1938
*15 ONC=N    9.342
*17 NC(=O)NO   10.266
*20 NC(=N)NN=O   11.539
*24 COS(O)(=O)=O    8.090
*30 NC(S(O)(=O)=O)S(O)(=O)=O   15.983
*51 N=C1NN=CO1    8.627
*61 CC([N+]([O-])=O)[N+]([O-])=O    7.495
*72 O=C1NNC(=O)NN1   17.521
*170 CNC(=N)NN(O)O   18.065
*189 O=C1OC=CO1    1.963
*222 N=C1NC=CS1    7.983
*226 NC1=NC(=NC(=N1)S)S    4.668
*242 OCCC#N    8.830
*244 NC(=O)C=C    8.229
*250 OC(=O)CNC(S)=S    7.582
*256 S=C1NCCS1    4.631
*297 CCC1=NN=NN1    6.048
*306 CCC=O    4.045
*312 CCOC(S)=S    4.585
*314 CCOC=O    3.496
*323 C1OCOCO1    6.706
*331 OC(=O)CCS(O)(=O)=O   12.907
*355 N[CH](CS)C(O)=O   10.276
*383 CCC(=O)NN   10.208
*385 NC(=O)NCCS   10.424
*393 CNC(=S)NC    6.119
*395 NNC(=O)CC(=O)NN   16.328
*413 COCCO    7.378
*422 CS(=O)(=O)CS(C)(=O)=O    9.277
*425 CCNC    4.656
*453 CCN(CC)[N+]([O-])=O    5.249
*473 CC(C)(C)O    5.000
*476 CSCCCO    7.296
*482 CCOCCO    7.255
*491 CCCCS(O)(=O)=O    7.530
*508 CC(CS)CS    3.664
*545 CNCCNC    8.302
*662 NS(=O)(=O)C1=CC=CS1    6.640
*718 C[CH](C#N)C(N)=O   11.210
*730 OC1=C2CSC[N+]2=NO1   15.699
*764 NNC1=C(C(=NC=N1)N)[N+]([O-])=O   14.541
*765 N=C1NC(=N)N2C(=N)NNC2=N1   20.815
*854 OC(=O)CNCC(O)=O   12.437
*865 CC1=NC(=NC(=N1)N)N    9.228
*874 NC1=C(N)C(=NC(=N1)S)N   15.313
*917 CCCC1=NN=NN1    5.924
*927 NC(=S)NN=CC=NNC(N)=S   11.492
*945 CC1OCCO1    4.529
*1013 CSC[CH](N)C(O)=O   10.799
*1034 CCOC(=O)CON    7.305
*1039 OCC(CO)(CO)[N+]([O-])=O   11.317
*1045 CN1CSCSC1    3.520
*1047 CN1CNC(=O)NC1    7.538
*1055 CCOC(=O)NNC(N)=O   13.635
*1071 CC(CC(C)=NO)=NO    9.083
*1159 OC[CH](O)[CH](O)[CH](O)C=O    8.917
*1201 CNC(=O)OC(C)C    6.815
*1226 C[CH](O)C(C)(C)[N+]([O-])=O    8.321
*1231 OCCNCCC(O)=O   14.099
*1248 NCCN1CCNC1=O   12.633
*1255 COC(=O)NCCSC(N)=N   14.420
*1256 NNC(=O)CC[CH](N)C(O)=O   17.900
*1271 CCOC(=N)N(C)C    7.770
*1292 CS(=O)(=O)N(CCCN(N=O)S(C)(=O)=O)N=O   11.103
*1308 CC(C)(CO)CO    6.514
*1315 CC(C)CCS(O)(=O)=O    7.408
*1323 CCS(=O)(=O)CS(=O)(=O)CC    9.031
*1328 COS(=O)(=O)CCCS(=O)(=O)OC    9.410
*1331 CCC(C)(C)N    4.629
*1374 CC(C)CNC(=N)NN(O)O   17.697
*1376 N#CC1=CC=CO1    4.285
*1381 OC1=NC(=C(C=N1)C#N)O   15.516
*1400 OC1=C(C=NC=C1)[N+]([O-])=O    8.039
*1406 ON=CC1=CC=C(O1)[N+]([O-])=O    8.851
*1407 OC(=O)C1=C(O)N=C(O)N=C1   15.096
*1416 OC1=C2C=NNC2=NC=N1   13.693
*1421 OC1=C2C=NNC2=NC(=N1)S   13.116
*1428 OC1=C2NC(=S)NC2=NC(=N1)S   13.333
*1434 OC1=C2NC(=O)NC2=NC=N1   16.547
*1435 CN1C=NC(=C1C#N)[N+]([O-])=O    8.516
*1460 OC(=O)C1=CC=CS1    7.230
*1472 [O-][N+]1=CC=CC=C1S    9.575
*1485 ONC(=O)C1=CC=CO1   11.354
*1491 OS(=O)(=O)C1=CC=[N+]([O-])C=C1   16.483
*1530 NC1=C2C=NNC2=NC(=N1)S   12.585
*1534 CC1=NC(=N)C2=NSNC2=N1    8.072
*1537 CC(=C)C#C    1.519
*1561 CC1=CC(=NC(=N1)O)O   13.457
*1566 NNC(=O)C1=CC=CO1   11.035
*1572 NS(=O)(=O)C1=CC=CN=C1    9.257
*1608 NNC(=O)C1=CC(=NC(=N1)O)O   22.265
*1616 NC1=C2NC=NC2=C(N)N=N1   16.613
*1623 COC1=C2N=NNC2=NC(=N1)N   10.270
*1625 NC1=NC(=C2NC(=S)NC2=N1)N   13.281
*1678 N[N]1=CC=CC=C1    8.019
*1711 NC(=O)NNC1(O)C(=O)NC(=O)NC1=O   24.684
*1722 N#CN1CCCC1    3.907
*1723 CN1N=C(C)CC1=O    7.416
*1736 NC(=O)CC(=C)C(N)=O   11.654
*1738 C[CH]1CC(=O)NC(=O)N1    9.857
*1749 C[CH]1CNC(=S)SSC(=S)N1    5.488
*1761 CSC1=NC(=CC(=N1)N)N   12.384
*1780 CC(C)=CC(O)=O    6.149
*1784 COC(=O)C(C)=C    3.839
*1805 CC1=CCS(=O)(=O)C1    5.175
*1811 CO12CC1OC(=O)C2    8.475
*1842 CON=C(C)C(C)=O    4.597
*1843 O=CN1CCOCC1    9.296
*1844 CC(=O)C(N)C(C)=O   10.165
*1852 CN(C)C(=S)SCC(O)=O    9.061
*1859 CCOC(=O)CC(N)=O   10.451
*1861 O[CH]1CN[CH](C1)C(O)=O   13.154
*1867 CC(=O)OC[CH](N)C(O)=O   11.450
*1886 NC(=N)N[CH](CC(O)=O)C(O)=O   19.124
*1911 C=CCN(CC=C)N=O    5.450
*1932 CCNC1=C(N)C=NC=N1   11.975
*1935 NC(=O)C1=C(N)N(CCO)N=C1   18.256
*1957 O=CC1CCCC1    4.032
*1967 CCC(C)=CC(O)=O    6.026
*1968 CCOC(=O)C=CC    3.717
*1981 CCCC(=O)C(C)=O    6.458
*2024 CCOC(=O)C(=O)OCC    5.362
*2037 OC(=O)CCSSCCC(O)=O   12.928
*2043 OC[CH]1C[C](O)(CO)C(=O)O1    7.424
*2063 CC(C)(C)CC#N    4.023
*2077 OC[CH](C=C)N1CC1    8.987
*2133 OC(=O)CCNCCC(O)=O   14.790
*2138 CC(C)(CCO[N+]([O-])=O)C(O)=O    8.339
*2156 C1CCN(CC1)C2=NN=NN2    8.000
*2161 CC(C)CC=C    0.445
*2163 CC1CCCC1    0.593
*2186 OCCNC(=S)C(=S)NCCO   14.317
*2196 [O-][N+](=O)CCCCCC[N+]([O-])=O    7.003
*2222 C1N2CN3CN1CN(C2)C3    0.788
*2232 CC(C)COC=C    1.873
*2252 O[CH](CC=C([CH](O)S(O)(=O)=O)[CH](O)S(O)(=O)=O)S(O)(=O)=O   28.113
*2275 CCC(C)(C)C(O)=O    5.770
*2307 CCC(=O)C(OC)OC    6.495
*2308 COC(=O)CCSCCO    9.917
*2325 CC(C)COC(=O)CS(O)(=O)=O   10.154
*2372 CCN(CC)COC(S)=S    6.466
*2376 CN(C)CCOC(C)=O    6.939
*2393 CCOC(=O)C(C)(C)N    6.075
*2406 CCSCC[CH](N)C(O)=O   10.551
*2469 N[CH]1CCCC[CH]1N    8.848
*2484 CC[CH](C)[CH](NN)C(O)=O   10.836
*2494 NNC(=O)[CH](O)[CH](O)[CH](O)[CH](O)CO   16.393
*2542 CC(C)OC[CH](O)CO    8.446
*2556 CS(=O)(=O)OCCCCOS(C)(=O)=O    9.287
*2574 CN(C)C(C)(C)C    4.069
*2583 CC(C)[CH](O)[CH](C)N    8.943
*2593 CC(C)N(C)CCO    8.506
*2606 NC[CH](O)[CH](O)[CH](O)[CH](O)CO   14.690
*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
*2663 OC(=O)C1=COC(=O)C=C1    8.842
*2666 OC(=O)C1=CC=C(O1)C(O)=O   11.662
*2673 OC(=O)C1=CC=NC=C1    9.848
*2707 OC1=C2N=CNC2=CC=N1   13.302
