1823
*6 N1C=NN=N1    6.214
*15 ONC=N    9.342
*30 NC(S(O)(=O)=O)S(O)(=O)=O   15.983
*34 NNC(N)=S    9.180
*40 NNC(NN)=NN   17.770
*51 N=C1NN=CO1    8.627
*56 N=C1NNC(=S)S1    8.656
*57 C=NN=C    2.228
*72 O=C1NNC(=O)NN1   17.521
*83 OS(=O)(=O)C=C    7.452
*87 CC=NO    5.231
*115 NC(=N)CO   10.959
*154 CCN    4.996
*221 OS(=O)(=O)NC1=NC=CS1   11.777
*226 NC1=NC(=NC(=N1)S)S    4.668
*246 S=C1NCCO1    5.959
*268 NC(=O)C1=C(N)NN=N1   15.662
*275 N=C1NCCO1    8.588
*283 NC(=N)SCC(O)=O   13.745
*289 CCC([N+]([O-])=O)[N+]([O-])=O    7.373
*291 CC(CO)([N+]([O-])=O)[N+]([O-])=O   11.810
*302 NC(=N)N(CS(O)(=O)=O)C#N   13.403
*337 C1SCSCS1    7.527
*343 CCC(N)=O    7.830
*383 CCC(=O)NN   10.208
*396 ON(O)NC1=NCCN1   18.079
*428 C[CH](O)CN    9.312
*439 C1CNCCN1    8.658
*441 CCN(CC)N=O    5.440
*453 CCN(CC)[N+]([O-])=O    5.249
*460 ONC(=N)CCC(=N)NO   17.181
*513 CSSC(SSC)SSC    6.483
*535 CN(C)CCS(O)(=O)=O   11.081
*563 N#CC=CC#N    6.513
*570 OC1=NC(=C2N=NOC2=N1)O   16.879
*594 O=C1CC=NC(=S)N1    6.842
*617 SC1=CC=NC=N1    4.959
*620 SC1=CC(=NC=N1)S    4.382
*653 COC(=O)CC#N    7.138
*659 O=C1CCC(=O)N1    7.597
*666 ON=C1CCOC1=O    6.910
*669 CC1=CSC(=S)N1    3.790
*670 NC1=NC=CC=N1    5.437
*681 CC1=C(O)N=C(S)N=N1    9.289
*687 NC(=O)NC(=O)CC#N   13.349
*715 CC1=NNC(=O)C1    7.757
*733 CC(C)(O[N+]([O-])=O)C#N    6.839
*743 NC1=CN=C(N)N=C1    8.889
*746 NC(=O)C1=C(N)NN=C1   15.271
*759 NNC1=NC(=NC=C1)S   10.790
*764 NNC1=C(C(=NC=N1)N)[N+]([O-])=O   14.541
*790 C=CS(=O)(=O)C=C    4.309
*798 O=S1(=O)C[CH]2O[CH]2C1    8.225
*832 O=C1CCNC1    7.007
*837 CS[CH]1OCC=N1    2.604
*840 C[CH]1OCNC1=O    7.747
*843 C[CH]1CNC(=O)O1    7.293
*854 OC(=O)CNCC(O)=O   12.437
*860 CC(=NNC(N)=O)C(O)=O   12.717
*862 CCNC1=NN=CS1    8.793
*865 CC1=NC(=NC(=N1)N)N    9.228
*898 CCOC(=O)N(C)N=O    7.845
*936 CSCCC=O    6.017
*957 O=S1CCOCC1    9.469
*995 CCCC[N+]([O-])=O    4.007
*1001 CCOC(=O)NC    6.939
*1013 CSC[CH](N)C(O)=O   10.799
*1047 CN1CNC(=O)NC1    7.538
*1048 OC1CNC(=N)NC1   14.618
*1079 CCOC(=O)CNC(N)=O   10.297
*1086 CCC(OC(N)=O)OC(N)=O   10.226
*1124 CCCCOC=O    3.250
*1159 OC[CH](O)[CH](O)[CH](O)C=O    8.917
*1231 OCCNCCC(O)=O   14.099
*1234 CCC(CO)(CO)[N+]([O-])=O    9.757
*1238 COC(=O)NCCOS(C)(=O)=O   11.200
*1255 COC(=O)NCCSC(N)=N   14.420
*1291 CN(N=O)S(=O)(=O)CCCS(=O)(=O)N(C)N=O   11.103
*1308 CC(C)(CO)CO    6.514
*1328 COS(=O)(=O)CCCS(=O)(=O)OC    9.410
*1329 O[CH](CCC[CH](O)S(O)(=O)=O)S(O)(=O)=O   20.049
*1343 CC[CH](N)[CH](C)O    9.066
*1372 CC(=O)N[N+](C)(C)C   17.790
*1374 CC(C)CNC(=N)NN(O)O   17.697
*1376 N#CC1=CC=CO1    4.285
*1391 OC(=O)C1=CN=CC=N1   10.231
*1392 [O-][N+](=O)C1=CC=NC=C1    7.556
*1434 OC1=C2NC(=O)NC2=NC=N1   16.547
*1435 CN1C=NC(=C1C#N)[N+]([O-])=O    8.516
*1438 OC1=NC(=C2NC(=O)NC2=N1)S   15.971
*1449 SC1=NC(=C2N=CNC2=N1)S    8.550
*1472 [O-][N+]1=CC=CC=C1S    9.575
*1491 OS(=O)(=O)C1=CC=[N+]([O-])C=C1   16.483
*1498 ONC(=O)C1=CN=CC=N1   14.620
*1503 NC1=NC(=NC(=C1)C(O)=O)O   17.666
*1519 NC1=NC(=C2C=NNC2=N1)O   13.593
*1534 CC1=NC(=N)C2=NSNC2=N1    8.072
*1537 CC(=C)C#C    1.519
*1546 CC1=CC=C(O)N=N1    9.483
*1549 NC(=O)N1C=CC=C1    9.035
*1572 NS(=O)(=O)C1=CC=CN=C1    9.257
*1608 NNC(=O)C1=CC(=NC(=N1)O)O   22.265
*1676 CC1=NC(=CS1)C    5.331
*1711 NC(=O)NNC1(O)C(=O)NC(=O)NC1=O   24.684
*1730 C[CH]1CC(=O)NC(=S)N1    9.182
*1743 CC(CC=C)([N+]([O-])=O)[N+]([O-])=O    7.254
*1749 C[CH]1CNC(=S)SSC(=S)N1    5.488
*1766 CC(C)(O)C#C    5.983
*1784 COC(=O)C(C)=C    3.839
*1861 O[CH]1CN[CH](C1)C(O)=O   13.154
*1906 C[CH](CC#N)N1CC1    7.928
*1932 CCNC1=C(N)C=NC=N1   11.975
*1957 O=CC1CCCC1    4.032
*1993 OC(=O)C1CCOCC1    9.079
*1999 CC1(C)COC(=O)[CH]1O    4.550
*2017 CCC(C)(C(O)=O)C(O)=O   11.021
*2022 C[CH](CCC(O)=O)C(O)=O   11.021
*2032 C[CH]([CH](C)C(O)=O)C(O)=O   11.021
*2063 CC(C)(C)CC#N    4.023
*2085 C[CH](O)C(=O)NCC=C    8.175
*2116 CC(C)(S)[CH](NC=O)C(O)=O   12.383
*2134 N[CH](CCCC(O)=O)C(O)=O   13.708
*2138 CC(C)(CCO[N+]([O-])=O)C(O)=O    8.339
*2143 CC(=C)CNC(C)=S    4.536
*2156 C1CCN(CC1)C2=NN=NN2    8.000
*2160 CN1C(=O)N[CH](NC(N)=O)[CH](N)C1=O   20.991
*2161 CC(C)CC=C    0.445
*2169 CCCNCCC#N    7.793
*2186 OCCNC(=S)C(=S)NCCO   14.317
*2233 C[CH]1CC[CH](C)O1    3.827
*2242 C[CH]1CSC[CH](C)O1    5.023
*2275 CCC(C)(C)C(O)=O    5.770
*2301 CO[CH](C)CCOC=O    5.182
*2357 CC(=NO)C(C)(C)C    4.738
*2376 CN(C)CCOC(C)=O    6.939
*2404 CC(C)C[CH](N)C(O)=O    8.457
*2429 C[CH](O)[CH](O)[CH](O)[CH](O)C=NO   13.487
*2450 CCOC(=O)NCCSC(N)=N   14.298
*2460 CC(=O)OCCCN(N=O)C(=N)NN(O)O   21.350
*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
*2496 CCCCCSC(N)=N    8.123
*2502 NNC(=O)CCCCC(=O)NN   15.959
*2513 CCOC(C)(C)C    2.572
*2542 CC(C)OC[CH](O)CO    8.446
*2543 OCC[S+](CCO)CCO    9.762
*2662 OC1=CC(=O)C(=CC1=O)O    5.728
*2667 OC1=C(O)C(=O)C(=C(O)C1=O)O   -0.456
*2668 O=CC1=CC=CC=N1    7.754
*2762 CC1=CC(=CC=[N+]1[O-])[N+]([O-])=O   12.513
*2789 CC1=NC2=CN=CN=C2N1    9.660
*2799 COC1=C2N=CNC2=NC=N1    9.971
*2817 CN1C=NC2=C(O)N=NC(=C12)O   16.346
*2899 CC1=CC=CN=C1    5.109
*2935 C=CCOC(=O)OCC#N    2.652
*2942 OC(=O)CCC(=O)CSC#N   12.536
*3001 CN1C=NC(=C1SCC(O)=O)[N+]([O-])=O   13.164
*3002 NC(=N)SC1=CC=CC=N1   10.607
*3007 CC1=NNC2=C1N=CN=C2N   13.119
*3010 CN1C=NC2=NC=NC(=C12)N   11.824
*3058 CC1=CC(=NC(=N1)O)C    9.432
*3073 COC1=NC(=O)N(C)C=C1    7.921
*3087 NC1=C(C=CC=C1)S(N)(=O)=O    9.827
*3089 CC1=C(CO)C(=NC(=N1)O)O   17.851
*3101 NC1=CC(=C(C=C1)S(O)(=O)=O)N   15.503
*3117 CC(C)=C1NC(=S)NC1=S    5.963
*3157 CCOC(=S)SCC#C    5.767
*3205 CCN1C=CC=C1    3.590
*3206 C=CCOCCC#N    6.206
*3224 CC(=O)N1CCCC1=O    7.132
*3264 NNS(=O)(=O)C1=CC=C(N)C=C1   12.206
