1C=CC=C1    9.035
*1554 CC1=CC(=NO1)C(N)=S    8.342
*1565 CN1NC(=O)C=CC1=O   10.236
*1569 CN1C(=O)NC=CC1=O    9.721
*1595 CN1N=CC(=C1N)C#N    9.570
*1608 NNC(=O)C1=CC(=NC(=N1)O)O   22.265
*1634 C=COC(=O)C=C    3.211
*1651 CC(=C)[CH](O)C#N    4.818
*1689 CC1=CC(=NC(=N1)O)N   12.928
*1707 NC(=O)C1=CC(=NC(=N1)N)N   15.274
*1717 N#CCCN1CC1    8.052
*1722 N#CN1CCCC1    3.907
*1723 CN1N=C(C)CC1=O    7.416
*1726 N#CN1CCOCC1    5.959
*1732 CC1(C)NC(=O)NC1=O    8.558
*1735 CN1CCC(=O)NC1=O    9.640
*1738 C[CH]1CC(=O)NC(=O)N1    9.857
*1759 CNC1=CC(=NC(=N1)N)S    7.971
*1766 CC(C)(O)C#C    5.983
*1784 COC(=O)C(C)=C    3.839
*1790 CC(=O)OCC=C    3.638
*1811 CO12CC1OC(=O)C2    8.475
*1857 NCC(=O)CCC(O)=O   12.000
*1858 CC(=O)NCCC(O)=O   12.616
*1860 C[CH](NC(C)=O)C(O)=O   11.315
*1867 CC(=O)OC[CH](N)C(O)=O   11.450
*1873 CCSCCC#N    6.240
*1885 CCOC(=O)C=NNC(N)=O   10.210
*1928 CCOC(=O)N=NC(=O)OCC    4.752
*1934 CN(C)C1=NC(=CC(=N1)O)N   11.218
*1936 CN1C(=C(N)C(=O)N(C)C1=O)N   12.914
*1938 CN(C)S(=O)(=O)NC1=NC=CC=N1    6.788
*1958 CC(C)C=CC=O    4.005
*1967 CCC(C)=CC(O)=O    6.026
*1976 OC[CH]1CCC=CO1    6.593
*1977 CCC(=O)C(=O)CC    6.458
*2022 C[CH](CCC(O)=O)C(O)=O   11.021
*2028 C1COC2OCCOC2O1    8.747
*2043 OC[CH]1C[C](O)(CO)C(=O)O1    7.424
*2118 CN(C)COC(=S)SCC(O)=O   12.363
*2155 CC(C)C1=NC(=NC(=N1)N)N    8.983
*2156 C1CCN(CC1)C2=NN=NN2    8.000
*2167 CCN(CC)CC#N    7.573
*2196 [O-][N+](=O)CCCCCC[N+]([O-])=O    7.003
*2200 COC(=O)NCCNC(=O)OC    9.666
*2213 C[CH]1CNCCN1C(S)=S    7.166
*2220 CN(C)C(=S)SSSSC(=S)N(C)C    4.195
*2388 CCC[C](C)(N)C(O)=O    8.457
*2393 CCOC(=O)C(C)(C)N    6.075
*2404 CC(C)C[CH](N)C(O)=O    8.457
*2436 OC[CH](O)[CH](O)[CH](O)[CH](O)C=NO   14.924
*2483 CCN(CC)CC(N)=O    9.710
*2484 CC[CH](C)[CH](NN)C(O)=O   10.836
*2493 N[CH](C=NO)[CH](O)[CH](O)[CH](O)CO   17.474
*2503 N[CH](CCCNC(N)=N)C(O)=O   17.738
*2508 CN(N=O)S(=O)(=O)CCCCS(=O)(=O)N(C)N=O   10.979
*2587 C[CH](CCO)N(C)C    8.506
*2605 N[CH](CO)[CH](O)[CH](O)[CH](O)CO   14.690
*2631 ON(O)NC(=N)NCCN1CCN=C1NN(O)O   34.547
*2642 OC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O    7.559
*2644 [O-][N+](=O)C=CC1=CC=C(O1)[N+]([O-])=O    7.863
*2652 [O-][N+](=O)C1=CC2=C(NN=N2)C=C1    9.237
*2697 COC(=O)C1=CC=C(O1)[N+]([O-])=O    6.863
*2765 CC(=O)C1=CC(=NC(=N1)O)O   16.240
*2773 OC(=O)CC1=C(NC=N1)C(O)=O   15.208
*2777 NS(=O)(=O)C1=CC=C(C=C1)[N+]([O-])=O    8.777
*2781 NC1=CC=C(C=C1[N+]([O-])=O)S(O)(=O)=O   13.115
*2817 CN1C=NC2=C(O)N=NC(=C12)O   16.346
*2839 CN1N=CC2=C(S)N=CN=C12    7.804
*2842 CSC1=C2C=NNC2=NC=N1    9.656
*2845 CN1C=NC2=NC=NC(=C12)S    7.796
*2848 CC1=NC2=C(N)N=CN=C2S1   13.102
*2855 CSC1=C2N=CNC2=C(S)N=N1    9.078
*2865 CC1=C(O)C(=O)C=C1    4.873
*2882 OCC1=CC=C(O1)C(O)=O   11.360
*2931 OC(=O)CN1C=CC=C1    8.842
*2954 NC1=C(S)C=CC=C1    6.733
*2975 NC1=CC=C(C=C1N)[N+]([O-])=O   11.577
*2993 CC1=CC(=O)N(NC(N)=O)C1=O   17.558
*3010 CN1C=NC2=NC=NC(=C12)N   11.824
*3030 CS(=O)(=O)C1=NC(=C2N=CNC2=N1)N   15.199
*3033 CSC1=NC(=C2N=CNC2=N1)N   13.099
*3047 CC1=CC=C(N)N=C1    8.561
*3058 CC1=CC(=NC(=N1)O)C    9.432
*3060 C[C]1(CCC(=O)N1)C#N   11.101
*3073 COC1=NC(=O)N(C)C=C1    7.921
*3075 CN1C=C(C)C(=O)NC1=O    9.526