*2762 CC1=CC(=CC=[N+]1[O-])[N+]([O-])=O   12.513
*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
*2815 CN1C=NC2=C(O)N=C(O)N=C12   16.338
*2824 CSC1=NC2=C(O)N=C(O)N=C2N1   19.203
*2848 CC1=NC2=C(N)N=CN=C2S1   13.102
*2870 OC1=CC(=C(O)C=C1)O   14.217
*2877 OCC1=CC=C(O1)C=O    9.267
*2900 CC1=CC=NC=C1    5.109
*2912 CC1=CC=C(O)C=N1    9.092
*2915 OCC1=CC=NC=C1    9.545
*2926 NC1=CC(=CC(=C1)O)O   13.686
*2935 C=CCOC(=O)OCC#N    2.652
*2942 OC(=O)CCC(=O)CSC#N   12.536
*2943 NS(=O)(=O)C1=CC=C(O)C=C1   10.358
*2962 ONC(=N)C1=CC=CN=C1   13.318
*2975 NC1=CC=C(C=C1N)[N+]([O-])=O   11.577
*2993 CC1=CC(=O)N(NC(N)=O)C1=O   17.558
*3001 CN1C=NC(=C1SCC(O)=O)[N+]([O-])=O   13.164
*3002 NC(=N)SC1=CC=CC=N1   10.607
*3006 CC1=NC(=C2C=NNC2=N1)N   13.119
*3030 CS(=O)(=O)C1=NC(=C2N=CNC2=N1)N   15.199
*3049 NC1=CC(=CC=C1)N    9.172
*3089 CC1=C(CO)C(=NC(=N1)O)O   17.851
*3092 CC[C]1(NC(=O)NC1=O)C=O   11.593
*3117 CC(C)=C1NC(=S)NC1=S    5.963
*3123 O=NN(CCC#N)CCC#N   12.205
*3131 NNC(=O)C1=CC=C(O1)C(=O)NN   16.600
*3145 CNC1=C2N=NN(C)C2=NC=N1   11.879
*3186 CCC(=CC(O)=O)C(O)=O   11.551
*3205 CCN1C=CC=C1    3.590
*3206 C=CCOCCC#N    6.206
*3225 CCCOC(=O)CSC#N    6.735
*3232 OCCN1C(=O)CCC1=O   11.569
*3255 CCSC1=CC(=NC(=N1)N)O    9.242
*3287 ON(O)NC(=N)NN=CC1=CC=CO1   19.073
*3289 NNC(=S)NN=CC1=CC=CN1   12.620
*3305 COC1=C(N)C=C(N)C=C1   10.400
*3312 CC(=O)C1=C(C)NN=C1C    8.087
*3330 NCC1=CC=C(C=C1)S(N)(=O)=O   10.320
*3356 OC(=O)CN1CSC(=S)N(C1)CC(O)=O   10.203
*3365 NC1=NC(=C2CCCC2=N1)N    9.035
*3375 CC(=NNC(N)=S)C1=CC=CN1   10.118
*3404 CC=CC(=O)OCC=C    3.721
*3423 C[CH]1C[CH](C(C)=O)C(=O)O1    7.038
*3451 CC1=CC=CC=[N+]1C    9.780
*3454 CCN(C)C1=CC=CO1    3.947
*3479 CC1=N[CH](C(O)=O)C(C)(C)S1    8.101
*3526 C[CH]1CCC=CC1    1.056
*3535 C1CN(CCO1)C2=NCCS2   10.111
*3546 COC(=O)CCNC(=O)N1CC1   11.269
*3549 COC(OC)[C]1(C)NC(=O)NC1=O   11.721
*3580 C1CC[CH]2OC[CH]2C1    4.060
*3581 CC(=O)C1CCCC1    4.168
*3586 OC(=O)C1CCCCC1    6.002
*3615 CCOC(=O)[CH](O)C=CC    4.127
*3619 COC(=O)[CH]1CC[CH](O)C1    8.057
*3642 O[CH]1CC(O)(C[CH](O)C1O)C(O)=O   11.120
*3644 OC1[CH](O)[CH](O)C2(CO2)[CH](O)[CH]1O   13.845
*3648 OC[CH](O)[CH](O)[CH]1OC(=O)[CH](O)[CH]1O   10.174
*3659 C[CH]1CCC(CC1)=NO    4.971
*3667 C[CH](O)C(=O)NCC(C)=C    7.979
*3671 OC(=O)CN1CCCCC1    8.253
*3696 OC(=O)CCN1CCOCC1   11.607
*3700 CC(C[CH]1CCS(=O)(=O)C1)=NO    9.166
*3708 N[CH](CCCC(O)=O)CC(O)=O   14.886
*3717 CCCCCCSC#N    3.742
*3729 CN1CSC(=S)NCCNC(=S)SC1    5.735
*3749 CCN(CN(CC)C=O)C=O    7.185
*3758 OCCN1CSC(=S)N(CCO)C1    8.174
*3762 CCOC(=O)CC[CH](N)C(N)=O   12.893
*3764 CCOC(=O)N(N=O)C(C)(C)C    7.476
*3768 N[CH](CCC[CH](N)C(O)=O)C(O)=O   16.273
*3770 CCCCN1CCNC1=S    5.764
*3794 CC(C)(C)SCCC=O    5.648
*3813 CCC(CC)OC(C)=O    3.264
*3826 CC(C)SCCCC(O)=O    7.740
*3828 CCC[CH](C)OCC(O)=O    6.851
*3834 CCOCC(=O)COCC    6.222
*3872 CC1CCC(N)CC1    4.738
*3877 CCCCCCC(N)=O    7.336
*3894 CC(C)NC(=O)C(C)C    7.117
*3927 CSCCCC[CH](N)C(O)=O   10.428
*3930 CCOC(=O)[CH](N)CCSC    8.047
*3948 CCCCCCSC(N)=S    4.000
*3953 CCC(C)(C)NC(=O)NC(N)=O   11.860
*3970 CN1CCN(CCO)CC1   12.288
*3988 ON(O)NC(=N)NC1CCCCC1   17.807
*4001 CCC(O)(CC)CC    4.631
*4004 CC[CH](C)C(C)(C)O    4.631
*4018 CCOS(=O)(=O)CC(C)(C)C    4.780
*4035 CC[CH](C)C[CH](C)N    4.382
*4043 CC[CH](N)[CH](O)C(C)C    8.818
*4049 CCCCN(C)CCO    8.382
*4054 CC(=O)SCC[N+](C)(C)C   15.529
*4066 NCNC1=NC(=NC(=N1)NCN)N(CN)CN   16.338
*4087 [O-][N+](=O)C1=CC=CC(=C1)N=C=O    6.037
*4108 O=C1NC2=CC=CC=C2O1    7.437
*4133 OC(=O)C1=CC(=CC=C1O)[N+]([O-])=O   10.252
*4136 OC(=O)C=CC1=CC=C(O1)[N+]([O-])=O   10.293
*4137 OC(=O)C1=CC(=C(C=C1)[N+]([O-])=O)O    9.851
*4141 S=C=NC1=CC=CC=C1    3.107
*4153 [O-][N+](=O)C1=C(NC#N)C=CC=C1    5.801
*4154 [O-][N+](=O)C1=CC2=C(C=C1)C=NN2    8.848
*4172 N#CCSC1=C2N=CNC2=NC=N1   13.030
*4175 NC1=CC=CC(=C1)C#N    7.735
*4242 O=CC1=CC=CC=C1    4.873
*4249 O=CC=CC1=CC=CO1    5.796
*4261 OC(=O)C=CC1=CC=CO1    7.889
*4268 OC(=O)C1=CC(=C(O)C=C1)O   14.932
*4289 C=CC1=CC=CC=N1    5.441
*4293 NC(=O)C1=CC=CC=C1    8.656
*4319 O=NOCC1=CC=CC=C1    5.277
*4324 NC1=CC(=C(C=C1)C(O)=O)O   11.299
*4325 CC1=CC(=C(C=C1)[N+]([O-])=O)O    5.112
*4332 OCC1=CC=C(C=C1)[N+]([O-])=O    9.067
*4346 ONC1=CC=C(C=C1)C(O)=O   13.115
*4369 CN1N=NC2=C1C=CC=C2    5.504
*4407 NC(=O)CSC1=C2N=CNC2=NC=N1   16.466
*4424 NN=CC1=CC=CC=C1    6.128
*4428 NC1=CC=CC(=C1)NC=O   11.524
*4436 CC1=C(C=NC=C1)C(N)=O   11.495
*4496 NC(=S)CC1=CC=CC=N1    9.167
*4512 CC1=NC2=C(CNC(=O)N2)C=N1   13.014
*4575 CN1C(=O)N(C)C2=C(N=C(NN=O)N2)C1=O   16.135
*4589 CC1=CC(=CC(=C1)O)O   10.191
*4597 CS(=O)(=O)C1=CC=CC=C1    5.903
*4672 NS(=O)(=O)CC1=CC=CC=C1    6.767
*4708 CN(CC1=CC=NC=C1)N=O    9.664
*4732 CC1=C(SC=C1)C=NNC(N)=S    7.690
*4761 CN1C(=O)N(C)C2=C(NC(=N)N2)C1=O   14.232
*4797 CCOC(CC)=C(C#N)C#N    7.104
*4798 CC1=CC=C(C=N1)C(C)=NO    9.164
*4844 OCCNC1=C(C=CC=C1)[N+]([O-])=O   10.757
*4846 COC1=CC(=C(C)C=C1N)[N+]([O-])=O    9.310
*4850 CC(=O)NS(=O)(=O)C1=CC=C(N)C=C1   12.315
*4854 CCOC(=O)C1=C(O)N=C(SC)N=C1    8.431
*4931 CC1=C(C)C=C(O)C=C1    6.166
*4939 COCC1=CC=CC=C1    4.157
*4962 CC1=C(O)C(=CC(=C1)O)C   10.149
*4966 COC1=CC(=CC=C1O)CO   11.873
*4987 SCCC1=CC=CC=C1    3.553
*5006 NCCC1=CC=CC=C1    6.090
*5011 CC1=C(C)C=C(N)C=C1    5.635