*3270 NC(=O)NN=C(CCC(O)=O)C(O)=O   17.721
*3271 CC1=NN=C(NCC=C)S1    8.757
*3312 CC(=O)C1=C(C)NN=C1C    8.087
*3449 OC[CH](O)[CH](O)[CH]1OC(=O)C(=C1O)O    8.703
*3454 CCN(C)C1=CC=CO1    3.947
*3476 CC(C)(C)OC(=O)CSC#N    6.613
*3486 CCOC(=O)N1CCCC1=O    6.460
*3495 OC[CH]1O[CH]2NC(=S)O[CH]2[CH](O)[CH]1O   14.788
*3496 N[CH](COC(=O)CCC(O)=O)C(O)=O   16.455
*3502 CC1=CC(C)(C)SC(=S)N1    3.873
*3523 CN(C)C=NS(=O)(=O)C1=C(N=CN1C)[N+]([O-])=O   11.104
*3526 C[CH]1CCC=CC1    1.056
*3535 C1CN(CCO1)C2=NCCS2   10.111
*3545 NC(=O)NC1(CCCC1)C(O)=O   12.788
*3564 CCCNC1=CC(=NC(=N1)N)S    7.724
*3565 CCSC1=CC(=NC(=N1)N)NC    8.370
*3577 CC(=C)CCC(C)=O    3.870
*3585 CCCCOC(=O)C=C    3.666
*3594 CC(C)COC(=O)C=C    3.666
*3616 COCCOC(=O)C(C)=C    5.648
*3618 CCCOC(=O)CC(C)=O    6.682
*3643 OC[C]12OC[CH](O1)[CH](O)[CH](O)[CH]2O   14.163
*3654 CC[CH]1CCC(C1)=NO    4.971
*3695 CCOC(=O)CCC(C)=NO    7.485
*3718 C[CH]1CC(C)(C)SC(=S)N1    4.138
*3744 NC(=O)NC1CCCCC1    8.836
*3749 CCN(CN(CC)C=O)C=O    7.185
*3758 OCCN1CSC(=S)N(CCO)C1    8.174
*3768 N[CH](CCC[CH](N)C(O)=O)C(O)=O   16.273
*3782 CC1(O)CCCCC1    5.187
*3793 CC[C](C)(O)C1CC1    5.187
*3794 CC(C)(C)SCCC=O    5.648
*3795 CCS[CH]1CCC[CH]1O    7.282
*3813 CCC(CC)OC(C)=O    3.264
*3869 NC1CCCCCC1    4.738
*3894 CC(C)NC(=O)C(C)C    7.117
*3911 CCN(CC)C[CH](O)C=O    7.910
*3925 CC(C)CN(C)CC(O)=O    7.896
*3975 CN(C)COC(=S)SCN(C)C    7.870
*3985 C[N+]12CN3CN(CN(C3)C1)C2    8.928
*4002 CC[CH](O)CC(C)C    4.631
*4021 CCOC[CH](O)COCCO   10.378
*4059 C[CH](O)CN(C)C[CH](C)O    9.818
*4085 [O-][N+](=O)C1=CC2=C(NC(=S)S2)C=C1    7.320
*4100 OC(=O)C1=CC(=O)C(=C(O1)C(O)=O)O   14.339
*4108 O=C1NC2=CC=CC=C2O1    7.437
*4128 OC(=O)C1=CC(=CC=C1)[N+]([O-])=O    9.369
*4138 OS(=O)(=O)C1=C(C=O)C=CC(=C1)[N+]([O-])=O   13.606
*4156 [O-][N+](=O)C1=CC2=C(NC(=N)S2)C=C1   11.320
*4173 N1C=NC2=C1C=CC=C2    6.435
*4279 OS(=O)(=O)C1=C(C=O)C=CC=C1   11.203
*4289 C=CC1=CC=CC=N1    5.441
*4324 NC1=CC(=C(C=C1)C(O)=O)O   11.299
*4344 CC1=C(C=C(O)C=C1)[N+]([O-])=O    8.613
*4346 ONC1=CC=C(C=C1)C(O)=O   13.115
*4352 CCC(=O)C1=CC=C(O1)[N+]([O-])=O    7.290
*4407 NC(=O)CSC1=C2N=CNC2=NC=N1   16.466
*4418 NC(=O)NC(=O)NN=CC1=CC=C(O1)[N+]([O-])=O   15.764
*4428 NC1=CC=CC(=C1)NC=O   11.524
*4448 CC1=CC=CC(=C1N)[N+]([O-])=O    6.742
*4482 COC(=O)C1=NC(=NC(=C1)O)SC   11.654
*4502 CN1N=NC2=C1C=CC(=C2)N    8.955
*4514 COC1=C2N(C)C=NC2=NC=N1    8.640
*4515 CCOC1=C2N=CNC2=NC=N1    9.848
*4517 CN1C=NC2=C(N(C)C=N2)C1=O   10.924
*4523 CSC1=NC(=C2N=C(C)NC2=N1)O   13.587
*4672 NS(=O)(=O)CC1=CC=CC=C1    6.767
*4679 CC1=C(N)C=CC(=C1)S(O)(=O)=O   12.008
*4726 NNC(=S)NC1=CC=CC=C1    9.439
*4732 CC1=C(SC=C1)C=NNC(N)=S    7.690
*4739 CN(C)C1=C2C=NNC2=NC=N1   11.509
*4753 CCN1C=NC2=C1N=C(N)N=C2O   12.134
*4772 CCSC1=C2N=CNC2=NC(=N1)N    9.426
*4791 O[CH]1CN=C2C=CC=CN2C1   10.227
*4878 CCCOC1=C2N=CNC2=NC=N1    9.724
*4880 NC(=N)NC(=O)C1=CC=C(N)C=C1   17.276
*4927 ON(O)NC(=N)NN=CC1=CC=C(C=C1)[N+]([O-])=O   21.476
*4946 CCCC(=O)C1=CC=CS1    5.027
*4954 COC1=C(O)C(=CC=C1)C    7.437
*4956 COC1=CC(=CC=C1)OC    4.724
*4982 OC[CH]1CO[CH](O1)C2=CC=CO2   10.059
*5002 C[CH](N)C1=CC=CC=C1    6.090
*5006 NCCC1=CC=CC=C1    6.090
*5017 CCOC1=CC=C(N)C=C1    6.824
*5025 CCOC1=CC(=CC=C1)N    6.824
*5028 CC(=O)C[N+]1=CC=CC=C1   12.996
*5047 CCOC(=O)C(C#N)=C(C)C    6.173
*5057 CCOC(=O)C1=CNC=C1C    7.068
*5080 CN(CC(O)=O)CC1=CC=CO1    9.360
*5094 CCOC1=C(N)C=CC(=C1)S(O)(=O)=O   13.156
*5104 NC1=CC2=C(NCCN2)C=C1   12.297
*5132 CCNC1=C2C=NN(C)C2=NC=N1   11.368
*5156 CN1C(=O)N(C)C2=C(N(C)C(=N)N2)C1=O   13.889
*5172 CCCN1C=NC2=C1N=C(N)N=C2S    7.452
*5183 CNCCC1=CC=CC=N1    8.633
*5188 CC[N+]1=CC=CC(=C1)C(N)=O   16.086
*5200 O=C1N[CH](C2CCCC2)C(=O)N1    8.545
*5203 C[N+]1=CC=CC(=C1)CC(=O)NO   19.297
*5207 CCOC1=CN=C(OCC)N=C1    6.785
*5232 ON1C(=O)N[CH]2CCCC[CH]2C1=O   11.712
*5238 C[CH](CC(O)=O)[C]1(C)NC(=O)NC1=O   13.440
*5250 CC(C)NC(=O)NC=C(C#N)C(N)=O   17.936
*5267 CCCCN1N=NC2=C1N=C(N)N=C2O   12.287
*5270 NC1=CC=C(C=C1)C=NNC(=N)NN(O)O   22.524
*5275 OC1(CCCCC1)C#C    5.971
*5278 C[C](O)(C#C)C1CCC1    5.971
*5286 CC(C)C=C1CCOC1=O    3.754
*5301 CC(=C)COC(=O)C(C)=C    3.526
*5311 COC(=O)C1CCC(=O)CC1    6.914
*5350 C1C=CC[N+]12CC=CC2   12.910
*5351 O=C1NC[CH]2CCC[CH]1C2    7.706
*5412 NCCNS(=O)(=O)C1=CC=C(N)C=C1   13.350
*5424 CCN1N=NC2=C1N=C(N)N=C2NCCO   15.975
*5440 CC1(C)C(=NO)C(C)(C)C1=NO    9.070
*5500 OC(=O)CC1CCCCC1    5.879
*5503 CC=C[CH]1OCC[CH](C)O1    4.092
*5534 CCCCC(=O)OCC=C    3.268
*5597 CO[CH]1O[CH]([CH](O)[CH](O)[CH]1O)C(=O)OC   14.267
*5615 CCCC[CH](CC)C#N    3.777
*5637 N[CH](C1CCCCC1)C(O)=O    8.567
*5642 CN(C)CCOC(=O)C(C)=C    7.020
*5645 C=COCCN1CCOCC1    7.587
*5654 CC(C)OC(=O)NCC(C)=C    6.502
*5676 CCOC(=O)N[CH](C(C)C)C(O)=O   10.398
*5680 CCCCCCCSC#N    3.620
*5702 CCN(CC)CCCC#N    7.327
*5704 C=CCNCCNCC=C    8.066
*5736 CN(CCN(C)CC(O)=O)CC(O)=O   15.277
*5737 NC(=O)OCCCCCCOC(N)=O    9.857
*5754 C1CN(CCO1)N=NN2CCOCC2   12.036
*5760 CC(C)C(C)(C)C(C)=O    3.690
*5773 CC[CH]1CCC[CH](O)C1    5.064
*5810 CC(C)C1OCCCCO1    4.036
*5812 C[CH](O)CC[CH]1CCCO1    8.019
*5813 CC[CH](C(O)=O)C(C)(C)C    5.523
*5817 CCOCC=CCOCC    4.437
*5821 CC[CH](C=O)[CH](O)C(C)C    7.866
*5828 CCC(C)(C)SCCC(O)=O    7.618
*5834 CCOCCOCOCC=C    5.863
*5872 CCCN1CCCCC1    4.178
*5876 NCCC1CCCCC1    4.614
*5896 CCOC1CCC(N)CC1    6.670
*5900 CCC(CC)(CC)C(N)=O    7.213
*5911 C[CH](O)CC(C)(C)NC(C)=O   11.432
*5913 CC[CH](C)CC[CH](N)C(O)=O    8.211
*5940 CC(CC(C)(C)C)=NNC(N)=O    8.272
*5946 CCCCCC(C)=NNC(N)=S    5.636
*5974 CCCCCC[CH]1CS(=O)(=O)NN1    7.330
*5987 CC(C)CCC(C)(C)O    4.509
*5988 CCCCOCCCC    2.326
*6018 CCCC[CH](CC)COS(O)(=O)=O    7.228