*3092 CC[C]1(NC(=O)NC1=O)C=O   11.593
*3117 CC(C)=C1NC(=S)NC1=S    5.963
*3131 NNC(=O)C1=CC=C(O1)C(=O)NN   16.600
*3149 CCOC1=C2N=NNC2=NC(=N1)N   10.146
*3151 CCSC1=C2N=NNC2=NC(=N1)N    9.824
*3193 CCOC(=O)C(=O)CC(O)=O   11.162
*3195 O[CH](C=O)[CH]1OC(=O)[CH](O)[CH]1O    6.951
*3233 CCC[CH]1OC(=O)NC1=O    5.951
*3267 ON=C1CC(CC(C1)=NO)=NO   13.536
*3268 OCCNC1=C(O)N=C(O)N=C1   20.924
*3271 CC1=NN=C(NCC=C)S1    8.757
*3272 CC1=NC(=C(CS)C=N1)N   10.351
*3290 CCN1N=NC2=C1N=C(N)N=C2N   12.001
*3297 CC1=C(NN)C=CC=C1    8.057
*3336 CC[CH]1CC(=O)NC(=O)NC1=O   12.565
*3375 CC(=NNC(N)=S)C1=CC=CN1   10.118
*3387 ON(O)NC(=N)NN=CC1=CC=CC=N1   21.955
*3404 CC=CC(=O)OCC=C    3.721
*3495 OC[CH]1O[CH]2NC(=S)O[CH]2[CH](O)[CH]1O   14.788
*3537 CN(C)COC(=S)SCCC#N   10.493
*3545 NC(=O)NC1(CCCC1)C(O)=O   12.788
*3549 COC(OC)[C]1(C)NC(=O)NC1=O   11.721
*3564 CCCNC1=CC(=NC(=N1)N)S    7.724
*3585 CCCCOC(=O)C=C    3.666
*3586 OC(=O)C1CCCCC1    6.002
*3609 OC(=O)C1(O)CCCCC1    6.810
*3620 CCCCC(C(O)=O)C(O)=O   10.896
*3623 CCOC(=O)[CH](C)OC(C)=O    5.283
*3643 OC[C]12OC[CH](O1)[CH](O)[CH](O)[CH]2O   14.163
*3673 NC[CH]1O[CH]2CCC[CH]1O2    9.402
*3685 COC(=O)N1CCCCC1    6.706
*3694 CCOC(=O)N1CCOCC1    8.759
*3700 CC(C[CH]1CCS(=O)(=O)C1)=NO    9.166
*3728 NC(=S)NN=C1CCCCC1    6.115
*3733 C1CCCCCC1    0.470
*3749 CCN(CN(CC)C=O)C=O    7.185
*3770 CCCCN1CCNC1=S    5.764
*3793 CC[C](C)(O)C1CC1    5.187
*3806 CCCCCC(=O)OC    3.264
*3813 CCC(CC)OC(C)=O    3.264
*3815 C[C]1(O)CCC[C]1(C)O    6.623
*3829 CCCCOC(=O)[CH](C)O    4.071
*3831 CCCCCOCC(O)=O    6.851
*3835 CCCCOCCOC=O    5.059
*3845 C[CH](O)C(=O)OCCOCCO    7.562
*3877 CCCCCCC(N)=O    7.336
*3911 CCN(CC)C[CH](O)C=O    7.910
*3912 CC(C)C[C](C)(N)C(O)=O    8.333
*3913 CCCCNC[CH](O)C=O    8.130
*3948 CCCCCCSC(N)=S    4.000
*3971 CCC(CC)CNC(N)=O    8.481
*3973 C[CH]1CN(CCO)CCN1   12.507
*3987 N[CH](CCCCNC(N)=N)C(O)=O   17.614
*4011 CCCC(C)(CO)CO    6.268
*4045 CCCN(C)C[CH](C)O    8.382
*4085 [O-][N+](=O)C1=CC2=C(NC(=S)S2)C=C1    7.320
*4088 [O-][N+](=O)C1=CC=C(C=C1)N=C=O    6.037
*4094 [O-][N+](=O)C1=CC=CC(=C1)C(=O)N=[N+]=[N-]    9.688
*4100 OC(=O)C1=CC(=O)C(=C(O1)C(O)=O)O   14.339
*4125 OC(=O)C1=CC(=CN=C1)C(O)=O   14.544
*4136 OC(=O)C=CC1=CC=C(O1)[N+]([O-])=O   10.293
*4138 OS(=O)(=O)C1=C(C=O)C=CC(=C1)[N+]([O-])=O   13.606
*4154 [O-][N+](=O)C1=CC2=C(C=C1)C=NN2    8.848
*4171 CN(C1=C(C=C(C=C1[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O    8.567
*4174 NC1=CC=C(C=C1)C#N    7.735
*4241 NC1=NC(=C2N=CNC2=N1)SCC#N   12.932
*4249 O=CC=CC1=CC=CO1    5.796
*4267 OC(=O)C1=C(O)C=C(O)C=C1   11.830
*4273 O[CH]1OCC=C2OC(=O)C=C12    9.971
*4369 CN1N=NC2=C1C=CC=C2    5.504
*4375 NC1=C2NN=CC2=CC=C1    9.896
*4407 NC(=O)CSC1=C2N=CNC2=NC=N1   16.466
*4436 CC1=C(C=NC=C1)C(N)=O   11.495
*4449 NNC(=O)C1=CC=C(O)C=C1   15.017
*4453 CC1=CC(=C(N)C=C1)[N+]([O-])=O    6.742
*4461 CC1=C(C=CC=C1N)[N+]([O-])=O    8.081
*4481 CCSC1=NC(=CC(=N1)O)C(O)=O   14.036
*4482 COC(=O)C1=NC(=NC(=C1)O)SC   11.654
*4514 COC1=C2N(C)C=NC2=NC=N1    8.640
*4517 CN1C=NC2=C(N(C)C=N2)C1=O   10.924
*4524 COC1=C2N=C(NC2=NC=N1)SC   11.506
*4541 NCC(=O)NN=CC1=CC=C(O1)[N+]([O-])=O   13.710
*4560 CSC1=NC(=C2N=C(C)NC2=N1)S    9.028
*4608 OS(=O)(=O)SCC1=CC=CC=C1    8.804