*5014 N#C[CH]1C[CH]2CC[CH]1C2    4.488
*5057 CCOC(=O)C1=CNC=C1C    7.068
*5059 CCCOC(=O)N1C=CC=C1    4.593
*5067 CC1=CC(=C(C)C=C1)S(N)(=O)=O    6.289
*5074 ON1C(=O)[CH]2CCCC[CH]2C1=O   10.158
*5091 CCOC(=O)[CH]1CN(C)C(=O)C1=O   12.524
*5104 NC1=CC2=C(NCCN2)C=C1   12.297
*5105 NNC(=O)CCC1=CC=NC=C1   14.184
*5111 CC1=CC=CC(=C1)NNC(N)=O   12.032
*5152 OCCCNC1=C2C=NNC2=NC=N1   17.011
*5156 CN1C(=O)N(C)C2=C(N(C)C(=N)N2)C1=O   13.889
*5163 NC(=N)NC(=N)NC1=CC=C(C=C1)S(O)(=O)=O   22.389
*5175 CCC1=C(N)C=C(C)N=C1    8.395
*5188 CC[N+]1=CC=CC(=C1)C(N)=O   16.086
*5195 O=C=NCCCCCCN=C=O    4.319
*5223 CCOC(=O)C(CCCC#N)=NO    9.567
*5232 ON1C(=O)N[CH]2CCCC[CH]2C1=O   11.712
*5262 CCN(CC)C1=C2N=NNC2=NC=N1   11.652
*5267 CCCCN1N=NC2=C1N=C(N)N=C2O   12.287
*5278 C[C](O)(C#C)C1CCC1    5.971
*5285 CC1(C)CC(=CC(=C1)O)O    4.903
*5299 CC(=O)OC1=CCCCC1    2.654
*5301 CC(=C)COC(=O)C(C)=C    3.526
*5308 CC(=O)OC(C)=C(C)C(C)=O    5.917
*5310 CCC(=O)C(C)=C1OCCO1    5.983
*5311 COC(=O)C1CCC(=O)CC1    6.914
*5317 C=CC(=O)OC[CH]1CCCO1    6.851
*5319 CCCC[CH]1CC(=O)OC1=O    4.312
*5350 C1C=CC[N+]12CC=CC2   12.910
*5361 C=COCCN1CCCC1=O    8.487
*5365 COC(=O)C1=CCCN(C)C1    7.305
*5370 OCC1=CCN2CC[CH](O)[CH]12   10.391
*5398 NC(=O)[CH]1OCO[CH]2[CH](CO)OCO[CH]12   19.030
*5431 CNC1(CCCCC1)C#N    7.903
*5441 CC1(C)NC(=O)C(C)(C)NC1=O    8.273
*5459 COC(OC)[C]1(C)NC(=O)N(C)C1=O   11.380
*5486 CC(=O)C1CCCCC1    4.045
*5496 CC(C)(C)[C](C)(O)C#C    5.616
*5520 OC1[CH]2CCC[CH]1COC2    8.375
*5559 CC(C)OC(=O)CCC(C)=O    6.559
*5574 CCOC(=O)CCC(=O)OCC    6.010
*5583 CC(=O)OCCSCCOC(C)=O    8.105
*5588 COCOCCO[CH](C)C(=O)C=O   10.567
*5591 OC[CH]1OCO[CH]2[CH](CO)OCO[CH]12   14.376
*5618 NC(=O)CC1CCCCC1    7.569
*5627 CC[CH]1CS[CH](CC)C(=O)N1    9.445
*5642 CN(C)CCOC(=O)C(C)=C    7.020
*5645 C=COCCN1CCOCC1    7.587
*5670 CCOC(=O)CNCC(=O)OCC    7.179
*5675 CCOC(=O)CNC(=O)OC(C)C    8.015
*5679 CCOC(=O)CNC(=O)OC[CH](C)O   12.452
*5702 CCN(CC)CCCC#N    7.327
*5711 CC[CH]1CC[CH](C)N(C1)N=O    5.304
*5772 C[CH]1CCCC[CH]1CO    5.064
*5788 CSC(=S)O[CH](C)CC(C)C    4.614
*5828 CCC(C)(C)SCCC(O)=O    7.618
*5834 CCOCCOCOCC=C    5.863
*5840 CC(C)(C)C[C](C)(O)C(O)=O    6.330
*5849 CC(C)CC(=O)OC[CH](O)CO    9.015
*5851 CCS(=O)(=O)C(CC=C)S(=O)(=O)CC    8.788
*5854 OC[CH](O)[CH]1OCO[CH]([CH](O)CO)[CH]1O   14.221
*5862 CCCCN=CCCC    1.575
*5901 CN(C)[CH]1CCCC[CH]1O    8.614
*5918 CCCCCCCOC(N)=O    6.664
*5923 CC(C)C(=O)OCCN(C)C    6.693
*5974 CCCCCC[CH]1CS(=O)(=O)NN1    7.330
*5988 CCCCOCCCC    2.326
*5997 CCCCSCCCCO    6.804
*6013 CCOCC[CH](O)COCC    8.818
*6036 CC(C)(C)CC(C)(C)N    4.259
*6040 CCN(CC)CC[CH](C)O    8.259
*6049 CCCCOCCOCCN    8.369
*6117 [O-][N+](=O)C1=CC2=C(C=CC=C2)N=N1    8.955
*6153 NC1=CC=CC2=C1C(=O)NC2=O   11.442
*6176 SC1=NC2=C(C=CC=C2)N=C1S    5.393
*6194 OC(=O)C1=CC=C(C=O)C=C1    9.569
*6200 OC(=O)C1=CC2=C(OCO2)C=C1    9.900
*6236 ON=CC(=O)C1=CC=CC=C1    7.928
*6237 O[CH]1C(=O)NC2=C1C=CC=C2    9.452
*6239 NC1=CC2=C(COC2=O)C=C1    8.347
*6264 CC1=CC=CC(=C1[N+]([O-])=O)C(O)=O    9.326
*6266 COC1=CC(=C(C=C1)[N+]([O-])=O)C=O    8.504
*6274 COC1=CC(=C(C=C1O)[N+]([O-])=O)C=O   12.487
*6277 COC1=C(C=C(C=O)C=C1O)[N+]([O-])=O   12.487
*6286 NC1=CC2=C(C=CS2)C=C1    6.996
*6315 CCC1=C(C(=C(C=C1[N+]([O-])=O)[N+]([O-])=O)O)[N+]([O-])=O    9.796
*6321 NC(=O)NNC(=O)C1=CC(=CC(=C1)[N+]([O-])=O)[N+]([O-])=O   19.818
*6324 NC1=NC2=NC3=NC(=NC(=C3N=C2C(=N1)N)N)N   24.345
*6325 CC1=CC2=C(NC=N2)C=C1    6.393
*6332 CC1=CC=C2NC(=O)NC2=C1    9.254
*6333 O=C1CCN2C=CC=CC2=N1    8.745
*6349 NC(=S)NC1=CC=C(C=C1)C(O)=O   11.757
*6352 CC(=O)NC1=CC(=CC=C1)[N+]([O-])=O   10.613
*6360 NC(=O)CC1=CC=C(C=C1)[N+]([O-])=O   11.449
*6362 NC1=CC=C(NC(=O)C(O)=O)C=C1   16.018
*6381 COC1=CC(=C(C=C1OC)[N+]([O-])=O)[N+]([O-])=O    9.532
*6415 NC(=S)NNC(=O)C1=CC=C(C=C1)[N+]([O-])=O   14.777
*6458 CC1=CC(=O)C=C(C)C1=O    8.523
*6459 CC(=O)OC1=CC=CC=C1    4.188
*6471 COC(=O)C1=CC=C(S)C=C1    5.472
*6508 O=C1OC(=O)[CH]2CC=CC[CH]12    4.724
*6509 CC1=CC=CC(=C1O)C(O)=O    7.804
*6525 CS(=O)(=O)C1=CC(=CC=C1)C(O)=O   10.600
*6532 CC(=O)O[CH]1[CH](OC(C)=O)C(=O)OC1=O    8.350
*6539 N#C[CH]1C[CH]2C[CH]1C=C2    4.544
*6541 CC1=CC=C(C=C1)C(N)=O    8.613
*6543 CC1=CC=CC(=C1)C(N)=O    8.613
*6545 CN(C=O)C1=CC=CC=C1    6.762
*6571 CNC1=C(C=CC=C1)C(O)=O   10.075
*6591 NC(=O)OCC1=CC=CC=C1    8.496
*6604 O=C1NC(=O)[CH]2CC=CC[CH]12    7.516
*6616 COC1=CC=C(C=C1)C(=O)NO   12.582
*6626 CC1=C(O)C(=C(CO)C=N1)C=O   12.987
*6661 COC1=CC=C(C=C1)C=NS(O)(=O)=O    7.886
*6692 [O-][N+]1=C(SC2=NCCN2)C=CC=C1   15.281
*6724 NNC(=S)NN=CC1=CC=CC(=C1)[N+]([O-])=O   12.250
*6741 CCC1=NC2=CC=CC=C2N1    6.270
*6755 CC(=NNC1=CC=CC=C1)C(O)=O    9.000
*6758 O=CNCC(=O)NC1=CC=CC=C1   10.050
*6767 CC1=CC=C(C=C1)[N+]2=NOC(=C2)O   17.016
*6768 CC1=CC=CC(=C1NC=O)NC=O   10.635
*6785 OCCN=CC1=CC=C(C=C1)[N+]([O-])=O   10.125
*6786 CCOC(=O)N(N=O)C1=CC=CC=C1    7.475
*6793 NNC(=O)[CH]1COC2=C(O1)C=CC=C2   13.428
*6819 CCOC(=O)NC1=CC=C(C=C1)[N+]([O-])=O    9.943
*6821 OCC1=CC=C(O1)C=NN2CCOC2=O   12.478
*6835 CN(C)N1N=NC2=C(C=CC=C2)C1=O   11.185
*6844 CCOC(=O)CN1C=NC2=C1N=CN=C2S   10.297
*6863 C=CCOC1=CC=CC=C1    3.379
*6888 CCOC(=O)C1=CC=CC=C1    4.336
*6897 COC1=C(C=CC=C1)C(C)=O    6.237
*6906 OC(=O)CSCC1=CC=CC=C1    9.326