*6036 CC(C)(C)CC(C)(C)N    4.259
*6046 CCCCCN(C)CCO    8.259
*6064 O[CH](CNCCS)[CH](O)CNCCS   16.583
*6069 CC[N+](CC)(CC)CC   12.087
*6078 [O-][N+](=O)N1C(=O)C2=C(C=CC=C2)C1=O    8.708
*6118 [O-][N+](=O)C1=CC2=C(C=C1)N=CC=N2    8.951
*6144 ON=C1C(=O)NC2=C1C=CC=C2   11.567
*6156 ON1C(=O)NC2=C(C=CC=C2)C1=O   12.140
*6194 OC(=O)C1=CC=C(C=O)C=C1    9.569
*6204 OC(=O)C1=CC(=CC=C1O)C=O   10.451
*6239 NC1=CC2=C(COC2=O)C=C1    8.347
*6244 CC(=O)C1=CC(=CC=C1)[N+]([O-])=O    7.412
*6254 OC(=O)C(=O)NC1=CC=CC=C1   12.565
*6276 COC1=C(O)C(=C(C=O)C=C1)[N+]([O-])=O    8.987
*6277 COC1=C(C=C(C=O)C=C1O)[N+]([O-])=O   12.487
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*6384 CSC1=NC2=CC=CC=C2N1    7.971
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*6766 CC(=O)C1=CC=C(NC(N)=O)C=C1   12.435
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*6844 CCOC(=O)CN1C=NC2=C1N=CN=C2S   10.297
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*6897 COC1=C(C=CC=C1)C(C)=O    6.237
*6906 OC(=O)CSCC1=CC=CC=C1    9.326
*6935 COC1=C(OC)C=C(C=O)C=C1    7.328
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*7008 O=CNCCC1=CC=CC=C1    8.444
*7017 OC1=C2NCCCC2=CC=C1    9.551
*7028 CCOC(=O)NC1=CC=CC=C1    7.538
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*7134 COC1=CC=C(C=C1)C=NNC(N)=S    8.695
*7135 CC(=NNC(N)=S)C1=CC=C(O)C=C1   11.327
*7143 CCCCN1C=C(C#N)C(=O)NC1=O   12.003
*7187 CCC(=O)NNC1=CC=CC=C1   10.466
*7209 CCOC1=CC=C(NC(N)=O)C=C1   10.801
*7225 CCC1(CC=C)C(=O)NC(=O)NC1=O   12.447
*7231 CC(=O)NC1=C(C)C(=CC=C1)S(N)(=O)=O   12.272
*7242 CC(C)NS(=O)(=O)C1=CC=CC(=C1)[N+]([O-])=O    8.190
*7247 CCOC(=O)N1N=C(CC1=O)C(=O)OCC    7.697
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*7284 CCCCSC1=C2N=CNC2=NC=N1    9.278
*7315 CCOCC1=CC=CC=C1    4.034
*7350 COC1=C(O)C(=CC(=C1)C)OC    8.666
*7384 CCNC1=CC=C(C)C=C1    5.213
*7397 CNC1=C(C)C=CC=C1C    5.293
*7398 CC1=C(NCCO)C=CC=C1    9.650
*7399 CC1=CC=CC(=C1)NCCO    9.650
*7418 CCC(=O)C[N+]1=CC=CC=C1   12.873
*7422 C[CH]1CC(=O)C[C](C)(C1)C#N    7.427
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*7460 C[CH](CC(O)=O)C(NC(C)=O)(C(O)=O)C(O)=O   21.326
*7487 CN(C)NC(=S)NC1=CC=CC=C1    8.757
*7491 CCCCNC1=C2C=NNC2=NC=N1   12.451
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*7516 CNC1=NC2=C(N1C)C(=O)N(C)C(=O)N2C   13.556
*7527 CN(C)C1=C2N=C(NC2=NC(=N1)S(C)(=O)=O)S(C)(=O)=O   17.181
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*7547 NC[CH](N)CC1=CC=CC=C1    9.955
*7548 C[CH](CN)C1=C(N)C=CC=C1    9.419
*7559 CCOC(=O)C1=CNC(=C1C)CN   11.012
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*7598 CCNC1=NC2=C(NCC)N=CN=C2N1   15.676
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*7641 CC(=O)OC1(CCCCC1)C(O)=O    7.775
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*7671 C[N+](C)(C)C1=CC=CC=C1   13.179
*7686 CCCC1(C)CC(=O)NC(=O)C1    6.983
*7744 CCC(CC)C(=O)NC(=O)NC(C)=O   11.963
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*7795 CCCCCOC(=O)C(C)=C    3.347
*7809 CCC[CH](C(C)=O)C(=O)OCC    6.437
*7841 COCCOCCOC(=O)CC(C)=O   10.545
*7854 C[CH](N)CC1=CCCCC1    4.475
*7894 CN1CC[C](C)(O)[CH](C1)C(C)=O   11.910
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*7927 CC(C)(CO)[CH](O)C(=O)NCCC(O)=O   14.367
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*7980 CCCCC(=O)CCCC    3.567
*7990 CCCC1(O)CCCCC1    4.939
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*8014 CCCCCC[CH](C)OC=O    2.759
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*8120 CCCCC[CH]1CNCCN1    8.042
*8130 CCCCNC(=S)NCCCC    5.380
*8144 CCCCCCC(C)(C)O    4.385
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*8201 C[N+]1(C)CCC[N+](C)(C)CC1   18.135
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*8227 OC1=CC=NC2=C1C=CC(=C2)[N+]([O-])=O   12.548
*8268 OC1=CC=C(C=C1)C2=NC=CS2   10.514
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*8289 O=C1NC(=O)[CH](O1)C2=CC=CC=C2    7.413
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*8654 OC(=O)C=CC(=O)NCC1=CC=NC=C1   17.194
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*8698 OC(=O)CCC(=NNC1=CC=C(C=N1)[N+]([O-])=O)C(O)=O   19.292
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*8893 C[CH](COC(=O)C1=CC=CC=C1)[N+]([O-])=O    7.456
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*9249 COC1=C(CCC(O)=O)C=CC=C1    8.460
*9251 CC1=CC(=C(C)C=C1)OCC(O)=O    7.690
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*10783 C(SC1=C2N=CNC2=NC=N1)C3=CC=CS3   11.005
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*15764 COC1=CC2=C(C=C1)C=C(CCO)C=C2    8.777
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*16760 CCCCC#CCN(CCC)CCC    4.411
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*17927 CC(=O)OC[CH]1CO[CH](O1)C=CC2=CC=CC=C2    8.383
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*18301 C[CH]1CCO[CH](O1)C2=CC=C(C=C2)C(C)C    5.210
*18320 CCC1(OCC(C)(C)CO1)C2=CC=CC=C2    5.130
*18329 CCC1(C)COC(CC2=CC=CC=C2)OC1    5.130
*18334 O=C(OC[CH]1CCC=CC1)[CH]2CCC=CC2    3.225
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*18392 CC(C)N(C(C)C)C(=O)C1=C(C)C=CC=C1    7.437
*18403 C1CCN(CC1)CCOCC2=CC=CC=C2    7.325
*18413 COC1=CC=C(C=C1)[CH](O)[CH](C)N2CCCC2   11.059
*18422 CCC[C]1(C)NCCO[C]1(O)C2=CC=CC=C2   11.983
*18429 CCCC(C)(C)COC(=O)C1=CC(=CC=C1)N    7.173
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*18459 CC(C)C[CH](NC(=O)OCC1=CC=CC=C1)C(=O)NN   12.360
*18485 CC1=CC=C(C=C1)N2CCN(CCCO)CC2   11.752
*18494 CCN(CC)CCOC1=CC=C(NC(C)=O)C=C1   12.373
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*18523 CCCCCCN(N=O)C1=NC2=C(N1C)C(=O)N(C)C(=O)N2C   12.879