*4618 OC(=O)[CH]1CCC1(C(O)=O)C(O)=O   16.506
*4640 NC1=C(CO)C=CC=C1   10.115
*4642 O=C1CCCC[CH]1C#N    7.674
*4678 CC1=CC(=C(N)C=C1)S(O)(=O)=O   12.008
*4729 NC1=NC(=C2CCCC2=N1)S    5.007
*4739 CN(C)C1=C2C=NNC2=NC=N1   11.509
*4890 NNC(=O)C1=CC=C(C=C1)C(=O)NN   16.599
*4945 C[CH](O)C1=CC=CC=C1    6.539
*4960 CCCC(=O)C1=CC=CO1    4.762
*4965 CC1=CC=C(C=C1)S(C)(=O)=O    5.860
*4966 COC1=CC(=CC=C1O)CO   11.873
*4967 O=C1OC(=O)[CH]2CCCC[CH]12    4.668
*5017 CCOC1=CC=C(N)C=C1    6.824
*5028 CC(=O)C[N+]1=CC=CC=C1   12.996
*5041 CC1=C(O)C(=C(CS)C=N1)CS   11.907
*5045 NOCCOC1=CC=CC=C1    7.896
*5053 CCC1=C(C)C=C(O)N=C1O   12.910
*5080 CN(CC(O)=O)CC1=CC=CO1    9.360
*5094 CCOC1=C(N)C=CC(=C1)S(O)(=O)=O   13.156
*5095 CCOC(=O)C(=NOC(C)=O)C(C)=O    7.914
*5096 COC(=O)CCC(=O)C(=NO)C(=O)OC   12.350
*5119 CCOC(=O)C1=C(N)N=C(SC)N=C1   11.000
*5137 CN(C)C1=C2N=CN(C)C2=NC=N1   10.171
*5142 CCNC1=C2N(C)C=NC2=NC=N1   11.361
*5148 CCCOC1=C2N=CNC2=NC(=N1)N    9.625
*5155 ON(O)NC(=N)NN=CC1=CC=CC=C1   19.073
*5163 NC(=N)NC(=N)NC1=CC=C(C=C1)S(O)(=O)=O   22.389
*5184 CC1=C(C)N=C(C)C(=N1)C    5.364
*5188 CC[N+]1=CC=CC(=C1)C(N)=O   16.086
*5200 O=C1N[CH](C2CCCC2)C(=O)N1    8.545
*5256 CNC1=C2N=CNC2=NC(=N1)N(C)C   11.061
*5262 CCN(CC)C1=C2N=NNC2=NC=N1   11.652
*5270 NC1=CC=C(C=C1)C=NNC(=N)NN(O)O   22.524
*5275 OC1(CCCCC1)C#C    5.971
*5306 CC1(C)C(=O)C(C)(C)C1=O    7.463
*5308 CC(=O)OC(C)=C(C)C(C)=O    5.917
*5310 CCC(=O)C(C)=C1OCCO1    5.983
*5317 C=CC(=O)OC[CH]1CCCO1    6.851
*5363 CCOC(=O)N1CCC=CC1    6.638
*5408 CCCCSC1=CC(=NC(=N1)N)O    8.996
*5410 CCCC[CH](C#N)C(=O)NC(N)=O   12.857
*5427 CC(=C)CCC(C)=C    0.383
*5517 CC(C)CCOC(=O)C=C    3.542
*5539 CCC(=O)CC(=O)C(C)C    7.108
*5559 CC(C)OC(=O)CCC(C)=O    6.559
*5569 CCOC(=O)CC1(C)OCCO1    6.907
*5572 CC(C)C(OC(C)=O)OC(C)=O    6.010
*5576 CCOC(=O)CCCCC(O)=O    8.393
*5615 CCCC[CH](CC)C#N    3.777
*5618 NC(=O)CC1CCCCC1    7.569
*5637 N[CH](C1CCCCC1)C(O)=O    8.567
*5655 C=COCCNCCOC=C    6.750
*5668 CC(C)OC(=O)N1CCOCC1    8.638
*5670 CCOC(=O)CNCC(=O)OCC    7.179
*5679 CCOC(=O)CNC(=O)OC[CH](C)O   12.452
*5701 CC1CCC(C)CC1    0.347
*5704 C=CCNCCNCC=C    8.066
*5726 CCC[CH](CC)C(=O)NC(N)=O    9.352
*5734 CN(C)CCN(CC(O)=O)CC(O)=O   15.277
*5745 OCCNC(=O)OCCOC(=O)NCCO   15.294
*5747 C[N+]([O-])=NCO[CH]1O[CH](CO)[CH](O)[CH](O)[CH]1O   22.103
*5773 CC[CH]1CCC[CH](O)C1    5.064
*5800 CCC[CH]1OCC[CH](C)O1    4.036
*5806 CCCC[CH](CC)C(O)=O    5.523
*5808 CCC(CC)OC(=O)CC    3.141
*5809 OCCOC1CCCCC1    7.119
*5821 CC[CH](C=O)[CH](O)C(C)C    7.866
*5834 CCOCCOCOCC=C    5.863
*5849 CC(C)CC(=O)OC[CH](O)CO    9.015
*5862 CCCCN=CCCC    1.575
*5876 NCCC1CCCCC1    4.614
*5923 CC(C)C(=O)OCCN(C)C    6.693
*5986 CC(C)(C)CC(C)(C)O    4.509
*6009 CCOC(C)(OCC)OCC    5.735
*6036 CC(C)(C)CC(C)(C)N    4.259
*6046 CCCCCN(C)CCO    8.259
*6058 CCCCN(N)CCCC    6.420
*6062 CC(C)OC[CH](O)CNCCN   14.520
*6087 N=C(C(C#N)C#N)C(=N)C(C#N)C#N   17.338
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*7135 CC(=NNC(N)=S)C1=CC=C(O)C=C1   11.327
*7139 CC(=O)NC1=NC(=CC=C1)NC(C)=O   13.833
*7149 NC1=NC2=C(C[CH](CC2)C(O)=O)C(=N1)O   14.572
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*7170 NC(=S)NN=CC1=NC(=CC=C1)C=NNC(N)=S   15.550