*6908 CCOC1=CC(=CC=C1O)C=O    9.959
*6920 COC1=CC(=C(OC)C=C1)C=O    7.328
*6935 COC1=C(OC)C=C(C=O)C=C1    7.328
*6953 CCOC1=CC(=C(C=C1)C(O)=O)O    8.951
*6957 COC1=C(OC)C=C(C=C1)C(O)=O    9.421
*6970 COC1=CC(=CC(=C1)OC)C(O)=O    9.421
*6974 COC(=O)C1=C(O)C(=CC=C1)OC    6.570
*6980 COC1=C(OC)C(=C(C=C1)C(O)=O)O   10.304
*6981 COC1=CC(=O)C(=C(OC)C1=O)OC    9.460
*6993 CN(C(C)=O)C1=CC=CC=C1    6.900
*7003 CN(C)C(=O)C1=CC=CC=C1    7.971
*7017 OC1=C2NCCCC2=CC=C1    9.551
*7029 COC1=C(NC(C)=O)C=CC=C1    9.438
*7037 CN(C(C)=O)C1=CC=C(O)C=C1   10.879
*7038 CC1=CC(=C(C(=C1)C)[N+]([O-])=O)C    4.544
*7039 CC(C)OC(=O)C1=CC=CN=C1    7.096
*7048 CCNC1=C(C=CC=C1)C(O)=O    9.951
*7056 CCOC(=O)C1=C(C)C=CN=C1    7.177
*7068 COC1=C(N)C=C(C=C1)C(C)=O    9.688
*7072 CC(=O)C[CH](O)C1=CC=CC=N1   12.595
*7086 COCCOC(=O)C1=CC=NC=C1    9.151
*7097 N[C](CO)(C(O)=O)C1=CC=CC=C1   14.356
*7114 CCOC(=O)C1=C(C)C=C(O)N=C1O   12.042
*7139 CC(=O)NC1=NC(=CC=C1)NC(C)=O   13.833
*7159 NC1=NC(=C2C[CH](CCC2=N1)C#N)N   12.294
*7170 NC(=S)NN=CC1=NC(=CC=C1)C=NNC(N)=S   15.550
*7181 C[CH]1CNC2=C(N1)C=CC=C2    8.721
*7202 CC1=CC(=C(C)C=C1)NNC=O   10.367
*7209 CCOC1=CC=C(NC(N)=O)C=C1   10.801
*7216 N[CH](CC1=CC(=CC=C1)N)C(O)=O   13.371
*7235 N[CH](CO)[CH](O)C1=CC=C(C=C1)[N+]([O-])=O   14.245
*7248 OC[CH]1O[CH]([CH](O)[CH]1O)N2C=CC(=O)NC2=O   18.550
*7262 CCNC(=O)NNC(=O)C1=CC=NC=C1   17.428
*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
*7299 CN1C(=O)N(C)C2=C(N(C)C(=N2)NC(N)=O)C1=O   21.074
*7385 CCCC1=CC=C(N)C=C1    5.432
*7398 CC1=C(NCCO)C=CC=C1    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
*7429 O=C1CSC(=S)N1C2CCCCC2    6.983
*7437 COC(OC)C1=CC(=CC=C1)N    8.842
*7442 CC[N+]1=CC=C(C=C1)C(=O)OC   11.889
*7444 O=C(CSC#N)OC1CCCCC1    6.721
*7451 COCC1=C(CO)C=NC(=C1O)C   15.375
*7460 C[CH](CC(O)=O)C(NC(C)=O)(C(O)=O)C(O)=O   21.326
*7463 CN(C)CSC1=CC=CC=C1    4.439
*7479 OC1=NC(=C(CN2CCOCC2)C=N1)O   18.928
*7480 CCCCNC(=O)C1=CC(=NC(=N1)O)O   19.176
*7489 NC1=NC(=NC(=N1)N)[CH]2CCCC=C2    9.025
*7510 CN(C)CCOC1=C2N=CNC2=NC=N1   13.152
*7513 CCCCN1C=NC2=C1N=C(N)N=C2O   11.889
*7516 CNC1=NC2=C(N1C)C(=O)N(C)C(=O)N2C   13.556
*7537 CC1=C(N)C(=C(N)C(=C1)C)C    9.044
*7543 CN(C)CCC1=CC=CC=N1    8.291
*7548 C[CH](CN)C1=C(N)C=CC=C1    9.419
*7551 CCCCC1=C(C)N=C(S)N=C1O    8.487
*7552 CC(=C)C(=O)NCNC(=O)C(C)=C    8.553
*7570 CCCCC[C]1(NC(=O)NC1=O)C=O   11.225
*7581 CCCCNC(=O)NC=C(C(O)=O)C(O)=O   18.801
*7589 CCNC(=S)NC1C(=O)N(C)C(=O)N(C)C1=O   15.815
*7605 O=C1CCC[CH]2CCC[CH]12    4.278
*7610 CC#CC1(O)CCCCC1    6.146
*7641 CC(=O)OC1(CCCCC1)C(O)=O    7.775
*7650 CC(=O)O[CH]1CCC[CH]1OC(C)=O    6.243
*7651 CCOC(=O)[CH]1C[C]1(C)OC(C)=O    6.243
*7656 C[CH](O)C(=O)O[CH](C)C(=O)OCC=C    5.971
*7686 CCCC1(C)CC(=O)NC(=O)C1    6.983
*7707 CCOC1=CC(CCC1)=NNC(N)=O    9.717
*7737 NC(=O)NC(=O)CC1CCCCC1    9.585
*7744 CCC(CC)C(=O)NC(=O)NC(C)=O   11.963
*7752 CC(C)(NC(=O)NC(C)(C)C(N)=O)C#N   17.163
*7778 OC(=O)CCC1CCCCC1    5.757
*7819 COC[C]1(C)COC(=O)[CH](C)C1    5.428
*7840 OC[CH]1[CH](CO)[CH](CO)C(=O)[CH]1CO   12.670
*7842 OCC1(CO)CCC(CO)(CO)C1=O   12.670
*7853 C1CCC2(CC1)CCCN2    4.629
*7854 C[CH](N)CC1=CCCCC1    4.475
*7873 CCC[CH]1SCC(C)(C)NC1=O    9.322
*7877 CC(C)[CH](O)C(C)(C)[CH](O)C#N    5.708
*7880 C[CH](O)C(=O)NC1CCCCC1    8.034
*7894 CN1CC[C](C)(O)[CH](C1)C(C)=O   11.910
*7895 CCCOC(=O)N1CCCCC1    6.460
*7900 CC(C)[CH]1CCC[C]1(N)C(O)=O    8.444
*7922 CCOC(=O)CC[CH](N)C(=O)OCC    8.575
*7935 CCCC=C(CC)C=NNC(N)=S    5.496
*7956 CC(=O)CC(C)(C)NC(=S)NCCO   13.235
*7962 CCOC(=O)NC[CH](C)NC(=O)OCC    9.297
*7974 CC(C)[CH]1CCCC[CH]1O    4.939
*7990 CCCC1(O)CCCCC1    4.939
*7993 CC1(CCO)CCCCC1    4.939
*8028 CCCCCCCOC(=O)CO    3.824
*8032 CCC[CH](C)C(=O)OCCOC    5.073
*8036 CCCCC(=O)O[CH](C)COC    5.073
*8047 COCCC(=O)OCC[CH](C)OC    7.127
*8053 CCCCCCC1SCCS1    4.695
*8066 CN1CCCC[CH]1C(C)(C)O    8.492
*8106 C[CH](O)CC(C)(C)NC(=O)[CH](C)O    9.115
*8118 CCCCCCC(C)C   -0.602
*8134 NNC(=O)CCCCCCCC(=O)NN   15.590
*8169 CCSCCS(=O)(=O)CS(=O)(=O)CCSCC   12.728
*8211 N#CC(C#N)C1=CC=CC=C1    8.991
*8223 OC1=CC(=C2N=CC=CC2=C1)[N+]([O-])=O   12.548
*8250 OC(=O)C1=C(C(O)=O)C(=CC(=C1)O)C(O)=O   20.340
*8268 OC1=CC=C(C=C1)C2=NC=CS2   10.514
*8277 OC(=O)CC1=CC=C(C=C1)C#N    9.370
*8278 OC(=O)C1=CC2=CC=CC=C2N1   10.750
*8306 OC(=O)C(=O)CC1=CC=C(C=C1)[N+]([O-])=O   12.158
*8314 CC1=NC(=C2C=C(C=CC2=N1)[N+]([O-])=O)O   12.889
*8421 CC(=O)OC1=C(C=O)C=CC=C1    6.790
*8429 OC(=O)CC1=C(C=CC=C1)C(O)=O   12.051
*8450 CC1=C2NC=CC2=CC=C1    6.010
*8465 CC1=C(O)C=CC(=C1C)SC#N    8.955
*8484 NC1=C(C=CC=C1)C=CC(O)=O   11.340
*8520 CC(=O)COC1=C(C=CC=C1)[N+]([O-])=O    8.223
*8530 COC(=O)C1=CC(=C(C)C=C1)[N+]([O-])=O    6.821
*8533 CC1(C)OC2=C(O1)C=C(C=C2)[N+]([O-])=O    7.362
*8542 CNC(=O)OC1=CC2=C(OCO2)C=C1   10.428
*8556 CCSC1=NC2=CC=CC=C2S1    7.839
*8559 CC(=O)N1C(=N)NC2=C1C=CC=C2   12.010
*8563 CC(=O)NC1=CC2=C(NC(=N)S2)C=C1   14.857
*8600 NC1=C2C(=CC=CC2=CC=C1)N   10.182
*8626 O=C(NC1=CC=CC=C1)OCCC#N   10.921
*8628 C[C]1(NC(=O)NC1=O)C2=CC=CC=C2    9.775
*8637 OC(=O)CCC1=NC2=CC=CC=C2N1   11.399
*8673 CCOC(=O)C(=NO)C1=CC(=CC=C1)[N+]([O-])=O   10.051
*8745 CCOC(=O)C(=O)C1=CC=CC=C1    6.738
*8768 CC(=O)OC1=CC=C(OC(C)=O)C=C1    6.108