*18528 CC(C)=CCCC1=CC[C](C)(CC1)C=O    3.015
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*18674 CC(=O)N(C1CCCCC1)C2CCCCC2    6.750
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*18721 CC(C)[CH]1OC2(CCCCC2)OCC1(C)C    3.654
*18735 CCCCCCCCCCC=CCC(O)=O    4.842
*18737 CCC1(CC)COC2(CCC(C)CC2)OC1    3.654
*18741 C[CH](CCOC(=O)C(C)C)CCC=C(C)C    2.386
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*18759 CCCCCCCCCCCC(C(O)=O)C(O)=O   10.037
*18774 CCCCN(CCCC)CC#CCCC    4.289
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*18848 CCCCCCCCCCCC[CH](O)C(O)=O    5.592
*18869 CCCCCCCCCCN1CCNCC1    7.209
*18871 C1CC[N+]2(C1)CCCC[N+]3(CCCC3)CC2   18.231
*18888 CCCCCCCCCCCCCCO    3.770
*18907 CCCCCCCCCC[N+](C)(C)CC(O)=O   15.300
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*19013 NC1=CC2=C(C=C1S)C(=O)C3=C(C=CC=C3)C2=O   12.963
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*19136 COC1=CC=C(C=C1)C(=CC2=CC=NC=C2)C#N   10.670
*19205 OC(=O)[C]1(O[CH]1C2=CC=CC=C2)C3=CC=CC=C3   10.385
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*19274 CC(=O)OC1=CC=C(C=C1)C=CC2=CC=CC=N2    8.710
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*19292 OC(=O)C(=NOCC1=CC=CC=C1)C2=CC=CC=C2    8.863
*19306 O=C1NC(=O)[C](CC2=CC=CC=C2)(N1)C3=CC=CN=C3   13.750
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*19320 C(C1=NC2=CC=CC=C2C=C1)[N+]3=CC=CC=C3   14.810
*19367 S=C1SC2=C(C=CC=C2)N1CCNC3=CC=CC=C3    7.728
*19395 OC1=CC=C(C=C1)[CH]2CCC3=C2C=CC=C3    7.491
*19413 OCCOC1C2=C(C=CC=C2)C3=CC=CC=C13   10.022
*19423 COC(=O)C1=C(CC2=CC=CC=C2)C=CC=C1    5.510
*19431 CC1=CC(=C(C=C1)C(=O)CC2=CC=CC=C2)O    6.943
*19439 COC(=O)C(O)(C1=CC=CC=C1)C2=CC=CC=C2    6.750
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*19452 CC1(C)CC(=O)C2=C(C1)OC(=O)C3=C2C=CC=C3    7.493
*19474 COC1=C2C=CC(C)(C)OC2=CC3=C1C=CC(=O)O3    7.943
*19477 CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C(C)C=C2)C(O)=O   11.214
*19503 CCC(=CC1=C(O)C=CC=C1)C2=CC=NC=C2   10.455
*19514 NCCCC1=CC2=C(C=C1)C3=CC=CC=C3O2    8.085
*19560 CCOC(=O)C(N1C(=O)C2=CC=CC=C2C1=O)C(=O)OCC   11.350
*19588 CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NN=CC2=CC=C(O)C=C2   16.963
*19602 CC1=C(NC(=O)NC2=C(C)C=CC=C2)C=CC=C1    9.870
*19627 CCOC(=O)[CH](C)NC(=O)C1=CC2=C(C=CC=C2)N=C1   13.284
*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
*19670 C[CH](C1=CC=CC=C1)C2=C(O)C=CC(=C2)C    7.135
*19688 OCC(CO)(C1=CC=CC=C1)C2=CC=CC=C2    8.947
*19689 CCCCC(=O)C1=CC=C2C=CC=CC2=C1O    6.532
*19692 CC(C)OC(=O)CC1=C2C=CC=CC2=CC=C1    5.613
*19693 COC(=O)C=CC=C1CCCC2=C1C=CC=C2    5.277
*19703 CC1=CC(=C(C(=C1)C)S(=O)(=O)OC2=CC=CC=C2)C    6.398
*19709 O=S(=O)(CC1=CC=CC=C1)CS(=O)(=O)CC2=CC=CC=C2   11.462
*19718 CCN(CC1=CC=CC=C1)C2=CC=CC=C2    5.037
*19729 C1CCN(CC1)C2=C3C=CC=CC3=CC=C2    5.064
*19760 CC(=O)C1=CC=C(C=C1)N=C[CH]2CCCCC2=O    8.688
*19782 CC1=CC=C(NS(=O)(=O)C2=C(C)C=CC(=C2)C)C=C1    6.504
*19792 CO[CH]1O[CH]2CO[CH](O[CH]2[CH](SC#N)[CH]1O)C3=CC=CC=C3   18.157
*19833 CCC(O)(CC1=CC=CC=N1)CC2=CC=CC=N2   13.030
*19854 NS(=O)(=O)C1=CC=C(N[CH](C[CH](C2=CC=CC=C2)S(O)(=O)=O)S(O)(=O)=O)C=C1   21.196
*19872 CCC(=O)C1=CC(=CC(=C1)C(=O)CC)C(=O)CC   10.119
*19885 CCOC(=O)[CH]1CCC(=O)[C](O)(C1)C2=CC=CC=C2    8.693
*19886 CCOC(=O)CC1=CCC2=C(OC)C(=CC=C12)OC    7.561
*19895 CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC)C(=O)OCC    8.472
*19896 C=CCOC(=O)CC(=CC(=O)OCC=C)C(=O)OCC=C    8.932
*19903 O=C1[CH](CN2CCCCC2)CC3=C1C=CC=C3    8.489
*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
*19950 CCN(CC)C1=CC=NC(=N1)SCC2=CC=CC=C2    8.126
*19969 CCN1C[CH](CC2=C1C=CC=C2)C(=O)N[CH](C)C(O)=O   14.317
*19977 CCOC(=O)C1=CC=CC(=C1)NC(=O)CN2CCOCC2   14.446
*20010 OC(=O)[CH](CC1=CC=CC=C1)C2CCCCC2    6.848
*20061 CCCCOC1=CC2=C(C=C1OC)C(=NCC2)C    5.684
*20062 O=C(OCCCN1CCCCC1)C2=CC=CC=C2    7.504
*20072 CCCCCCC(=NOCC1=CC=CC=C1)C(O)=O    7.032
*20093 CCOC(=O)OC1=C(OC)C=C(C=C1)C(=O)NCC(C)C   10.420
*20112 CCN(CC)CCC[CH](C#N)C1=CC=CC=C1    8.298
*20129 COC(=O)CCN1CCN(CC1)C2=CC(=CC=C2)C   10.062
*20134 COC1=CC=C(C=C1)C(=O)NCCCN2CCOCC2   14.764
*20155 CCN(CC)S(=O)(=O)NC1=C(C)N(C)N(C1=O)C2=CC=CC=C2   12.650
*20172 CCCC[C](CC)(CC1=CC=CC=C1)C(O)=O    6.493
*20212 CCC1(C)COC(CC)(OC1)C2=CC=CC=C2    5.007
*20241 CCCCC[C](C)(O)[CH](C(O)=O)C1=CC=CC=C1   10.932
*20257 CCC1(C)COC(OC1)C2=CC=C(OC)C(=C2)OC    7.708
*20276 C=CC[N+]1(CCOCC1)CCC2=CC=CC=C2   15.595
*20288 CCCCCC[CH](C)OC(=O)C1=CC=C(N)C=C1    7.050
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*20299 COC(=O)CCCC1=C(C=CC=C1)N(CCO)CCO   12.029
*20302 CCCCCCCCS(=O)(=O)NC1=CC=C(C=C1)C(O)=O    9.770
*20309 C1CCN(CC1)C2(CCCCC2)C3=CC=CS3    5.523
*20351 CCCCOC1=C(N)C=C(C=C1)C(=O)OCCNCC   12.170
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*20454 CCCCC([CH](C)C=C)(C(=O)OCC)C(=O)OCC    5.277
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*20462 CC1(COC(CCCCCCCCC=C)OC1)[N+]([O-])=O    6.545
*20472 O=C(CCN1CCCCC1)CCN2CCCCC2   10.640
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*20592 CCCCCCCCCCCC(=O)OCCOC    4.334
*20594 C[CH](CCCC(C)(C)O)CC1OCC(C)(C)CO1    7.613
*20620 CCCCS(=O)(=O)OCC(CC)(CC)COS(=O)(=O)CCCC    8.180
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*20664 OC1=C(C=CC=C1)C2=NC3=C(S2)N=C(S3)C4=C(O)C=CC=C4   19.770
*20671 S1C(=NC2=C1N=C(S2)C3=CC=CC=C3)C4=CC=CC=C4   11.804
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*20792 O(C1=CC=CC=C1)C2=C3C=CC=CC3=CC=C2    4.939
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*20845 COC1=CC=C(C=C1)C(=O)[CH](C#N)C2=CC=CC=C2   10.712
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*20923 O=C(C[N+]1=C2C=CC=CC2=NC=C1)C3=CC=CC=C3   15.092