*7193 CN(C)C1=CC=C(N=O)C(=C1)C    6.005
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*7245 OC[CH]1O[CH](C[CH]1O)N2C=CC(=O)NC2=O   17.112
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*7268 CCNC1=NC2=C(S1)N(C)C(=O)N(C)C2=O   14.754
*7297 NC1=C2N=C(NC2=NC=N1)N3CCOCC3   17.116
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*7998 CCCCCCC1OCCO1    3.914
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*8248 OC1=CC2=C(C=CC(=O)O2)C=C1O   13.124
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*8645 COC1=CC2=NN=CC(=C2C=C1OC)S   10.022
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*16891 CCCCCCCCCCSC(NC)=NC    6.824
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*19212 COC1=CC2=C3C=C(C)C(=O)OC3=CC=C2C=C1    7.201
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*19311 CC1=CC=C(C=C1)S(=O)(=O)NN=C2C(=O)NC3=C2C=CC=C3   12.117
*19332 O=C(N1CCCC2=C1C=CC=C2)C3=CC=CC=N3   10.674
*19336 CC1=CC=C(NC(=S)NC(=O)C2=CC=CC=C2)C=C1   10.210
*19337 CCOC1=CC=C(NC2=NC3=CC=CC=C3S2)C=C1   11.242
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*19391 CC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)C    5.625
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*19416 OC(=O)C1=C2C=CC=CC2=C3CCCCC3=C1    8.000
*19462 COC1=C(OCC2=CC=CC=C2)C=C(C=O)C=C1    8.421
*19477 CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C(C)C=C2)C(O)=O   11.214
*19492 CC1(C)C2=C(NC3=C1C=CC=C3)C=CC=C2    6.126
*19507 CC1=CC=C(NC(=O)C2=C(C)C=CC=C2)C=C1    8.827
*19522 COC1=CC=C(C=C1NC(C)=O)C2=CC=CC=C2   10.553
*19524 CC1=C(C=CC=C1)N2C(=O)[CH]3CC=CC[CH]3C2=O    6.762
*19558 CC1=CC(=C(C(=C1)C)S(=O)(=O)OC2=C(C=CC=C2)[N+]([O-])=O)C    8.801
*19602 CC1=C(NC(=O)NC2=C(C)C=CC=C2)C=CC=C1    9.870
*19632 CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=C3CCCC3=N2)N   12.967
*19653 CC(C)C1=CC=C(C=C1)C=NNC2=CC=C(C=N2)[N+]([O-])=O   11.384
*19662 OC[CH]1O[CH]([CH](O)[CH]1O)N2C=NC3=C(SCC4=CC=CS4)N=CN=C23   19.804
*19688 OCC(CO)(C1=CC=CC=C1)C2=CC=CC=C2    8.947
*19689 CCCCC(=O)C1=CC=C2C=CC=CC2=C1O    6.532
*19709 O=S(=O)(CC1=CC=CC=C1)CS(=O)(=O)CC2=CC=CC=C2   11.462
*19716 OC[CH]1O[CH](OC2=C(O)C=C3OC(=O)C=CC3=C2)[CH](O)[CH](O)[CH]1O   21.812
*19723 NC(CC1=CC=CC=C1)CC2=CC=CC=C2    7.060
*19776 COC1=CC=C(C=C[N+]2=CC=CC=C2)C=C1OC   13.854
*19780 CC1=CC=C(C=C1)S(=O)(=O)NCCC2=CC=CC=C2    6.959
*19802 CC1=NC(=[N+](C)C(=C1)C)C=CC2=CC=CC(=C2)[N+]([O-])=O   14.163
*19850 CCOCC1(CCOC2=CC=CC=C2)C(=O)NC(=O)NC1=O   16.738
*19859 CO[C]12[CH](COC(N)=O)C3=C(N1C[CH]4N[CH]24)C(=O)C(=C(N)C3=O)C   23.943
*19863 CC(C)(C)[C](O)(C=CC1=CC=CC=C1)C#C    6.971
*19878 COC1=CC(=CC=C1)CCC2C(=O)CCCC2=O    9.785
*19902 O=C(CCN1CCCC1)C=CC2=CC=CC=C2    9.223
*19940 CN1CCN(CC1)CCN2C(=O)C3=C(C=CC=C3)C2=O   14.368
*19941 CCC1(CC)C(=O)NC(=O)N(CCC2=NC=CC=C2)C1=O   15.955
*19959 C[CH](CN(C)C)C(=O)C1=CN(C)C2=C1C=CC=C2   10.521
*19977 CCOC(=O)C1=CC=CC(=C1)NC(=O)CN2CCOCC2   14.446
*20036 CCCCCCCC(=O)OC1=CC2=C(OCO2)C=C1    6.385
*20047 C[CH](CN1CCCCC1)C(=O)C2=CC=CC=C2    8.054
*20062 O=C(OCCCN1CCCCC1)C2=CC=CC=C2    7.504
*20064 CC[CH]1CC2=C(C=C(OCCN(C)C)C=C2)C1=O    9.484
*20096 COC1=CC(=C2N=CC=CC2=C1)N[CH](C)CCCN   13.996