*8817 C[N+]1=CC2=CC=CC=C2C=C1   10.833
*8852 C1CC1C2=NO[CH](C2)C3=CC=CO3    4.162
*8854 CC(=O)C1=CC(=C(C=C1)C(C)=O)N   11.200
*8877 CNC(=O)[CH]1COC2=C(O1)C=CC=C2   10.708
*8902 CC(C)OC(=O)C1=CC(=CC=C1)[N+]([O-])=O    6.618
*8920 OC[CH](O)COC(=O)C1=CC=C(C=C1)[N+]([O-])=O   12.491
*8925 C1CN=C(S1)SCC2=CC=CC=C2    7.706
*8941 CC[C]1(NC(=O)NC1=O)C2=CC=NC=C2   12.535
*8950 CC(=O)NC1=CC(=C(NC(C)=O)C=C1)[N+]([O-])=O   12.015
*8955 CN(C)C(=O)OC1=C(C=C(C=C1C)[N+]([O-])=O)[N+]([O-])=O   11.917
*8968 C1C=C[CH]2[CH]3C[CH](C=C3)[CH]12    1.204
*8982 CN1C=[N+](C)C(=O)C2=C1C=CC=C2   16.268
*8983 CN1NC(=O)C[CH]1C2=CC=CC=C2   11.096
*9036 CC1=C(C)C(=C(C)C(=C1C)[N+]([O-])=O)[N+]([O-])=O    6.907
*9090 CSC1=C2C(=CC(=NC2=NC(=N1)N)C)C    9.190
*9094 N#CCN(CCN(CC#N)CC#N)CC#N   21.148
*9127 C[CH](C(C)=O)C1=CC=CC=C1    5.275
*9133 CC1=CC2=C(OCCSC2)C=C1    5.738
*9165 CC(C)C1=CC=CC(=O)C(=C1)O    4.526
*9230 C[C](O)(C(=O)CO)C1=CC=CC=C1    3.889
*9242 CCC(=O)C1=C(O)C=C(OC)C=C1    6.996
*9251 CC1=CC(=C(C)C=C1)OCC(O)=O    7.690
*9270 CCCC(=O)C1=CC(=C(O)C(=C1)O)O   16.710
*9277 CCOC(=O)C1=CC=C(C=C1)S(C)(=O)=O    7.971
*9278 CCCOC(=O)[CH](C(O)=O)C1=CC=CS1    9.996
*9281 CCCOC(=O)C1=CC(=C(O)C(=C1)O)O   16.162
*9312 C[CH](O)CN=CC1=CC=CC=C1    7.599
*9329 OCCCN=CC1=CC=CC=C1    7.599
*9338 COC1=CC2=C(NCCC2)C=C1    6.796
*9395 C[CH](CC1=CC=CC=C1)OC(N)=O    8.249
*9422 OCCNC(=O)COC1=CC=CC=C1   13.438
*9427 CCOC(=O)COC1=CC(=CC=C1)N    8.599
*9428 CN(C)CC1=CC(=CC=C1O)C(O)=O   14.210
*9436 CCOC(=O)C1=C(NC(=C1C)C)C(O)=O   11.721
*9442 CC1=C(C=CC=C1)S(=O)(=O)C[CH](N)C(O)=O   13.554
*9458 CC(C)(NNC1=CC=CC=C1)C#N   10.893
*9467 NC(=N)N[CH](CC1=CC=CC=C1)C(O)=O   15.088
*9484 CC(C)OC(=O)NNC(=O)C1=CC=NC=C1   12.411
*9499 CC(=O)NC1=CC=C(C=C1)C=NNC(N)=N   17.238
*9524 C1C[CH]2C[CH]1[CH]3CC=C[CH]23    1.398
*9546 CC(=O)C1=C(C)N2CNCC2=C1C   10.450
*9565 CC(C)OC(=O)NC1=CC(=CC=N1)C   10.255
*9569 C=CC(=O)N1CCN(CC1)C(=O)C=C   10.991
*9578 COC(=O)C1=C(C)NC(=C1C)C(C)=NO   11.203
*9586 OCCNC1=CC(=O)C(=CC1=O)NCCO   18.593
*9614 CCCCCSC1=C2N=CNC2=NC=N1    9.156
*9686 C[CH](O)[C](C)(O)C1=CC=CC=C1    7.730
*9692 C[CH]1CCO[C](C)(O1)C2=CC=CS2    5.640
*9707 CCCCC1=C(O)C(=C(O)C=C1)O   13.804
*9717 C=CCOC(=O)CCC(=O)OCC=C    6.020
*9732 COC(=O)[CH]1CCC(=O)[CH](C1)C(=O)OC    9.538
*9743 COC(=O)[CH](OC(C)=O)[CH](OC(C)=O)C(=O)OC    9.804
*9770 CC(C)(C)C1=CC=C(N)C=C1    5.308
*9778 CN(C)C1=C(CCO)C=CC=C1    8.338
*9793 CC[C](O)(CN)C1=CC=CC=C1   10.281
*9800 CC(C)C(=O)C[N+]1=CC=CC=C1   12.750
*9806 C[N+](C)(C)C1=CC=C(C=O)C=C1   15.783
*9845 N#CCN(CC#N)C1CCCCC1   10.943
*9855 CCCCNC1=C2C=NN(C)C2=NC=N1   11.121
*9882 CC(C)CCSC1=C2N=CNC2=NC(=N1)N    9.057
*9889 CC(=C)[CH]1CCC(=CC1)C    0.420
*9906 COC1=CC=C(C[CH](C)NN)C=C1    9.575
*9916 CC(C)[CH]1CCC[C]12NC(=O)NC2=O    8.298
*9922 CCC1(CC(C)C)C(=O)NC(=S)NC1=O    8.321
*9933 O[CH](CC(=O)NCC=C)C(=O)NCC=C   11.334
*9954 CCCCNC1=C2N=CNC2=NC(=N1)NC   12.003
*9955 CN(C)CCCNC1=C2N=CNC2=NC=N1   15.870
*9957 CCCN(CCC)C1=C2N=NNC2=NC=N1   11.407
*9959 CN(C)CCCNC1=NC(=C2C=NNC2=N1)O   16.311
*10008 CCOC(CC)=C(C(C)=O)C(C)=O    8.547
*10041 CCOC(=O)C[CH](C(C)=O)C(=O)OCC    9.182
*10100 CCCCCCSC1=CC(=NC(=N1)N)O    8.750
*10102 CCOC1=C(OCC)C(=NC(=N1)N)OCC    6.833
*10119 CCC[C]1(NC(=O)NC1=O)[CH](C)CC    7.943
*10133 CCC[C]1(NC(=O)N(C)C1=O)C(OC)OC   11.134
*10141 CC(C)(C)CC(C)(C)SSC1=NNC(=S)S1    5.588
*10151 CN(C)C(=S)SSC(=S)NCCNC(=S)SSC(=S)N(C)C    8.572
*10164 CC(C)[CH]1CC=C(C1)[CH](C)O    4.801
*10179 CCCCCC(=O)CC(=O)CC    6.863
*10225 CCCC(=O)[CH](C(C)C)C(C)=O    6.863
*10233 CC1CCC2(CC1)OCC(O)CO2    8.583
*10235 CCOC(=O)C(C)(C)C(=O)C(C)C    6.313
*10240 CCOC(=O)[CH](CO)C1CCCC1    7.688
*10258 CCCCOC(=O)C(=O)OCCCC    4.870
*10264 C(CCOCC1CO1)COC[CH]2CO2    9.455
*10270 CCOC(OCC)C=CC(=O)OCC    6.633
*10285 C1CS[CH](C1)CC[CH]2CCCS2    4.928
*10288 CCCCN[CH](CCC)C#C    4.701
*10320 CCCCOC(=O)C1(N)CCCC1    5.939
*10325 CC(C)C[CH]1CCC[C]1(N)C(O)=O    8.321
*10338 CCOC(OCC)[C](C)(NC(C)=O)C(O)=O   14.110
*10342 CCCC(=O)N[CH]1[CH](O)O[CH](CO)[CH](O)[CH]1O   18.807
*10407 CCCCCCCCCC=O    3.184
*10409 C[CH](CCO)CCC=C(C)C    4.246
*10416 CC=CC[CH](CCO)C(C)C    4.318
*10434 CCCC1(C)OCC(C)(C)CO1    3.790
*10436 CCCCCC[CH]1OC[CH](C)O1    3.790
*10449 CCCCCCCCCOC=O    2.635
*10464 CCCCC(C)(C)SCCC(O)=O    7.372
*10475 CCCCC(=O)OCC[CH](C)OC    4.951
*10482 CCCCOCCOCCOC(C)=O    7.004
*10498 CCCCN(CCCC)C(C)=O    6.530
*10519 CC(C)CN(CC(C)C)CC(O)=O    7.527
*10528 CCCCCCOC(=O)NCCSC(N)=N   13.804
*10560 CC[CH](O)C(C)(C)[CH](O)C(C)C    5.900
*10580 CCO[CH](SCC)[CH](O)[CH](O)[CH](O)[CH](O)CO   14.360
*10588 CCCCCNCCCCC    3.796
*10625 [O-][N+](=O)C1=C2C(=CC=C1)C=CC=C2[N+]([O-])=O    8.087
*10628 OC(=O)C1=C2C=CC=CC2=NC=C1[N+]([O-])=O   13.262
*10662 OS(=O)(=O)C1=CC2=CC(=CC(=C2C(=C1)[N+]([O-])=O)S(O)(=O)=O)S(O)(=O)=O   24.674
*10666 OC1=C2C=CC=CC2=CC=C1N=O    9.242
*10670 O=C1C=CC(=O)N1C2=CC=CC=C2    7.487
*10673 OC(=O)C1=C2C=CC=CC2=NC=C1   10.857
*10701 OS(=O)(=O)C1=CC2=CC=CC(=C2C=C1)[N+]([O-])=O   12.014
*10708 O=C1NC2(NC(=O)C1=O)NC3=CC=CC=C3S2   14.084
*10724 N#CCC1=C(CC#N)C=CC=C1    8.947
*10753 CC1=CC(=C2C=C(C=CC2=N1)[N+]([O-])=O)O   12.506
*10758 COC1=CC(=C2N=CC=CC2=C1O)[N+]([O-])=O   13.777
*10768 CC1=CC=C(C=C1)N=NC(C#N)C#N   10.955