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*20980 CC(=O)CC(=O)C1=CC=C(C=C1)C2=CC=CC=C2    9.295
*20985 COC1=CC=CC(=C1)C=CC(=O)C2=CC=CC=C2    7.863
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*21011 COC1=CC=C(C=C1)C(=O)CC(=O)C2=CC=CC=C2   10.112
*21064 CC1=CSC=[N+]1CC(=O)C2=CC3=C(C=CC=C3)C=C2   14.932
*21079 CC1=[N+](CC(=O)C2=CC=CC=C2)C3=C(O1)C=CC=C3   14.668
*21081 COC1=CC2=CC=C[N+](=C2C=C1)CC(=O)C3=CC=CS3   16.201
*21107 CCOC1=C(C=CC=C1)C=NNC2=NC3=CC=CC=C3O2   11.385
*21194 CC(C)C(=O)C1=CC=C(C=C1)C2=CC=CC=C2    5.876
*21237 COC1=CC=C(CC(=O)OCC2=CC=CC=C2)C=C1    7.170
*21258 COC1=CC(=CC=C1)[CH](O)C(=O)C2=CC=CC(=C2)OC    9.365
*21270 COC1=CC=C(C=C1)C(=O)C2=C(O)C(=C(OC)C=C2)OC   10.278
*21272 CC1=CC=C(SC=CSC2=CC=C(C)C=C2)C=C1    5.417
*21273 C1CN[CH](C1)C2=CC=C(C=C2)C3=CC=CC=C3    7.096
*21278 O=C1CCCC[CH]1NC2=CC3=C(C=CC=C3)C=C2    8.248
*21279 O=CNC(CC1=CC=CC=C1)CC2=CC=CC=C2    9.413
*21289 CN(C)C1=CC=C(CC(=O)C2=CC=CC=C2)C=C1    7.900
*21319 NC[CH]1COC(O1)(C2=CC=CC=C2)C3=CC=CC=C3   10.703
*21329 N[CH]([CH](O)C1=CC=CC(=C1)OCC2=CC=CC=C2)C(O)=O   16.678
*21338 CN(C)C1=CC2=C(C=C1)C=C3C=C(C)C(=CC3=N2)N   12.380
*21352 COC1=C(C=CC=C1)C=NNS(=O)(=O)C2=CC=C(NC(C)=O)C=C2   14.209
*21355 CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NN=C(C)C2=C(O)C=CC=C2   16.842
*21366 C1CN[CH]([CH](N1)C2=CC=CC=C2)C3=CC=CC=C3   10.845
*21372 C[CH](NC1=CC=CC=C1)C=CNC2=CC=CC=C2    9.063
*21386 CC(CCC1=CC=C(O)C=C1)=NNC2=CC=CC=C2   10.000
*21391 CC(C)C[CH](NC(=O)C1=NC2=C(C=CC=C2)C=C1)C(O)=O   15.544
*21412 CN1C(=O)N(C)C2=C(N(CCO)C(=N2)CC3=CC=CC=C3)C1=O   15.810
*21435 C[CH](O)CC(C1=CC=CC=C1)C2=CC=CC=C2    7.386
*21443 CCCC(C1=CC=C(O)C=C1)C2=CC=C(O)C=C2   10.914
*21449 O=C(CC1=CC=CC=C1)OC[CH]2C[CH]3C[CH]2C=C3    4.754
*21475 C(CCSC1=CC=CC=C1)CSC2=CC=CC=C2    6.106
*21517 COC1=C2C=CC=CC2=C(C=C1)C(=O)CCN(C)C   10.428
*21524 CCN[CH](CC1=CC=C(O)C=C1)C2=CC=C(O)C=C2   14.684
*21569 CCCN1C=NC2=C1N=C(N)N=C2SCCC3=CC=CC=C3    8.943
*21585 CC(C)(C)C1=CC=C(C=C1)C(=O)C[N+]2=CC=NC=C2   13.670
*21597 CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(N)C=CC=C2    9.672
*21600 CC[CH](C)C1(CCC2=CC=CC=C2)C(=O)NC(=O)NC1=O   13.290
*21622 CC(C=CC1=CC=C(O1)[N+]([O-])=O)=NN2C[CH](CN3CCOCC3)OC2=O   15.848
*21626 NC1=NC(=C2N=C(C(=NC2=N1)N)C3=CC=C(C=C3)N(CCO)CCO)N   25.158
*21629 CC1=CC2=C(CCCC2(C)C)C3=C1C(=O)CC3    5.056
*21645 CCOC(=O)C[CH](CC1=CC2=C(OCO2)C=C1)C(=O)OCC    9.914
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*21829 CCC1=CC2=C(C=C1)[CH](C)CC[C]2(C)CC    1.635
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*22708 CCOC(=O)[CH](CC1=CC=CC=C1)C2=CC=CC=C2    5.697
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*22773 CN(C)C[CH](OC1=CC=CC=C1)C(=O)C2=CC=CC=C2    9.703
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*22791 CNC[CH]1COC(O1)(C2=CC=CC=C2)C3=CC=CC=C3   10.361
*22795 CCOC(=O)[CH](CCC1=CC=NC=C1)C2=CC=CC=C2    8.456
*22820 CC(CCC1=CC=CC=N1)(CCC2=CC=CC=N2)C#N   11.851
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*22859 CC(C)(C)C(=O)NC1=CC=C(NS(=O)(=O)C2=CC=CC=C2)C=C1   12.205
*22950 CC(C)(C)C1=CC(=C(O)C=C1)CNC2=CC=CC=C2   10.042
*22962 COC1=C(OC)C=C(CC[CH](N)C2=CC=CC=C2)C=C1    9.516
*23010 C1CCN(CC1)C2=C(N=C3C=CC=CC3=N2)N4CCOCC4   12.293
*23018 CC1=C2C(=O)CCC2=C3C(=C1)C(C)(C)CC3(C)C    4.932
*23024 COC1=CC=C(C=CC(=O)OCC2CCCCC2)C=C1    6.228
*23048 CCCCCCOCCCN1C(=O)C2=C(C=CC=C2)C1=O    8.719
*23059 CCOC(=O)CSCC[CH](NC(=O)C1=CC=CC=C1)C(=O)OCC   13.740
*23080 CCN(CC)C(=O)C1CCN(CC1)C(=O)C2=CC=CC=C2   10.648
*23088 CCCCOC(=O)C1=CC=C(NC(=O)CN2CCOCC2)C=C1   14.200
*23093 CC[C]1(C)CC(C)(C)C2=C1C=C(C)C(=C2)C(C)=O    4.498
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*23117 CCN(CC)CCOC1=CC=C(C=C1)C=C(C)C(C)=O    9.900
*23118 CCCC[CH](CC)CN1C(=O)[CH]2[CH]3C[CH](C=C3)[CH]2C1=O    6.545
*23159 CC[C]1(C)CC[C](C)(CC)C2=C1C=CC(=C2)C    1.511
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*23231 CCCCOCCOCCOC(=O)COC1=CC=C(OC)C=C1    9.745
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*23291 CCCCCC[CH](C)C1=CC=C(O)C(=C1)CN(C)C    8.609
*23301 CCN(CC)CCSCCN(CC)C(=O)C1=CC=C(N)C=C1   16.085
*23308 COC1=CC2=C(C=C1OC)C=[N+](CCC[N+](C)(C)C)CC2   19.519
*23312 CCCCCCCCCCCCOC(=O)C=CC(=O)NC(N)=O   11.717
*23313 CN(C)CCOC(=O)C1CC2(C1)CC(C2)C(=O)OCCN(C)C   12.714
*23335 CCCCCCCCCCCC[N+]1=CC=CC=C1    8.470
*23350 CCCCCCCCCCCCCCSC1=NC=CN1    5.362
*23351 CCN(CC)CCNC1=NC(=C2C=NNC2=N1)NCCN(CC)CC   18.251
*23361 CCCCCC[CH](C)C(CC)(C(=O)OCC)C(=O)OCC    4.903
*23384 CCCCCCCCCCCCOC(=N)N1CCOCC1    8.703
*23389 CCCCCC(=O)O[CH](C)CC[CH](CC)CCCC    2.033
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*23411 CCCCN(CCCC)C(=O)N(CCCC)CCCC    6.595
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*23654 CC1=NC(=C2C=NN(C3=CC=CC=C3)C2=N1)NNC4=CC=CC=C4   18.195
*23660 O=C([CH]1CCC=C1C2=CC=CC=C2)C3=CC=CC=C3    6.277
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*23668 CC1=CC2=C(C(=C1)C)C(=O)C3=C(C(=CC(=C3)C)C)C2=O    8.327
*23669 O=C([CH]1CCC=C(O1)C2=CC=CC=C2)C3=CC=CC=C3    6.654
*23708 CSC1=CC=C(C=C1)C(=O)C[N+]2=CC3=CC=CC=C3C=C2   16.244
*23763 CCOC(=O)C(NC(=O)C1=CC=CC=C1)=CC2=C(NO)C=CC=C2   16.971
*23768 CN1C(=NC2=C1C=CC=C2)CCCC3=NC4=CC=CC=C4N3   10.078
*23769 C(CCC1=NC2=CC=CC=C2N1)CC3=NC4=CC=CC=C4N3   11.284
*23772 O=C1CC(=O)N(CCC2=CC=CC=N2)C(=O)N1CCC3=CC=CC=N3   19.959
*23818 O=CO[CH](CCCC1=CC=CC=C1)C2=CC3=C(OCO3)C=C2    8.372
*23821 CCCCOC(=O)C1=CC=C(OC(=O)C2=CC=CC=C2)C=C1    6.714
*23836 CCOC(=O)OC1=C(OC)C=C(C=C1)C(=O)OC2=C(OC)C=CC=C2    8.595
*23845 CN(C)C[CH](O)C1=C2C=CC=CC2=C3C=CC=CC3=C1   11.866
*23888 COC1=CC=C(NC2=NC(=NC(=C2)NC3=CC=C(OC)C=C3)N)C=C1   15.312