*20139 CCOC(=O)C1=C(NC(=O)CN(CC)CC)C=CC=C1   12.036
*20197 CCCCCCCC(=O)OCC1=CC=CC=C1    4.111
*20212 CCC1(C)COC(CC)(OC1)C2=CC=CC=C2    5.007
*20228 CCCC[C](O)(CC(=O)OCC)C1=CC=CC=C1    8.548
*20230 CO[CH](C)CCOC(=O)C1=CC=C(C=C1)C(C)C    5.733
*20263 CCOC(=O)C=C(C(C(=O)OCC)C(=O)OCC)C(=O)OCC   11.418
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*20297 C[CH]1C[CH](C)C(=O)[CH](C1)[CH](O)CC2CC(=O)NC(=O)C2   14.453
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*20427 CC[N+](C)(CC)C1=CC(=C(C)C=C1)OC(=O)N(C)C   17.772
*20435 CC(=O)[C]1(C)CC[CH]2CCCC(C)(C)[CH]2C1    3.539
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*20519 CCCCOC(=O)CCCCCC(=O)OCCCC    5.149
*20549 C(CCN1CCCCC1)CCN2CCCCC2    7.223
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*20573 CCCCCCCCCC[CH]1O[CH](C)[CH](C)O1    3.175
*20590 CCCCCCCCCCCCOC(=O)[CH](C)O    3.086
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*20612 CCCCCCCCCCSC(NCC)=NCC    6.578
*20621 CCCCCCCCCCCCC[CH](C)N    3.398
*20624 CC[N+]1(CC)CC[N+]2(CCC[CH](C)CC2)CC1   17.752
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*20786 NC1=CC=C(C=C1)C2=NC3=C(S2)N=C(S3)C4=CC=C(N)C=C4   18.708
*20791 CC(=O)C1=C2C=CC=CC2=C3C=CC=CC3=C1    7.029
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*20848 C=CC(=O)NC1C2=C(OC3=C1C=CC=C3)C=CC=C2   11.077
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*21371 CC(=C(C)C1=CC=C(N)C=C1)C2=CC=C(N)C=C2   10.420
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*21501 CC[CH](N)C(O)(C1=CC=CC=C1)C2=CC=CC=C2   11.375
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*21552 CCN(CC)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)S(O)(=O)=O   12.717
*21556 [O-][N+](=O)C1=CC2=C(C=C1)C(=NO2)C(=O)OCCCN3CCCCC3   12.896
*21629 CC1=CC2=C(CCCC2(C)C)C3=C1C(=O)CC3    5.056
*21661 COC1=C(C[CH](C)N(C)CC2=CC=CS2)C=CC=C1    7.870
*21666 CC(=O)OC[CH](OC(C)=O)[CH](OC(C)=O)[CH](OC(C)=O)[CH](OC(C)=O)C#N   13.319
*21668 CCCC[CH](CC)CN1C(=O)C2=C(C=CC=C2)C1=O    6.788
*21693 C[CH]1CCCCN1CCCOC2=C(C=CC(=C2)[N+]([O-])=O)C#N   10.839
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*21784 CC(C)C(=O)OC1(CCCCC1)CC2=CC=CC=N2    7.103
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*21816 CC[CH](C)NCCNC1=C2N=CC=CC2=CC(=C1)OC   13.654
*21867 CC(C)(C)C1=CC(=C(O)C=C1)C2CCCCC2    5.538
*21882 COC1=CC2=C(C=C1OC)C(C)(C)CCC2(C)C    4.256
*21889 CCCCCCCC(=O)OCCC1=CC=CC=C1    3.987
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*21939 CCCN(CCC)C(=O)C1=CC=C(C=C1)C(C)C    7.190
*21944 CC(C)CN(CC(C)C)C(=O)C1=CC(=CC=C1)C    7.190
*21954 CCCCCN1CCC2=C(C1)C=C(OC)C(=C2)OC    7.807
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*22005 CCC1=CC(=C(O)C(=C1)C(C)(C)C)C(C)(C)C    5.261
*22013 C[CH](CCC1=C(C)CC[C]1(C)C(C)=C)OC(C)=O    2.480
*22039 CCCCCCCCCCCSC1=CC=CC=N1    3.866
*22049 CCN(CC)CC1=C(O)C=C(CN(CC)CC)C(=C1)O   16.265
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*22145 C[CH](CN1CCCCC1)SS[CH](C)CN2CCCCC2    9.006
*22149 CCCCCCCC[C](CC)(CCCC)C(O)=O    4.539
*22212 CCCCCC[CH](C)N[CH](C)CCCCCC    3.057
*22220 C[N+]1(CCCC1)CCC[CH](O)CC[N+]2(C)CCCC2   22.067
*22228 N#CC1=C2C=CC=CC2=C(C#N)C3=C1C=CC=C3    8.320