*10785 N=C1NC(=O)C2=NN(N=C2N1)C3=CC=CC=C3   19.419
*10821 OC(=O)C=CC1=CC2=C(OCO2)C=C1   10.824
*10872 COC1=CC2=C(C=C1)N=CC=C2    7.390
*10874 NC1=C2C=CC(=CC2=CC=C1)O   10.714
*10878 NC1=C2C(=CC=CC2=CC=C1)O   10.714
*10886 CC1=C(C=O)C2=C(N1)C=CC=C2    8.613
*10901 COC1=CC2=C(C=C1)N=C(O)C=C2   11.373
*10910 OC(=O)C=CC(=O)NC1=CC=CC=C1   13.818
*10928 NC1=CC=CC2=CC=CC(=C12)S(O)(=O)=O   13.061
*10933 OC(=O)C[CH]1SC2=C(NC1=O)C=CC=C2   15.229
*10959 NC1=C2C(=CC=CC2=CC(=C1)S(O)(=O)=O)O   17.044
*11005 NC1=C(C=NC=N1)C2=CC=CC=C2   10.101
*11011 CC(=O)NC1=NC2=C(C=C1)C(=CC=N2)O   18.971
*11014 NC1=CC=C(C=C1)N2NC(=O)C=CC2=O   13.318
*11020 OC1(CC2=CC=CC=N2)C(=O)NC(=O)NC1=O   17.595
*11024 CCOC(=O)C1=C(C(=NC(=C1C#N)O)C)[N+]([O-])=O   15.578
*11042 NNC(=O)C1=C2C=CC=CC2=CC=C1   12.044
*11054 CNC(=O)C(=O)C1=CNC2=C1C=CC=C2   14.498
*11056 NNC(=O)OC1=C2C=CC=CC2=CC=C1   11.224
*11064 CC1=C(C)N=C2C=C(C=CC2=N1)C(O)=O   11.156
*11082 NC(=S)NC1=C2C=CC=CC2=CC=C1    8.070
*11084 CC1=NN(C2=CC=CC=C2)C(=C1C#N)N   13.296
*11098 NC1=CC=C(NC2=C3N=CNC3=NC=N2)C=C1   16.863
*11109 NC1=NC2=C(N=CN2)C(=N1)SCC3=CC=NC=C3   13.526
*11137 OC1=C(C=CC=C1)C=C2CCOC2=O    9.526
*11139 CC(C=O)=CC1=CC2=C(OCO2)C=C1    8.535
*11150 OC(=O)[CH]1C[CH]1C2=CC3=C(OCO3)C=C2   10.399
*11185 C[CH](OC(C)=O)C1=CC(=CC=C1)C#N    6.740
*11190 CC1=CC=CC2=C1NC=C2CC(O)=O   11.096
*11215 COC1=CC=C2C=C(C=CC2=C1N)S(O)(=O)=O   14.289
*11265 CCCC1=NC2=C(C=CC=C2)N=C1O   10.239
*11308 CC[C]1(NC(=S)NC1=S)C2=CC=CC=C2    7.514
*11316 CC1=CC=C(NS(=O)(=O)C2=CC=C(N)C=C2)N=N1   13.315
*11331 CCOC(=O)C1=NC2=C(C(=N1)N)C(=NN2C)CC#N   17.240
*11332 NNC1=NC(=C2C=NN(C3=CC=CC=C3)C2=N1)NN   20.260
*11338 CC(=O)C1=CC2=C(CCC2)C=C1    5.156
*11344 C=CCOC(=O)CC1=CC=CC=C1    4.730
*11368 COC1=CC2=C(C=C1)C(=O)CCC2    6.426
*11384 CCOC(=O)[CH]1O[CH]1C2=CC=CC=C2    6.664
*11404 C=CCOC(=O)OCC1=CC=CC=C1    4.182
*11415 COC1=C(OC)C=C(C=CC(O)=O)C=C1   10.344
*11424 CC(=O)OCCOC1=CC2=C(OCO2)C=C1    8.932
*11427 COC1=CC(=CC(=C1OC)OC(C)=O)C(O)=O   11.340
*11430 CC1=CC=C2C=CC=CC2=[N+]1C   10.790
*11431 C1CN=C(C1)CC2=CC=CC=C2    3.394
*11441 O=C1CCCC[CH]1C2=CC=NC=C2    8.268
*11443 CCC1=CC(=C(OC)C=C1)CC#N    6.670
*11453 CN(C)C1=CC=C(C=CC(O)=O)C=C1    9.686
*11455 C[C]1(CO)COC(=N1)C2=CC=CC=C2    9.886
*11459 CC1(C)O[CH](NC1=O)C2=CC=CC=C2    8.717
*11468 CC=CCOC(=O)C1=CC=C(N)C=C1    7.599
*11472 O=C1OCCN1CCC2=CC=CC=C2    8.045
*11475 C[CH](NC(=S)SCC1=CC=CC=C1)C(O)=O    9.073
*11479 COC1=C(NC(=O)CC(C)=O)C=CC=C1   12.609
*11480 COC1=CC=C2C(=O)[CH](N)CC2=C1OC   10.465
*11481 OC(=O)CCCC(=O)NC1=CC=CC=C1   13.092
*11492 OC1=C(C=CC=C1)C(=O)N2CCOCC2   11.019
*11517 CC(=O)OCCOC(=O)NC1=CC=CC=C1   10.161
*11523 COC1=CC(=CC=C1O)C=C(C)C[N+]([O-])=O   10.622
*11528 OC(=O)CCNC(=O)OCC1=CC=CC=C1   13.159
*11529 CC(C)OC(=O)NC1=CC(=CC=C1)C(O)=O   12.111
*11530 CC(C)COC(=O)C1=CC=C(C=C1)[N+]([O-])=O    6.495
*11540 CCOC(=O)C1=C(NC=C1CCC(O)=O)C(O)=O   16.770
*11603 CC1(C)CC(=O)N(N1)C2=CC=CC=C2    9.387
*11613 CC(=O)C(CCC#N)(CCC#N)C(C)=O   13.750
*11683 CCN1C[CH](O)C2=CC(=NNC(N)=O)C(=O)C=C12   18.801
*11689 O=C1N[CH](CCS(=O)(=O)NNC2=CC=CC=C2)C(=O)N1   15.738
*11694 COC1=NC=C2N=CN([CH]3O[CH](CO)[CH](O)[CH]3O)C2=N1   18.770
*11702 CC1=CC(=C(C)C=C1)OCC=C    3.292
*11711 COC1=CC2=C(CCCC2)C=C1    3.520
*11729 COC1=C(OC)C=C(CC=C)C=C1    4.564
*11734 COC(=O)C1=CC=C(C=C1)C(C)C    4.171
*11737 COC1=CC=C(C[CH](C)C=O)C=C1    6.243
*11747 O=CCCCOCC1=CC=CC=C1    6.947
*11776 CCCOC(=O)[CH](O)C1=CC=CC=C1    5.410
*11780 CCOC(=O)C1=CC=CC(=C1)OCC    5.441
*11790 COC1=C(OC)C=C(CC(C)=O)C=C1    7.854
*11833 CCC(=O)OC(OC(=O)CC)C1=CC=CO1    7.227
*11845 C1CCC(C1)CC2=CC=CN=C2    4.851
*11854 CCCC(=O)NC1=CC=C(C)C=C1    7.921
*11869 CNC(=O)C1=CC=C(C=C1)C(C)C    8.024
*11881 CC(C)C(=O)[CH](C)C1=CC=CC=N1    7.914
*11903 COC1=CC2=C(CNCC2)C=C1OC    8.640
*11924 COC1=CC=C(C=C1)C=NCCCO    8.827
*11939 COC1=CC=C(C=C1)[CH](C)CC(N)=O   10.026
*11945 C[CH](O)C(=O)N(CCO)C1=CC=CC=C1    8.896
*11949 C[CH](COC1=C(C)C=CC=C1)OC(N)=O    9.478
*11966 CC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2    7.812
*11968 CCOC(=O)C1=C(C)C(=C(O)N=C1O)CC   11.876
*11978 CC(C)C1=CC=C(C=C1)C=NNC(N)=O    9.815
*12007 CCN(CC)C(=O)CSC1=C2N=CNC2=NC=N1   15.536
*12024 NC1=NC=NC2=C1N=CN2[C]3(CO)O[CH](CO)[CH](O)[CH]3O   23.268
*12040 CN(C)CC(=O)NC1=C(C)C=CC=C1   10.171
*12044 CC(C)CCON=CC1=CC=NC=C1    6.333
*12058 CN(C)CCOC(=O)C1=CC=C(N)C=C1   11.093
*12067 CN(C)S(=O)(=O)N1CCCC2=C1C=CC=C2    5.951
*12077 COC1=C(OC)C=C(CCNC(N)=O)C=C1   12.523
*12082 CCCCN(N=O)S(=O)(=O)C1=CC=C(C)C=C1    6.529
*12089 CCOC(=O)C1=CC(=CC(=C1)NS(C)(=O)=O)NS(C)(=O)=O   11.666
*12094 CCCCN1C(=O)N(C)C2=C(N(C)C=N2)C1=O   10.077
*12098 NNC(=O)CC(CC(=O)NN)C1=CC=CC=C1   17.175
*12100 CCC(CC)C=NNC1=CC=C(C=N1)[N+]([O-])=O    9.967
*12102 CCCCN1C(=S)NC2=C1N(C)C(=O)N(C)C2=O    9.693
*12201 CCCCCCC1=CC=CN=C1    4.493
*12223 C[CH](O)CN(C)CC1=CC=CC=C1    9.721
*12238 C[N+](C)(C)CC(=O)C1=CC(=C(O)C=C1)O   23.120
*12245 CCOC(=O)[CH]1CN(CC(C)C)C(=O)C1=O   12.155
*12256 CC1=C(CN2CCCCC2)C(=NC(=N1)S)O   12.146
*12269 CCCNC1=NC=C2N=CN(CCC)C2=N1    7.441
*12302 CCCC[CH]1CCC[C]12NC(=O)NC2=O    8.175
*12329 CN(C)CCN(NC(N)=O)C1=CC=CC=C1   13.947
*12357 CC(C)=C[CH]1[CH](COC=O)C1(C)C    2.851
*12368 CCOC(=O)[CH]1CCCCCCC1=O    6.545