*23943 CCCC(=O)CC(C1=CC=CC=C1)C2=CC=CC=C2    6.121
*23949 C[C]12CC[CH]3C(=CCC4=C3C=CC(=C4)O)[CH]1CCC2=O    9.405
*23950 C[C]12CCC3=C(C=CC4=C3C=CC(=C4)O)[CH]1CC[CH]2O   11.587
*23982 N[CH](CC1=CC=CC=C1)C2=C3CCCCC3=CC=C2    7.208
*23989 CCN(CC)C(=O)C(C1=CC=CC=C1)C2=CC=CC=C2    9.208
*24016 O=C(C[N+]1(CCOCC1)C2=CC=CC=C2)C3=CC=CC=C3   17.917
*24040 COC1=C(OC)C(=C2C(=C1)CC[CH](N)C3=C2C=CC(=C3)O)OC   15.185
*24071 C1CCN(C1)CC[CH](C2=CC=CC=C2)C3=CC=CC=N3    9.370
*24073 CCN(CC)C1=CC(=C(C=C1)N=C2C=CC(=O)C(=C2)C)C    8.045
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*24099 CC1=CC=CC(=C1)N2CCN(CC2)CSC3=CC=CC=C3    7.562
*24135 COC[C](O)(C1=CC=CC=C1)C2=C(C)C=C(C)C=C2C    9.435
*24143 C[CH](CC1=CC(=C(O)C=C1)O)[CH](C)CC2=CC(=C(O)C=C2)O   18.635
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*24177 CCN(CC)CCOC1=C(C=CC=C1)C2=CC=CC=C2    7.547
*24192 C1CCN(CC1)C[CH](OCC2=CC=CS2)C3=CC=CC=C3    8.684
*24217 COC(=O)C(OC)=C1C(=O)N(C)C2=C(C=C(C)C(=C2)C)C1(C)C   10.092
*24235 CC(C)OCCCNC1=NC(=NC2=C1C=NN2C3=CC=CC=C3)C   16.656
*24256 CCNS(=O)(=O)C1=CC=C(OCCOC2=CC=C(C=C2)S(=O)(=O)NCC)C=C1   13.020
*24272 CC1=C2CCC(=O)C2=C3C(=C1)C(C)(C)CCC3(C)C    4.810
*24278 C[C]12CC[CH]3[CH](CCC4=CC(=O)CC[CH]34)[CH]1CCC2=O    7.558
*24316 CCCCCCCCS(=O)(=O)NC1=CC2=C(C=CC=C2)C=C1    6.082
*24317 OC1(CCCCC1)[CH](C(=O)N2CCOCC2)C3=CC=CC=C3   14.580
*24349 CCC1=C(C=C2C(=C1[N+]([O-])=O)[C](C)(CC)CC[C]2(C)CC)[N+]([O-])=O    6.196
*24378 CCCCCC(=CC1=CC=CC=C1)[CH]2O[CH](C)[CH](C)O2    4.951
*24405 CCCC[CH](CC)CNC(=O)C=CC1=CC=C(OC)C=C1    9.604
*24414 CCCOC1=CC=C(C=C1)C(=O)OCCCN2CCC[CH]2C    8.487
*24418 CC(C)OC1=CC=C(C=C1)C(=O)OCCCCN2CCCC2    8.487
*24422 CCCOC1=CC=C(C=C1)C(=O)OC[CH](C)CN2CCCC2    8.487
*24424 CCOC1=C(OCCCN2CCOCC2)C=C(C=CC)C=C1    9.921
*24436 CCN(CC)CCCNC1=C2N=C(OC)C=CC2=CC(=C1)OC   13.580
*24439 CCN(CC)C[C](C)(O)CNC1=C2N=CC=CC2=CC(=C1)OC   17.627
*24447 CC(C)(C)N1COC2=C(C1)C=C3OCN(CC3=C2)C(C)(C)C    8.866
*24451 CCCCCOC(=O)C1=CC=C(NC(=O)CNCC(C)C)C=C1   11.886
*24469 CCC(=O)OC1=C(C=C(C(=C1)C)C(C)(C)C)C(C)(C)C    3.199
*24472 CCCCC1(CC)COC(C)(CC2=CC=CC=C2)OC1    4.636
*24478 CCCCC1(CC)COC(CC)(OC1)C2=CC=CC=C2    4.636
*24499 CCOCCOCCO[CH](C)O[CH](C)CC1=CC2=C(OCO2)C=C1   11.449
*24500 CCCCOCCOCCOC(=O)CC1=CC(=C(OC)C=C1)OC   10.553
*24512 CCN(CC)CCOC(=O)C1=C(C)C(=C(C)C(=C1C)C)C    7.181
*24545 CCCOC(=O)[CH](C)OC(=O)OCCOCCOC(=O)O[CH](C)C(=O)OCCC    9.775
*24578 CC(=O)NCCSC(=O)CCCCCCCCC(=O)SCCNC(C)=O   15.924
*24607 CCC[CH](C1CCCC1)C(=O)OCCN2CCCC2(C)C    6.173
*24627 C[CH]1C[CH](CC(C)(C)C1)N(N=O)[CH]2C[CH](C)CC(C)(C)C2    4.429
*24635 CCCCCCCCCCCCCC[CH]1CCC(=O)O1    2.266
*24640 CCCCCCCCCCCC[CH](C(C)=O)C(=O)OCC    5.329
*24656 CCCCCCCCC=CCCCCCCCC(N)=O    6.038
*24664 CCCCCCCCCC1=NC(C)(C)CN1C(C)(C)CO    8.688
*24670 CCCC[CH](CC)C=NNC(=N)C(=N)NN=C[CH](CC)CCCC    9.453
*24675 CCCCCC[CH](O)CC=CCCCCCCCCO    4.971
*24686 CCCCCCCCCCCCCCCC[CH](O)C(O)=O    5.100
*24687 CCCCCC[CH](O)CCCCCCCCCCC(O)=O    8.730
*24694 CCCCCCCCCCCCCCCC(=O)NCCO   10.201
*24700 CCN(CC)CCNC(=O)CCCCC(=O)NCCN(CC)CC   16.388
*24701 CCCCCCCCCC(CO)CCCCCCC    3.278
*24724 CN(C)CCCN1CN(CCCN(C)C)CN(CCCN(C)C)C1   13.201
*24729 [O-][N+](=O)C1=CC=C2C3=CC=CC=C3C(=NC4=CC=CC=C4)C2=C1    7.963
*24743 O=C(N1C2=CC=CC=C2C3=CC=CC=C13)C4=CC=CC=C4    8.660
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*24763 CC(=O)NC1=CC2=C(C=C1)C3=CC=C(C=C3C2)N4C(=O)C=CC4=O   14.936
*24776 O=C(C=CC1=CC=CC=C1)C2=C3C=CC=CC3=CC=C2    7.646
*24782 O=C1C[CH](C2=CC=CC=C2)C3=C4C=CC=CC4=CC=C3O1    6.604
*24790 OC(=O)C(=CC1=CC=C(O)C=C1)C2=C3C=CC=CC3=CC=C2   14.231
*24795 OC1=CC=C(C=C1)C2(OS(=O)(=O)C3=CC=CC=C23)C4=CC=C(O)C=C4   16.682
*24815 [N-]=[N+]=N[CH](C1=CC=CC=C1)C2=CC=C(C=C2)C3=CC=CC=C3    7.052
*24817 NC1=CC(=CC2=CC(=C(N=NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CS4)C(=C12)O)S(O)(=O)=O)S(O)(=O)=O   33.451
*24824 N#CCCC1(CCC#N)C2=C(C=CC=C2)C3=CC=CC=C13   10.049
*24830 NC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)N=CC3=CC=CC=C3   11.793
*24881 O=C([CH](C1=CC=CC=C1)[N+]2=CC=CC=C2)C3=CC=CC=C3   14.790
*24882 O=C1[CH](CCC2=C1C=CC3=C2C=CC=C3)[N+]4=CC=CC=C4   14.900
*24887 C1OC2=CC=C3C=CC=CC3=C2CN1CC4=CC=CC=C4    8.040
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*27981 CC1=CC(C=C(C1=O)C(C)(C)C)=C2C=C(C)C(=O)C(=C2)C(C)(C)C    7.391
*27982 CC(=O)O[C]1(CC[CH]2[CH]3CCC4=CC(=O)CC[CH]4[CH]3CC[C]12C)C#C    7.424
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*27990 CC(C)(C)C1=CC=C(C=C1)C(=O)C[N+]2(C)CCCC3=C2C=CC=C3   15.533
*28009 CC[N+]1(C)CCC[CH](C1)OC(=O)C(O)(C2=CC=CC=C2)C3=CC=CC=C3   18.059
*28014 CCCCOC(C(=O)OCCN(C)C)(C1=CC=CC=C1)C2=CC=CC=C2    9.836
*28025 CC(C)N(CCC(C(N)=O)(C1=CC=CC=C1)C2=CC=CC=C2)C(C)C   12.703
*28102 CC[N+](C)(CC)CC1=C(OC(=O)N(C)C)C=CC(=C1)CC2=CC=CC=C2   19.360
*28123 C[CH]1C[CH]2[CH](CC[C]3(C)[CH]2CC[C]3(O)C(C)=O)[C]4(C)CCC(=O)C=C14    7.873
*28125 C[CH]1C[C]2(C)[CH]3[CH](O)C[C]4(C)[CH](CC[CH]4C(C)=O)[CH]3CCC2=CC1=O   11.502
*28152 CCN(CC)C1=CC(=C(CCC2=C(N)C=C(C=C2)N(CC)CC)C=C1)N   13.204
*28159 CCCCCC(=CC1=CC=CC=C1)[CH]2OCC(C)(C)[CH](O2)C(C)C    4.457
*28162 CC1(C)[CH]2CC[CH]3[CH](CC[C]4(C)[CH](O)CC[C]34C)[C]2(C)C=CC1=O    8.156
*28197 CC1=CC=CC=[N+]1CCCCCCCCCC[N+]2=C(C)C=CC=C2   11.320
*28203 CCOC(=O)N1CCN(CCCCOC2=CC=C(C=C2)C(C)(C)CC)CC1   11.593
*28233 CCCCCCCCCCCCCCCCNC1=CC=CC=C1    3.533
*28287 CCCCCC[CH](O)CCCCCCCCCCC(=O)OCCCC    5.854
*28292 CCCCCCCCCCCCCCCC1=NCC[N+]1(CCO)CCO   17.900
*28294 CCCCCCCC(O)(CCCCCCC)CCCCCCC    2.785
*28301 C[N+]1(C)CCC(CCCCCCCCC2CC[N+](C)(C)CC2)CC1   16.893
*28369 COC1=C2C=CC=CC2=C(CC3=C4C=CC=CC4=C(OC)C=C3)C=C1    7.796
*28389 OC1=CC=C(O)C2=C1CN(CC3=CC=CC=C3)C(=S)N(CC4=CC=CC=C4)C2   17.116