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*22269 OC(=O)C=CC(=O)NC1=CC=C2C(=C1)CC3=C2C=CC(=C3)[N+]([O-])=O   17.728
*22299 C1=CC=C(C=C1)C=CC2=C3C=CC=CC3=NC=C2    7.801
*22306 OC1=CC=C(C=C1)C=CC2=CC=C3C=CC=CC3=N2   11.783
*22311 NC1=C2C=CC=CC2=C(OC(=O)C3=CC=CC=C3)C=C1    9.354
*22329 OC(=O)[CH](CC1=CC=CC=C1)N2C(=O)C3=CC=CC=C3C2=O   12.447
*22397 CC1=C(C=CC(=C1)O)N=NC2=CC3=C(C=C(C=C3C=C2)S(O)(=O)=O)S(O)(=O)=O   22.444
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*28005 CN1[CH](CCC[CH]1CCC2=CC=C(O)C=C2)CCC3=CC=C(O)C=C3   14.083
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*28107 CCCCCCC[N+]1=CC=C(CCS(=O)(=O)C2=CC=C(NC(C)=O)C=C2)C=C1   19.631
*28152 CCN(CC)C1=CC(=C(CCC2=C(N)C=C(C=C2)N(CC)CC)C=C1)N   13.204
*28166 CCCCCCCCCCOC(=O)C1=C(C=CC=C1)C(=O)OCCCC    5.174
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*28175 CCOC(=O)[CH]1CC[CH](OC(C)=O)[CH](C1)O[CH]2C[CH](CC[CH]2OC(C)=O)C(=O)OCC   12.793
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*28223 CCCCCN(CCCCC)C[CH](O)CN1CCCC2=C1C=CC=C2   10.767
*28253 CCCC[CH](CC)C(=O)OCCCNC(=O)[CH](C)OC(=O)[CH](CC)CCCC   10.161
*28385 CN(C)C1=CC=C(C=C1)C2=NC(=C(N2)C3=CC=CC=C3)C4=CC=CC=C4   10.453
*28399 CC1=CC=C(SC=C(SC2=CC=C(C)C=C2)SC3=CC=C(C)C=C3)C=C1    7.520
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*28427 CC(C)(O)CC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3    8.357
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*28454 C(CC[N+]1=CC2=C(C=CC=C2)C=C1)CC[N+]3=CC4=CC=CC=C4C=C3   14.041
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*28500 CC1=CC2=C(OC3(CC2(C)C)CC(C)(C)C4=C(O3)C=CC(=C4)C)C=C1    5.662
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*28504 CC(=O)OCC(=O)[C]1(O)CC[CH]2[CH]3C=CC4=CC(=O)CC[C]4(C)[C]35O[CH]5C[C]12C   12.824
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*28536 CC1=CC(=CC(=C1O)CC2=C(O)C(=CC(=C2)C(C)(C)C)C=O)C(C)(C)C    9.921
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*28557 CCCOC(C(=O)OCCN(CC)CC)(C1=CC=CC=C1)C2=CC=CC=C2    9.712
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*28612 C[CH]1CC(C)(C)CN1CCOC(=O)[CH]([CH]2CCCC=C2)C3=CC=CC=C3    7.444
*28648 CC(=O)O[C]1(CC[CH]2[CH]3C[CH]4O[C]45C[CH](O)CC[C]5(C)[CH]3CC[C]12C)C(C)=O   12.633
*28662 C[CH](OC(=O)NC1=CC=C(C)C(=C1)NC(=O)O[CH](C)N2CCCCC2)N3CCCCC3   13.547
*28681 CCCCOC1=C(C=CC=C1NC(=O)CN2CCOCC2)C(=O)OCCN(CC)CC   18.364
*28686 CCC[CH](C)C1=CC=C(OCCCCCN2CCN(CC2)C(=O)OCC)C=C1   11.470
*28689 CCCCCCCCCCCCC1=CC=C(OC(=O)OCCCC)C=C1    1.873
*28693 CCCCCCCCCCCC[CH](CN(C)C)C(=O)C1=CC=CC=C1    6.712
*28698 CCCCCCCCCCCCCCCCNC(=O)NC1=CC=CC=C1    7.509
*28716 CCCCCCCCC=CCCCCCCCC(=O)OCCCCC    1.351
*28723 CCCCCCCCCCCCCCCC1=NC(C)(C)CN1C(C)C    3.636
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*28802 COC1=C(C=CC=C1)C(=O)OC2=C(C(C)=O)C(=CC=C2)OC(=O)C3=C(OC)C=CC=C3   12.710
*28810 NC1=C(CC(C2=CNC3=C2C=CC=C3)C4=CNC5=C4C=CC=C5)C=CC=C1   15.309
*28812 C(OC1=NC(=NC(=N1)OCC2=CC=CC=C2)OCC3=CC=CC=C3)C4=CC=CC=C4   10.001
*28818 CN(C)C1=CC=C(C=C1)C=C2C3=CC=CC=C3C4=C2C=C(NC(C)=O)C=C4   13.453
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*28848 CN(C)C[CH](OC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3   10.217
*28893 CCCCCC1=CC=[N+](CC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C=C1   14.278