*12376 CC(=O)OC[CH]1COC2(CCCCC2)O1    6.893
*12386 COC(=O)CCC(CCC(=O)OC)C(=O)OC    8.510
*12388 COCCOC(=O)CC(=C)C(=O)OCCOC   10.079
*12415 CCCCNC(=S)NC1=C(N)N(C)C(=O)N(C)C1=O   13.542
*12434 CCOC(=O)N1CCN([CH](C)C1)C(=O)OCC    8.971
*12438 CC1(C)NC(=N)SC2(C)CCC1CC2    8.000
*12443 CO[CH]1C[CH]2CC[C]1(C)C2(C)C    2.668
*12458 OC(=O)CCCCC1CCCCC1    5.510
*12481 CC1CCC(CC1)OC(=O)C(C)C    3.127
*12503 OCCCC[CH]1COC2(CCCC2)O1    8.460
*12504 CCOC[CH]1COC2(CCCCC2)O1    6.078
*12506 CCCCCC(C)(CC(O)=O)CC(O)=O   10.406
*12509 CCOC(=O)C(C(=O)OCC)C(C)(C)C    5.640
*12538 CCC#CCN(C(C)C)C(C)C    4.658
*12561 CCOC(=O)C(CCN(C)C)C(=O)OCC    9.192
*12577 C1CCN(CC1)CN2CCCCC2    5.215
*12622 CCCCCC[CH]1OCC[CH](C)O1    3.668
*12644 CCCCCCCC(=O)OC(C)C    2.772
*12646 CCCCC[CH](CCC)COC=O    2.513
*12653 CCCCCOC(=O)CCCCC    2.772
*12659 CCCCC[C]1(C)O[CH](C)[CH](C)O1    3.668
*12672 CCCCCC[C]1(C)OC[CH](CO)O1    8.104
*12691 CCN(CC)CCC1CCCC1    3.810
*12858 OC(=O)C1=CC=C(S1)S(=O)(=O)C2=CC=CC=C2   11.564
*12878 NC(=O)C1=CC2=C(C=CC=C2)C=C1O   10.548
*12888 O=C[CH]1N=C(CC2=CC=CC=C2)OC1=O    8.121
*12898 COC1=CC=C(C=C1)C=C2SC(=O)NC2=O    8.209
*12920 CC1=CC(=C(C#N)C2=C(C#N)C(=N)NN12)C   13.249
*12925 CC(=O)NC1=CC=C(C=C1)N=NC(C#N)C#N   16.939
*12941 C1=CC=C(C=C1)C2=CC=CC=C2    3.383
*12943 C1=CC=C(C=CC2=CC=CC=N2)N=C1    9.674
*12982 OS(=O)(=O)C1=CC=C(C=C1)N=NC2=CC=CC=C2   11.163
*12998 OC1=CC(=C(C=C1)N=NC2=CC=C(C=C2)S(O)(=O)=O)O   19.128
*13023 [O-][N+](=O)C1=CC=C(NN=CC2=CC=CN=C2)C=C1   11.674
*13046 CSC1=C2N=CN(C3=CC=CC=C3)C2=NC=N1   12.087
*13057 [O-][N+](=O)C1=CC=C(NC(=O)NNC2=CC=C(C=N2)[N+]([O-])=O)C=C1   20.024
*13084 COC1=CC2=C(C=CC=C2)C=CC1=O    7.084
*13102 COC1=C(C=C2C=CC=CC2=C1)C(O)=O    9.203
*13105 OC1=CC=C(C=C1)S(=O)C2=CC=C(O)C=C2   16.670
*13106 OS(=O)(=O)C1=C2CCC3=C2C(=CC=C3)C=C1    9.879
*13111 CC(=O)C1=C2OC(=O)C=C(C)C2=CC=C1O    8.585
*13112 CCOC(=O)C1=C(O)C2=CC=CC=C2C1=O   12.217
*13126 N(C1=CC=CC=C1)C2=CC=CC=C2    5.979
*13140 NC1=CC2=C3C(=CC=CC3=C1O)CC2   10.983
*13171 CC(=O)N1C=C(C(C)=O)C2=C1C=CC=C2    9.139
*13174 CCOC1=C(C=CC=C1)C=C2SC(=S)NC2=O    9.790
*13176 CCOC1=CC(=C2C=CC=CC2=N1)C(O)=O   11.003
*13178 O=C(NC1=CC=CC=C1)OCC2=CC=CO2    8.754
*13184 COC1=CC2=C(SCC(O)=O)C=CN=C2C=C1   14.054
*13187 NC1=CC=C(C=C1)C2=CC=C(C=C2)S(O)(=O)=O   13.166
*13194 CCOC(=O)C1=NC(=C2C=CC=CC2=C1O)O   13.095
*13199 COC1=CC=C(C=C1OC)C=C2SC(=O)NC2=O    9.438
*13212 NN=C(C1=CC=CC=C1)C2=CC=NC=C2   10.104
*13222 NC(=O)SCC(=O)NC1=CC2=CC=CN=C2C=C1   13.883
*13237 NC1=C(C=C(C=C1)N=NC2=CC=C(C=C2)S(O)(=O)=O)S(O)(=O)=O   20.947
*13242 C(NC1=C2C=NNC2=NC=N1)C3=CC=CC=C3   13.914
*13285 CC1=NC(=NC(=C1)C)C2=CC=CC=C2    6.564
*13296 O[CH]([CH](O)C1=CC=CC=N1)C2=CC=CC=N2   14.836
*13299 O=C1[CH]2[CH]3C[CH](C=C3)[CH]2C(=O)N1CCC#N   10.666
*13305 CCOC(=O)NC1=CC2=C(C=CC=C2)N=C1   11.432
*13317 CCOC1=CC=C(C=C1)C=C2NC(=S)NC2=O   10.539
*13327 CCOC(=O)C1=NN(C=C1O)C2=CC=CC=C2   13.924
*13334 COC1(CC2=CC=CC=C2)C(=O)NC(=S)NC1=O   11.110
*13361 COC(=O)C1=C(NC(C)=O)C=C(C(=O)OC)C(=C1)[N+]([O-])=O   14.996
*13417 CC(=O)C(C(C)=O)C(=O)C1=CC=CC=C1   11.353
*13460 CC[CH](C)N1C(=O)C2=CC=CC=C2C1=O    7.280
*13469 CC1=CC2=C(C(=C1)C)C(=CN2)CC(O)=O   11.053
*13475 CCOC(=O)[C](C)(C#N)C1=CC=CC=C1    7.987
*13485 CC(=O)NC1=CC=C(C=C1)C(=O)CCC(O)=O   15.955
*13496 O[CH]([CH](O)[CH](O)C1=NC2=CC=CC=C2S1)[CH](O)C(O)=O   16.261
*13522 CN1N=CC2=C1N=C(C)N=C2NCC3=CC=CO3   12.542
*13540 C1C[CH](OC=C1)C2NC3=CC=CC=C3N2    7.491
*13544 CC1=CC2=C(C=C1)C(=CN2)C[CH](N)C(O)=O   13.660
*13545 CC1=CC=CC2=C1NC=C2C[CH](N)C(O)=O   13.660
*13571 COC(=O)CCC1=CC=C(C=C1)N(N=O)C(C)=O   10.606
*13573 CCOC(=O)C1=CC=C(NC(=O)CSC(N)=O)C=C1   12.056
*13575 NC(=O)CSC[CH](NC(=O)C1=CC=CC=C1)C(O)=O   17.609
*13607 CCNC1=C(N=NC2=CC=CC=C2)C(=NC(=N1)N)O   14.971
*13617 CC(C)C1=CC=C(C=CC=O)C=C1    5.506
*13650 CC1(C)CCC2=C(O1)C=CC(=C2)C(O)=O    8.137
*13672 CC(=O)CCC1=CC=C(OC(C)=O)C=C1    7.194
*13694 OC(=O)C(CCCC1=CC=CC=C1)C(O)=O   12.114
*13704 CCCC(=O)OC1=CC=C(C=C1)C(=O)OC    6.133
*13705 CC1=CC(=C(O)C(=C1)C)C(=O)CCC(O)=O   10.810
*13721 CC1=CC(C)(C)NC2=C1C=CC=C2    5.511
*13740 S=C(CC1=CC=CC=C1)N2CCOCC2    7.764
*13747 CC(=O)N[CH](CC1=CC=CC=C1)C(C)=O   10.452
*13777 CCOC(=O)CN(CC1=CC=CC=C1)C=O    9.425
*13833 C[C](CO)(NC(=O)OCC1=CC=CC=C1)C(O)=O   16.173
*13856 C=CCN1C(=O)N(CC=C)C(=O)N(CC=C)C1=O   12.680
*13859 CCOC1=CC=C(N[CH]2CNC(=O)NC2=O)C=C1   14.032
*13861 CCCC1=NN=C(NS(=O)(=O)C2=CC=C(C)C=C2)O1    9.575
*13893 CC(C)=C(C)C(=O)NNC1=CC=CC=C1   10.281
*13902 CC1=CC(=C(C(=C1)C)C(=O)CSC(N)=N)C   12.363
*13908 COC(=O)CCC(C)=NNC1=CC=CC=C1    7.547
*13916 O=S(=O)(NN=C1CCCCC1)C2=CC=CC=C2    5.688
*13922 CCCNCC(=O)NC1=C(C=CC=C1)C(O)=O   15.006
*13929 CC1=CC=C2N=C(NC2=C1)[CH](O)[CH](O)[CH](O)CO   14.728
*13947 S=C(NC1=CC=CC=C1)N2CCCCC2    6.364
*13948 CCO[CH]1CCC[CH](O1)N2C=NC3=C(S)N=CN=C23   11.724
*13961 COC1=NC(=C2N=CN([CH]3O[CH](CO)[CH](O)[CH]3O)C2=N1)OC   19.038
*13982 CC(C)C(=O)C1=C(C)C=CC(=C1)C    4.676
*13993 CCCC(=O)C1=C(OC)C=CC(=C1)C    5.947
*14017 CC1=CC=CC(=C1)OC[CH]2CCCO2    6.272
*14026 CCC1=CC=C(CCCC(O)=O)C=C1    6.943
*14035 CC1=CC(=C(CCC(O)=O)C(=C1)C)C    7.103
*14065 CC[CH](C)OC(=O)[CH](O)C1=CC=CC=C1    5.287
*14066 CC(C)CCOC(=O)C1=C(O)C=CC=C1    4.851
*14084 COC1=C(OC)C=C(C[CH](C)C=O)C=C1    7.471