*28406 O[C]1(OCCN(CC2=CC=CC=C2)[CH]1C3=CC=CC=C3)C4=CC=CC=C4   14.318
*28418 CC1(C)[CH](N2CCOCC2)C3=CC4=CC=CC=C4N=C3C5=C1C=CC=C5   12.770
*28467 C[CH](CN=C(CC(C)=O)C1=CC=CC=C1)N=C(CC(C)=O)C2=CC=CC=C2   11.533
*28480 CCOC(=O)[CH](CC(=O)C1=CC2=C(OCO2)C=C1)CC3=CC(=C(OC)C(=C3)OC)OC   14.975
*28507 CC(=O)OCC(=O)[C]1(O)C[CH]2O[C]23[CH]4C=CC5=CC(=O)CC[C]5(C)[CH]4[CH](O)C[C]13C   14.260
*28532 CCOC(=O)C1=C(C)C(=C(CC2=C(C(=C(N2)C(=O)OCC)C)C(=O)OCC)N1)C(=O)OCC   17.052
*28540 CC(=O)OCC(=O)[C]12O[CH]1C[CH]3[CH]4CCC5=CC(=O)CC[C]5(C)[CH]4CC[C]23C   11.021
*28545 CC(=O)OCC(=O)[C]1(O)CC[C]2(O)[CH]3CCC4=CC(=O)C=C[C]4(C)[CH]3CC[C]12C   11.533
*28551 CCCC(=O)C(CCN(CC)CC)(C1=CC=CC=C1)C2=CC=CC=C2    9.057
*28559 CC(C)CCOC(C(=O)OCCN(C)C)(C1=CC=CC=C1)C2=CC=CC=C2    9.712
*28575 C[CH](O)CNS(=O)(=O)C1=CC=C(NC(=O)CCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC[CH](C)O)C=C1   24.750
*28581 COC1=CC=C(C=C1)C(C[CH](C)CC(C)(C)C)C2=CC=C(OC)C=C2    4.790
*28604 CC(=O)OCC(=O)[C]1(O)CC[CH]2[CH]3CC[CH]4CC(=O)CC[C]4(C)[CH]3C(=O)C[C]12C   12.928
*28631 CC[N+](C)(CC)CCCN(C)C(=O)C(O)(C1=CC=CC=C1)C2=CC=CC=C2   21.215
*28637 CCC(=O)O[CH]1CC[CH]2[CH]3[CH](C)CC4=CC(=O)CC[C]4(C)[CH]3CC[C]12C    6.393
*28644 CC(=O)O[CH]1CC[C]2(C)[CH]3CC[C]4(C)[CH](CC[CH]4C(C)=O)[CH]3C[CH]5O[C]25C1    9.046
*28665 CC(=O)O[CH]1CC[C]2(C)[CH](CC[CH]3[CH]2CC[C]4(C)[CH]3CCC45SCCS5)C1    7.264
*28667 CC(=O)O[CH]1CC[C]2(C)[CH](CC[CH]3[CH]4CC[CH](C(C)=O)[C]4(C)CC[CH]23)C1    6.136
*28692 CCCCCC[CH](C)C1=CC(=C(O)C(=C1)CN(C)C)C2CCCCC2    8.306
*28708 CCCCCC[CH](CC=CCCCCCCCC(=O)OCCOC)OC(C)=O    6.275
*28711 CCCCCCCCC(=O)OCCNC(=O)[CH](C)OC(=O)CCCCCCCC   10.038
*28744 O=C1OC(=O)C2=C(C3=CC=CC=C3)C4=C(C=CC=C4)C(=C12)C5=CC=CC=C5    8.438
*28760 O=C(NC1=CC2=C(C=C1)C3=CC=CC=C3C2)C4=C5C=CC=CC5=CC=C4   11.432
*28787 C1=CC=C(C=C1)N(N(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4    6.936
*28789 O=C(NCCNC(=O)OC1=C2C=CC=CC2=CC=C1)OC3=C4C=CC=CC4=CC=C3   12.551
*28810 NC1=C(CC(C2=CNC3=C2C=CC=C3)C4=CNC5=C4C=CC=C5)C=CC=C1   15.309
*28818 CN(C)C1=CC=C(C=C1)C=C2C3=CC=CC=C3C4=C2C=C(NC(C)=O)C=C4   13.453
*28838 O=S(=O)(NC1=CC=C(C=C1)C2=NCCN2)C3=CC(=CC=C3)S(=O)(=O)NC4=CC=C(C=C4)C5=NCCN5   21.277
*28867 C[CH](S[CH](C)C(=O)NN=CC=CC1=CC=CC=C1)C(=O)NN=CC=CC2=CC=CC=C2   14.903
*28885 COC1=C(O)C=C2OC3=CC(=C(CC=C(C)C)C(=C3C(=O)C2=C1CC=C(C)C)O)O   15.688
*28889 CCO[CH]1[CH]2COC(=O)[CH]2[CH](C3=CC(=C(OC)C(=C3)OC)OC)C4=C1C=C5OCOC5=C4   14.790
*28897 CCOC(=O)[CH]1[CH](N(C)[CH]([CH](C(=O)OCC)C1=O)C2=CC=CC=C2)C3=CC=CC=C3   15.029
*28909 CN(C)C1=CC=C(C=C1)C([CH](O)C2=CC=CC=C2)C3=CC=C(C=C3)N(C)C   12.323
*28911 COC1=CC(=CC=C1O)C(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C   13.220
*28930 CC(=O)CC(=NCCNCCN=C(CC(C)=O)C1=CC=CC=C1)C2=CC=CC=C2   15.180
*28938 CC1=CC=C(C=C1)C(=O)[CH]([CH](N2CCOCC2)C3=CC=CC=C3)N4CCOCC4   15.573
*28967 O=C(OCCN1CCCCCCCC1)C(C2=CC=CC=C2)C3=CC=CC=C3    8.740
*28969 CCCCCCCCCCOC(=O)NC1C2=C(OC3=C1C=CC=C3)C=CC=C2    9.143
*28990 CC(=O)OC[CH]1OC=C[CH](OC(C)=O)[CH]1O[CH]2O[CH](COC(C)=O)[CH](OC(C)=O)[CH](OC(C)=O)[CH]2OC(C)=O   21.824
*29013 CCN(CC)C[CH](OC)[CH](COC)OC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2   12.495
*29016 CCOC1=CC=C(CCNC(=O)CC2=CC(=C(OCC)C=C2)OCC)C=C1OCC   14.093
*29045 C[CH]1C[C]2(C)[CH]3[CH](O)C[C]4(C)[CH](CC[C]4(O)C(=O)COC(C)=O)[CH]3CCC2=CC1=O   11.082
*29047 C[CH]1C[CH]2[CH]3CC[C](O)(C(=O)COC(C)=O)[C]3(C)C[CH](O)[CH]2[C]4(C)CCC(=O)C=C14   11.082
*29050 CCCCN(CCCC)C[CH](O)C1=CC=C(CCC2=CC=CC=C2)C=C1   10.033
*29053 CCCCN(CCCC)CCCC(O)(C1=CC=CC=C1)C2=CC=CC=C2    9.955
*29072 CCCCCC=CCC=CCCCCCCCC(=O)NC1=CC=CC=C1    6.353
*29087 CCCCCC[CH](C)OC(=O)C1=C(C=CC=C1)C(=O)O[CH](C)CCCCCC    4.928
*29127 CCCCCCCCCCCCCCCCNC(=S)NN=CC1=C(O)C=CC=C1    9.263
*29133 CCCCCCCCCCCCCCCCCCC1=CC=CC=C1    0.134
*29136 CCCCCCCCCCCCCCCCNC(=O)NC1=C(OC)C=CC=C1    8.738
*29143 CCCCOC(=O)C[CH](S[CH](CC(=O)OCCCC)C(=O)OCCCC)C(=O)OCCCC   11.876
*29149 CCCCCCCCCCCCCCCCCC(=O)NC[N+]1=CC=CC=C1   14.331
*29150 CCCCCCNCC1=C(O)C(=CC(=C1)C(C)(C)C)CNCCCCCC   11.815
*29154 CCCCCCCCCCOC(=O)C=CC(=O)OCCCCCCCCCC    4.644
*29160 CCCCCC(=O)OCCCC[CH](COC(=O)CCCCC)OC(=O)CCCCC    6.910
*29167 OCCN1CCN=C1CCCCCS(=O)(=O)CCCCS(=O)(=O)CCCCCC2=NCCN2CCO   22.987
*29208 O=C(C1=CC=C(C=C1)C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=CC=C4    7.939
*29240 CC1=C(C(C2=CC=C(C=C2)[N+]([O-])=O)C3=C(C)NC4=C3C=CC=C4)C5=CC=CC=C5N1   14.298
*29306 CC1=CC2=C(C=CC=C2)C=[N+]1CCCCC[N+]3=CC4=CC=CC=C4C=C3C   13.955
*29320 CCCCN(CCCC)CCC(=O)C1=CC2=C(C=C1)C3=C(C=CC=C3)C=C2    9.472
*29329 CCN(CC)CCN[CH](CC1=CC=CC=C1)C2=C(OC)C=CC3=C2C=CC=C3   12.016
*29350 CCCCN(CCCC)CCC[CH](O)C1=C2C=CC=CC2=NC3=C1C=CC=C3   13.764
*29425 COC(=O)CC[CH](C)[CH]1CC[CH]2[CH]3CC[CH]4C[CH](O)CC[C]4(C)[CH]3C[CH](O)[C]12C    8.346
*29439 CCCCCCCCCCCCCCCCCCOS(=O)(=O)C1=CC=C(C)C=C1    3.959
*29446 CCCCCCCCCCCCCCCCC(NC(C)=O)(C(=O)OCC)C(=O)OCC    9.341
*29453 CCCCCCCCCCCCCCCCCC1=NC(C)(C)CN1C(C)C    3.390
*29460 CCCCCCCCCCCCCCCC[N+](C)(CCO)C[CH](O)[CH](O)[CH](O)[CH](O)CO   21.616
*29481 O=C(OC1=C(C=CC=C1)C2=CC=CC=C2)C3=C(C=CC=C3)C(=O)C4=CC=CC=C4    9.450
*29482 O=C1O[C](OC2=C(C=CC=C2)C3=CC=CC=C3)(C4=CC=CC=C4)C5=C1C=CC=C5    9.467
*29496 C1=CC=C(C=C1)C(C2=CC=CC=C2)=C(C3=CC=CC=C3)C4=CC=CC=C4    6.606
*29499 C1=CC=C(C=C1)C=NC2=CC=C(C=C2)C3=CC=C(C=C3)N=CC4=CC=CC=C4    6.860
*29528 CC(C)=NN=C1[CH](C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=C1C=CC=C4   11.529
*29539 CC(C1=C2C=CC=CC2=CC=C1OC(C)=O)C3=C4C=CC=CC4=CC=C3OC(C)=O    9.056
*29540 O=C(COC1=CC2=C(C=CC=C2)C=C1)OCCOC(=O)COC3=CC4=C(C=CC=C4)C=C3   11.305
*29582 CC1=CC=C(C=C1)N=C(C(C2=CC=CC=C2)C3=CC=CC=C3)N4CCCCC4    8.225