*28924 C[CH]1C[CH](C)C(=O)[CH](C1)[CH](CC2CC(=O)NC(=O)C2)OC(=O)CC(=O)C3=CC=CC=C3   16.516
*28930 CC(=O)CC(=NCCNCCN=C(CC(C)=O)C1=CC=CC=C1)C2=CC=CC=C2   15.180
*28931 C[CH](CN1CCCCCCC1)C(C#N)(C2=CC=CC=C2)C3=CC=CC=C3    9.377
*28945 C[CH](CN(C)C)OC1=C2C(=O)C3=CC=CC=C3C(=O)C2=C(O[CH](C)CN(C)C)C=C1   17.071
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*29039 C[CH]1C[CH]2[CH](CC[C]3(C)[CH]2CC[C]3(OC(C)=O)C(C)=O)[C]4(C)CCC(=O)C=C14    8.839
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*29072 CCCCCC=CCC=CCCCCCCCC(=O)NC1=CC=CC=C1    6.353
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*29087 CCCCCC[CH](C)OC(=O)C1=C(C=CC=C1)C(=O)O[CH](C)CCCCCC    4.928
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*29143 CCCCOC(=O)C[CH](S[CH](CC(=O)OCCCC)C(=O)OCCCC)C(=O)OCCCC   11.876
*29148 CCCCCCCCCCCCCCCCCC[N+]1=CC=CC(=C1)C(N)=O   14.117
*29185 CCCCCCCCCCCCCCCCCCCCCCCC   -0.447
*29187 CCCCCCCCCCCCOCCCCCCCCCCCC    0.358
*29208 O=C(C1=CC=C(C=C1)C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=CC=C4    7.939
*29213 O=C(C[N+]1=CC2=CC=CC=C2C=C1)C3=CC4=C5C=CC=CC5=CC=C4C=C3   16.730
*29226 O=C(C[CH](C1=CC=CC=C1)C2=C3C=CC=CC3=CC=C2)C4=CC=CC=C4    8.081
*29287 COC1=CC=C(C=C1)N(CCN(C)C)C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3   13.493
*29306 CC1=CC2=C(C=CC=C2)C=[N+]1CCCCC[N+]3=CC4=CC=CC=C4C=C3C   13.955
*29329 CCN(CC)CCN[CH](CC1=CC=CC=C1)C2=C(OC)C=CC3=C2C=CC=C3   12.016
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*29414 CCOC(=O)N1CCN(CCCCCCOC2=CC=C(C=C2)C3CCCCC3)CC1   11.580
*29437 CCN(CC)CC(=O)NC1=CC(=C(C)C(=C1)NC(=O)CN(CC)CC)NC(=O)CN(CC)CC   22.124
*29439 CCCCCCCCCCCCCCCCCCOS(=O)(=O)C1=CC=C(C)C=C1    3.959
*29443 CCCCCC=CCC=CCCCCCCCC1=NC(C)(C)CN1C(C)C    3.502
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*30183 CCCCCCCCCCCCCCCCCC(=O)NC1=CC2=C(N)C=C(C)N=C2C=C1   13.544
*30208 CCCCCCCCCCCCCCCCNC(=S)NN=CC1=CC=C(C=C1)N(CC)CC    6.833
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*30249 COC1=CC=C(C=C1)C2(C3=CC=C(OC)C=C3)C4=C(C=CC=C4)C(=O)C5=C2C=C(OC)C=C5   11.975
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*30292 CCCCCCN(CCCCCC)C[CH](O)C1=C2C=CC=CC2=NC(=C1)C3=CC=CC=C3   13.622
*30297 C[C]12C[CH](O)[CH]3[CH](CCC4=CC(=O)C=C[C]34C)[CH]1CC[C]2(O)C(=O)COC(=O)CCC5CCCC5   11.151
*30299 O=C(CCCCCCCCCCCC[CH]1CCC=C1)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=N3   13.900
*30376 CC1(C)O[CH]2O[CH]([CH](COC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)[CH](OC(=O)C5=CC=CC=C5)[CH]2O1   17.203
*30387 CC(=O)OC1=CC(=C(OC(C)=O)C=C1CN(CC2=CC=CC=C2)C(C)=O)CN(CC3=CC=CC=C3)C(C)=O   17.279
*30421 CCN(CC)CCOC(=O)C1=CC=C(NC(=O)OCCOC(=O)NC2=CC=C(C=C2)C(=O)OCCN(CC)CC)C=C1   21.119
*30426 CC(C)CCN(CCC(C)C)C[CH](O)C1=CC(=C2C=CC3=C(C=CC(=C3)C(C)C)C2=C1)C   10.550
*30431 C[CH](CC[CH](O)C1=CC=CC=C1)[CH]2CC[CH]3[CH]4CC=C5C[CH](O)CC[C]5(C)[CH]4CC[C]23C    6.676
*30445 CCCCCCCCCC[CH](C[N+](C)(C)CC=CC1=CC=CC=C1)[CH](O)C2=CC=CC=C2   17.863
*30461 COC1=CC2=C(C=C1)N(CCCCCCCCCCN(CCC(C)C)CCC(C)C)CCC2    6.697
*30465 CCCC[CH](CC)COC(=O)CC(=CC(=O)OC[CH](CC)CCCC)C(=O)OC[CH](CC)CCCC    6.703
*30468 CCCC[CH](CC)COC(=O)C[C](O)(CC(=O)OC[CH](CC)CCCC)C(=O)OC[CH](CC)CCCC    6.979