*29607 CCOC1=C(C=CC=C1)N(CCN(C)C)C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3   13.371
*29612 O=C(CCCSCCCC(=O)NN=CC=CC1=CC=CC=C1)NN=CC=CC2=CC=CC=C2   14.656
*29627 CC(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C    7.721
*29636 C[C]12CCC(=O)C=C1CC[CH]3[CH]4CC[C](O)(C(=O)COC(=O)C5=CC=CO5)[C]4(C)C[CH](O)[CH]23   11.910
*29642 O=C(OCCN(CCOC(=O)C1=CC=CC=C1)CCC2CCCCC2)C3=CC=CC=C3   10.339
*29643 CCOC(=O)NC1=CC=C(C=C1)C(=O)[CH]([CH](N2CCOCC2)C3=CC=CC=C3)N4CCOCC4   20.886
*29668 COC(=O)C=C1CC[CH]2[CH]3CC=C4C=C(CC[C]4(C)[CH]3C(=O)C[C]12C)N5CCCC5    9.738
*29683 CCCCCCCCCCCCN[CH](C(=O)C1=CC=CC=C1)C2=CC=CC=C2    7.094
*29685 CCN(CC)CC1=CC(=CC(=C1O)C2=CC=CC=C2)[CH]3C[CH](C)CC(C)(C)C3    9.710
*29694 CCN(CC)C1=C(C)C(=CC=C1)NC(=O)OCCOC(=O)NC2=C(C)C(=CC=C2)N(CC)CC   13.886
*29734 CCCCCCCCCCCCCCCCCCNC(=S)NN=CC1=C(C=CC=C1)[N+]([O-])=O    7.438
*29740 CCCCCCCCCCCCCCCCCC(=O)C1=CC=C(OC)C(=C1)OC    5.496
*29766 CCCCCCCCCCCC(=O)NCCNC(=O)CCCCCCCCCCC    8.303
*29775 OC1(C2=C(C=CC=C2)C3=CC=CC=C13)C4=C5C=CC=CC5=C6C=CC=CC6=C4   11.327
*29794 O=C1C2=CC=CC=C2C3=C1C=C(C=C3)N(CC4=CC=CC=C4)CC5=CC=CC=C5   10.154
*29813 CC1=CC=C(N[CH](C2=CC=CC=C2)C(O)(C3=CC=CC=C3)C4=CC=CC=C4)C=C1   12.928
*29836 C1CCN(CC1)CCOC2=CC=C(CC3C4=C(C=CC=C4)C5=CC=CC=C35)C=C2    9.143
*29838 O=C(OCCN1CCCCC1)[CH](C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=CC=C4   10.225
*29869 CCCCN(C[CH](O)C1=C2C=CC=CC2=C3CCCCC3=C1)CC4=CC=CC=C4   11.602
*29903 CC(C)(C1=CC=CC=C1)C2=CC(=C(O)C(=C2)CN3CCCCC3)CN4CCCCC4   13.551
*29907 CCCCCC(=O)OCC(=O)[C]1(O)CC[CH]2[CH]3CCC4=CC(=O)CC[C]4(C)[CH]3C(=O)C[C]12C   12.695
*29916 CCCCCCCC(CCCCCCCC1=CC(=CC=C1)O)C2=CC=C(O)C=C2    9.562
*29924 CCCCN(CCCC)CC1=CC2=C(CC[CH]3[CH]2CC[C]4(C)[CH]3CCC4=O)C=C1O   11.943
*29940 CC(C)(C)CC(=O)OCC(=O)[C]1(O)CC[CH]2[CH]3CC[CH]4CC(=O)CC[C]4(C)[CH]3[CH](O)C[C]12C   10.456
*29948 C[CH]1CC[C]2(OC1)O[CH]3C[CH]4[CH]5CC[CH]6C[CH](O)CC[C]6(C)[CH]5CC[C]4(C)[CH]3[CH]2C    8.812
*29971 COC1=CC2=C(C=C1)N(CCCCCCCN(CCC(C)C)CCC(C)C)CCC2    7.067
*29979 CC(C)CCC[CH](C)[CH]1CC[CH]2[CH]3[CH](O)C[CH]4[CH](O)CCC[C]4(C)[CH]3CC[C]12C    5.230
*30003 NC1=C2C(=O)C3=CC=CC(=C3C(=O)C2=CC=C1)NC4=CC5=C(C=C4)C(=O)C6=CC=CC=C6C5=O   21.889
*30038 O=C(C1=CC=CC=C1)C2=CC=C(OCCOC3=CC=C(C=C3)C(=O)C4=CC=CC=C4)C=C2   12.623
*30059 CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(NS(=O)(=O)C4=CC=C(NC(C)=O)C=C4)C=C3   24.014
*30074 O=S1(=O)CCN(CC1)C2=C(CC(C3=CNC4=C3C=CC=C4)C5=CNC6=C5C=CC=C6)C=CC=C2   17.959
*30104 O=C(OC(=O)[CH](C1CCCCC1)C2=CC=CC=C2)[CH](C3CCCCC3)C4=CC=CC=C4    5.870
*30112 CCC(C)(C)C1=CC=C(NC2=CC=C(NC3=CC=C(C=C3)C(C)(C)CC)C=C2)C=C1    8.618
*30114 C(CCCCC[N+]1=CC2=CC=CC=C2C=C1)CCCC[N+]3=CC4=C(C=CC=C4)C=C3   13.426
*30148 CCCCCN(CCCCC)C[CH](OC(C)=O)C1=C2C=CC=CC2=C3CCCCC3=C1    8.080
*30159 CC(C)(C)C1=C(O)C(=CC(=C1)C2=CC(=C(O)C(=C2)C(C)(C)C)C(C)(C)C)C(C)(C)C    9.701
*30170 OCC[N+]1(CCC(CC1)C2CC[N+](CCO)(CC2)CC3=CC=CC=C3)CC4=CC=CC=C4   25.690
*30206 CCCCCCCCN(CCCCCCCC)C[CH](O)CN1CCCC2=C1C=CC=C2   10.030
*30214 CO[CH]1CC[C]2(C)[CH]3CC[C]4(C)[CH](CC[CH]4[CH]3C[CH](O)[C]2(O)C1)[CH](C)CCCC(C)C    7.162
*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
*30308 C[CH]1CC[C]2(OC1)O[CH]3C[CH]4[CH]5CC=C6C[CH](CC[C]6(C)[CH]5CC[C]4(C)[CH]3[CH]2C)OC(C)=O    6.983
*30311 CCCCC[CH](C[N+](C)(C)CC=CC1=CC=CC=C1)[CH](O)C2=CC=C(CCCC)C=C2   18.067
*30313 CCN(CC)CCCOC1=CC=C(C=C1)C(C)(C)C2=CC=C(OCCCN(CC)CC)C=C2   11.154
*30347 CCCC[CH](CC)CC[CH](CC(C)C)NC(=S)N[CH](CC[CH](CC)CCCC)CC(C)C    2.921
*30358 NC1=CC2=C(C=C1)N=C3C=C(NC4=CC=CC=C4)C(C=C3N2C5=CC=CC=C5)=NC6=CC=CC=C6   14.481
*30396 COC1=CC=C(C[CH](N=CC2=CC=C(OC)C=C2)C(=O)N[CH]3[CH](O)[CH](O[CH]3CO)N4C=NC5=C(N=CN=C45)N(C)C)C=C1   29.740
*30404 CC(=O)OC=C(C)[CH]1CC[CH]2[C]1(C)CC=C3[C]4(C)CC[CH](C[C]45C=C[C]23[CH]6[CH]5C(=O)OC6=O)OC(C)=O    8.317
*30413 CCN(CC)CCN(C)C[CH](N(C)C(=O)C(C1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3   16.664
*30432 CC(C)(C)C1=C(O)C(=CC(=C1)C=CC2=CC(=C(O)C(=C2)C(C)(C)C)C(C)(C)C)C(C)(C)C   10.225
*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
*30511 CCN(CC)CCOC(=O)C1=CC=C(NC(=O)OCCCOC(=O)NC2=CC=C(C=C2)C(=O)OCCN(CC)CC)C=C1   20.996
*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
*30563 CC1=CC=C(C=C1)S(=O)(=O)C[CH]2[CH](CS(=O)(=O)C3=CC=C(C)C=C3)C4C5=C(C=CC=C5)C2C6=C4C=CC=C6   13.032
*30580 CC(C)(C)C1=C2CN(COC2=C(C3=C1OCN(CC4=CC=CC=C4)C3)C(C)(C)C)CC5=CC=CC=C5   10.967
*30603 CC(C)CCC[CH](C)[CH]1CC[CH]2[CH]3CC=C4C[CH](CC[C]4(C)[CH]3CC[C]12C)[N+]5=CC=CC=C5    8.030
*30652 CC(C)CCC[CH](C)[CH]1CC[CH]2[CH]3CC=C4C[CH](CC[C]4(C)[CH]3CC[C]12C)OC(=O)CCCCC(O)=O    6.724
*30675 NC1=C2C=CC=CC2=C(C=C1)N=NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)N=NC5=C6C=CC=CC6=C(N)C=C5)S(O)(=O)=O)S(O)(=O)=O   30.622
*30694 CC1=CC(=CC=C1N=NC2=C(N)C3=C(C=CC=C3)C(=C2)S(O)(=O)=O)C4=CC(=C(C=C4)N=NC5=C(N)C(=CC6=C5C=CC(=C6)S(O)(=O)=O)S(O)(=O)=O)C   36.342
*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
*30750 CCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCC    8.889
*30759 CC1=CC(=CC=C1N=NC2=CC3=C(C=CC=C3S(O)(=O)=O)C(=C2)S(O)(=O)=O)NC(=O)NC4=CC(=C(C=C4)N=NC5=CC(=C6C=CC=C(C6=C5)S(O)(=O)=O)S(O)(=O)=O)C   42.340
*30794 C1=CC=C(C=C1)C=C2C(=C(C3=CC=CC=C3)C(=C2C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6    8.053
*30852 CC(=C)[CH]1CC[C]2(C)CC[C]3(C)[CH](CC[CH]4[C]5(C)CC[CH](OC(=O)C6=CC=CC=C6)C(C)(C)[CH]5CC[C]34C)[CH]12    2.726
*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
*30903 CCCCCC[CH](O)CC=CCCCCCCCC(=O)OCCCOC(=O)CCCCCCCC=CC[CH](O)CCCCCC    8.181
*30968 CC[C]1(O)C[CH](O[CH]2C[CH]([CH](O[CH]3C[CH]4O[CH]5CC(=O)[CH](C)O[CH]5O[CH]4[CH](C)O3)[CH](C)O2)N(C)C)C6=C(O)C7=C(C=C6[CH]1C(=O)OC)C(=O)C8=C(O)C=CC(=C8C7=O)O   37.648