*30473 CCCCCCCCCCCC(=O)OCCOCCOCCOCCOCCOCCOCCOCCOCCO   21.308
*30480 OC1=CC(=CC2=C1C=CC(=C2)NC(=O)NC3=CC4=CC(=C(N=NC5=CC6=C(C=C5)C=C(C=C6)S(O)(=O)=O)C(=C4C=C3)O)S(O)(=O)=O)S(O)(=O)=O   42.507
*30492 CC(=O)OC1=CC=C(C=C1OC(C)=O)C2=COC3=C4C=CC(C)(C)OC4=C(CC=C(C)C)C(=C3C2=O)OC(C)=O   14.206
*30513 CCCCCN(CCCCC)[CH](C)[CH](O)C1=CC(=C2C=CC3=C(C=CC(=C3)C(C)C)C2=C1)C   10.426
*30516 CCCCCCCCCC1CCN(CC1)C(C2=CC=C(NC(C)=O)C=C2)C3=CC=C(NC(C)=O)C=C3   14.184
*30519 C[CH](CC[CH]1O[CH]2C[CH]3[CH]4CC[CH]5CC(=O)CC[C]5(C)[CH]4CC6(SCCS6)[C]3(C)[CH]2[CH]1C)C7SCCS7   14.684
*30528 CCCCCCCCCCCCCCCC(=O)CCCCCCCCCCCCCCC    0.860
*30539 OS(=O)(=O)C1=CC=CC(=C1)N=NC2=C3C=CC=CC3=C(C=C2)N=NC4=C5C=CC=C(C5=C(NC6=CC=CC=C6)C=C4)S(O)(=O)=O   25.788
*30540 NC1=C2C=CC=CC2=C(C=C1N=NC3=CC=C(C=C3)C4=CC=C(C=C4)N=NC5=C(O)C6=C(C=CC=C6)C(=C5)S(O)(=O)=O)S(O)(=O)=O   30.627
*30595 CC(C)(C)CC1=CC(C=C(CC(C)(C)C)C1=O)=C2C=C(CC(C)(C)C)C(=O)C(=C2)CC(C)(C)C    6.161
*30642 O=C(CCCCCCCC(=O)NC1=CC(=CC(=C1)C2=NCCN2)C3=NCCN3)NC4=CC(=CC(=C4)C5=NCCN5)C6=NCCN6   31.910
*30709 CC(=O)C1=C(C)C2=CC3=NC(=CC4=C(CCC(O)=O)C(=C(N4)C=C5N=C(C=C1N2)C(=C5C(C)=O)C)C)C(=C3C)CCC(O)=O   27.048
*30754 OC(=O)C1=C(O)C=CC(=C1)N=NC2=CC=C(C=C2)C3=CC=C(C=C3)N=NC4=C(C=C5C=CC(=CC5=C4O)NC6=CC=CC=C6)S(O)(=O)=O   29.124
*30767 COC1=CC(=CC(=C1OC)OC)[CH]2[CH]3[CH](COC3=O)[CH](O[CH]4O[CH]5CO[CH](O[CH]5[CH](O)[CH]4O)C6=CC=CC=C6)C7=C2C=C8OCOC8=C7   28.218
*30849 CC1=CC(=C(O)C(=C1)C(C)(C)CC(C)(C)C)C(C2=CC=CC=C2)C3=C(O)C(=CC(=C3)C)C(C)(C)CC(C)(C)C   10.483
*30864 OC1=CC(=CC=C1)C2(C3=CC=CC=C3)C4=C(C=CC=C4)C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=C2C=CC=C7   12.067
*30876 O=C1NC2=CC=C(CC3=CC=C(NC(=O)N4CCN(CC4)C(=O)NC5=CC=C(CC6=CC=C(NC(=O)N7CCN1CC7)C=C6)C=C5)C=C3)C=C2   43.027
*30877 CCOC(=O)CCC1=C2NC(=C1C)C=C3N=C(C=C4NC(=CC5=NC(=C2)C(=C5C)CCC(=O)OCC)C(=C4C=C)C)C(=C3C=C)C   14.842
*30878 CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(C=C2)=[N+](CC)CC)C3=C4C=CC=CC4=C(NC5=CC=C(C)C=C5)C=C3   19.101
*30881 CCOC(=O)CCC1=C2NC(=C1C)C=C3N=C(C=C4NC(=CC5=NC(=C2)C(=C5C)CCC(=O)OCC)C(=C4CC)C)C(=C3CC)C   14.408
*30899 COC1=CC2=C(C=C1OC)[CH](NCC2)[CH](CCCCC[CH](CCC(C)C)[CH]3NCCC4=C3C=C(OC)C(=C4)OC)CCC(C)C   13.936
*30916 CCSC(SCC)[CH](SCC)[CH](OC(=O)C1=CC=CC=C1)[CH](OC(=O)C2=CC=CC=C2)[CH](COC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4   19.371
*30920 CCC(=O)OC[CH]1O[CH](O[CH]2[CH]3COC(=O)[CH]3[CH](C4=CC(=C(OC)C(=C4)OC)OC)C5=C2C=C6OCOC6=C5)[CH](OC(=O)CC)[CH](OC(=O)CC)[CH]1OC(=O)CC   26.910
*30926 CC(C)C1=C2C=C(C)C(=C(O)C2=C(C=NCCCN(C)C)C(=C1O)O)C3=C(O)C4=C(C=C3C)C(=C(O)C(=C4C=NCCCN(C)C)O)C(C)C   37.031
*30930 O=C(CN(C1CCCCC1)C2CCCCC2)NC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(NC(=O)CN(C5CCCCC5)C6CCCCC6)C=C4   18.256
*30943 COC1=CC=C(CC2=C3C=C(OC)C(=C(CC4=C(OC)C(=CC5=C(CC6=CC=C(OC)C(=C6)OC)N=CC=C45)OC)C3=CC=N2)OC)C=C1OC   23.030
*31015 CC(C)C1=C2C=C(C)C(=C(O)C2=C(C=N[CH](C)C3=CC=CC=C3)C(=C1O)O)C4=C(O)C5=C(C=N[CH](C)C6=CC=CC=C6)C(=C(O)C(=C5C=C4C)C(C)C)O   32.854
*31021 C[CH]1O[CH](C[CH](O)[CH]1O[CH]2C[CH](O)[CH](O[CH]3C[CH](O)[CH](O[CH]4O[CH](CO)[CH](O)[CH](O)[CH]4O)[CH](C)O3)[CH](C)O2)O[CH]5CC[C]6(C)[CH](CC[CH]7[CH]6C[CH](O)[C]8(C)[CH](CC[C]78O)C9=CC(=O)OC9)C5   34.370