*14094 COC1=CC(=C(CCCC(O)=O)C=C1)C    8.293
*14107 CCOC(=O)CC1=CC(=C(OC)C=C1)OC    7.182
*14118 CCCOC(=O)COC1=CC=C(OC)C=C1    6.252
*14121 CCOC1=C(OCC)C(=C(C=C1)C(C)=O)O    8.101
*14126 COCCOC(=O)COC1=CC=C(OC)C=C1    8.306
*14130 CC(=O)O[CH]1[CH]2CO[CH](O2)[CH](OC(C)=O)[CH]1OC(C)=O   13.408
*14145 CCCC(=O)N(CC)C1=CC=CC=C1    6.529
*14146 CCCC(=O)NCCC1=CC=CC=C1    8.333
*14166 CCOC1=CC2=C(C=C1)[CH](C)NCC2    7.167
*14180 CC(C)OC(=O)[CH](N)CC1=CC=CC=C1    7.167
*14183 O=C1CCC(=O)N1C[CH]2C[CH]3CC[CH]2C3    7.105
*14192 CCCCN[CH](C(O)=O)C1=CC=CC=C1    9.332
*14200 CCOC1=CC2=C(CNCC2)C=C1OC    8.517
*14206 COC(=O)[CH](C)CNCC1=CC=CC=C1    8.249
*14223 OCCN(CCO)C(=O)CC1=CC=CC=C1   13.987
*14226 C[C](N)(CCOCC1=CC=CC=C1)C(O)=O   11.604
*14230 COC(=O)CCC1=CC=C(NCCO)C=C1   12.150
*14242 CCC(CC)(NS(=O)(=O)C1=CC=CC=C1)C(O)=O    9.370
*14260 COC1=C(OC(C)C)C=CC(=C1)C=NNC(N)=S    9.678
*14316 CC(=O)N1CC[N+](C)(C)C2=C1C=CC=C2   18.164
*14353 CCOC(=O)[CH]1NN=C([CH]1C(=O)OCC)C(=O)OCC    9.827
*14392 CC(C)=C1[CH]2CC[CH]1[CH]3COC[CH]23    3.712
*14397 CCCCCCC1=C(O)C=C(O)C=C1    9.577
*14429 OC(=O)C=C(CCC1CCCCC1)C(O)=O   11.168
*14432 OC(=O)[CH](CC[CH](CC=C)C(O)=O)CC=C   10.538
*14440 CCOC(=O)[CH]([CH](C(C)=O)C(=O)OCC)C(C)=O   12.355
*14452 CCCCCCC1=CC=CC(=N1)C    4.451
*14491 CCNC[CH](O)CC1=C(OC)C=CC=C1   11.167
*14493 CC(C)C1=CC(=C(C=C1)C(C)C)S(N)(=O)=O    5.796
*14514 CCN(CC)CCNC1=CC=C(C=C1)[N+]([O-])=O   10.719
*14535 CC[N+]1(C)CCC[CH]1C2=CN=CC=C2   16.542
*14538 CN(C)CC1=CC=C(O)C(=C1)CN(C)C   12.775
*14553 CC(=O)CC(C)=NCCN=C(C)CC(C)=O    9.225
*14564 CCOC(=O)N1CC(=C(C)CN1C(=O)OCC)C    7.369
*14593 O=C(OC1CCCC1)C2CCCCC2    3.360
*14630 CCOC(=O)CC(O)(CC(=O)OCC)C(=O)OCC    9.194
*14649 CCCC[CH](CC)CNC(=O)C=CC(O)=O   12.357
*14655 COC(=O)CCN(CCC(=O)OC)CCC(=O)OC   11.939
*14748 C[CH](CCOCC=O)CCC=C(C)C    4.126
*14754 CCCC(=O)OCCCC[CH]1CCCO1    5.959
*14758 CCCCCC[C](C)(OC(C)=O)C(C)=O    5.217
*14797 CCCC#CCN(CCC)CCC    4.535
*14811 CCN[CH](CCC1CCCCC1)C(O)=O    7.857
*14836 C1CCN(CC1)CC[CH]2CCCCN2    7.810
*14845 C(CN1CCOCC1)OCCN2CCOCC2   13.757
*14850 CC(C)NC(=O)OCCOCCOC(=O)NC(C)C   10.983
*14854 CC(C)NC1=NC(=NC(=N1)NC(C)C)NC(C)C   10.959
*14855 CC(C)(C)C(=O)C(C)(C)C(C)(C)C    3.197
*14862 CO[CH]1C[CH](C)CC[CH]1C(C)(C)C    2.190
*14888 CCCCCCCCCCCOC=O    2.389
*14892 CCCCCCCC(=O)OCCCC    2.648
*14933 CCCCCCCC(=O)N(CC)CC    6.284
*14937 CCCCCCCC(=O)NCCCC    6.502
*14943 CCCCN(CCCC)CC1OCCO1    7.095
*14956 CCCCCCCCCCCC   -0.971
*14959 CCCCCCCCCCCC(=O)NN    9.100
*14990 CCC[C](C)(O)CC[C](C)(O)CCC    5.654
*14995 CCCCCCCCCCCCS(O)(=O)=O    6.547
*15030 CCCCCCCCCC[N+](C)(C)N   14.192
*15036 [O-][N+](=O)C1=C2C=CC=C3C(=O)OC(=O)C(=C23)C=C1    8.502
*15040 [N-]=[N+]=C1C(=O)C2=CC=CC3=CC=CC1=C23    5.493
*15086 [O-][N+]1=C2C=CC=CC2=[N+]([O-])C3=C1C=CC=C3   17.556
*15094 OC(=O)C1=C(SC2=CC=C(C=N2)[N+]([O-])=O)C=CC=C1   12.896
*15157 O=C1OCCC1=CC2=CC=C(C=C2)C#N    7.559
*15166 CC(=O)OC1=CC=C(C=C1)N2C(=O)C=CC2=O    9.407
*15170 N1C2=CC=CC=C2SC3=C1C=CC=C3    7.556
*15185 OC1=CC=C(NC2=C(C=C(C=C2)[N+]([O-])=O)[N+]([O-])=O)C=C1   13.429
*15211 O=C1NN(C2=CC=CC=C2)C3=C1C=CC=C3    9.924
*15218 CCC1=NC2=C(N1)C(=O)C3=C(C=CC=C3)C2=O   11.488
*15234 OC1=CC=C(C=C1C(=O)NC2=CC=CC=C2)[N+]([O-])=O   12.200
*15293 O=C(C=CC1=CC=CO1)C=CC2=CC=CO2    7.561
*15321 CC1=CC2=C(NC3=CC=CC=C23)C=C1    6.509
*15330 O=CNC1=C(C=CC=C1)C2=CC=CC=C2    9.188
*15359 OC(=O)CC1=CC(=NC=C1)C2=CC=CC=C2   11.353
*15360 N[C]1(CC2=CC=CC3=CC=CC1=C23)C(O)=O   11.366
*15367 COC1=C(N2CC2)C(=O)C3=CC=CC=C3C1=O   10.928
*15402 OC1=CC(=C(C=C1)C=NNS(=O)(=O)C2=CC=C(C=C2)[N+]([O-])=O)O   17.410
*15415 N(C=NC1=CC=CC=C1)C2=CC=CC=C2    7.160
*15428 O=C(NC1=CC=CC=C1)NC2=CC=CC=C2    9.955
*15441 NC(=O)NC(=O)CC1=C2C=CC=CC2=CC=C1   12.071
*15475 CCC1=NC(=C2C=NN(C3=CC=CC=C3)C2=N1)O   15.967
*15493 [O-][N+](=O)C1=C(NCNC2=C(C=CC=C2)[N+]([O-])=O)C=CC=C1    9.253
*15510 CNC1=C2C=NN(C3=CC=C(C=C3)[N+]([O-])=O)C2=NC(=N1)C   17.620
*15557 C(CC1=CC=NC=C1)C2=CC=CC=C2    6.079
*15558 C(NC1=CC=CC=C1)C2=CC=CC=C2    6.472
*15584 NC1=CC=C(C=C1)[CH](O)C2=CC=CC=C2   11.208
*15592 CNC(=O)OC1=C2C=CC=CC2=CC=C1C    8.461
*15606 CCOC(=O)C1=C2C=C(OC)C=CC2=NC=C1    9.458
*15608 OC1=CC(=C(C=C1)C(=O)C[N+]2=CC=CC=C2)O   18.564
*15622 CN(C(C)=O)C1=C2C(=CC=C1)C=CC=C2S(O)(=O)=O   14.239
*15659 CN(C)C1=C2C=NN(C3=CC=CC=C3)C2=NC=N1   13.947
*15671 CN(CC1=CC=CC=C1)C2=C3C=NNC3=NC=N2   12.600
*15686 CC1=CC2=C(C=C1)C=C(C)C(=C2)C    3.151
*15689 NN(CC1=CC=CC=C1)C2=CC=CC=C2    7.879
*15767 C[CH]1CC2=C(C=CC=C2)C(=O)[CH]1CC(O)=O   10.080
*15791 COC1=C(OC)C=C(C=C1)C(=O)[CH]2COC(=O)C2   10.321
*15815 C=CCN(CC=C)C(=O)C1=CC=CC=C1    7.735
*15823 CC1=C(CC(O)=O)C2=C(N1)C(=CC=C2C)C   11.010
*15827 ON=C1CC[C](CC1)(C(O)=O)C2=CC=CC=C2   11.316
*15846 CCOC(=O)[CH](CC)N1C(=O)C2=CC=CC=C2S1(=O)=O    9.523
*15857 CCOC1=CC=C(NC(=O)C2=CNC(=N2)C)C=C1   13.132
*15876 CN1CC[CH](C1)C2=CNC3=C2C=CC=C3    9.424
*15882 CC1=CC(C)(C)NC(=S)N1C2=CC=C(O)C=C2    8.987
*15884 CCOC(=O)NN=C1CCCC2=C1C=CC=C2    8.012
*15902 CC1=C(C=C2CCCC(C)(C)C2=C1[N+]([O-])=O)[N+]([O-])=O    6.812
*15910 C1CCC(CC1)NSC2=NC3=C(S2)C=CC=C3    9.182
*15944 C[CH]1CCO[CH](O1)C=CC2=CC=CC=C2    5.636
*15951 CC1=CC=C(C=C1)C(=O)OC2CCCC2    4.280
*15969 CCOC(=O)CCC1=CC=C(C=C1)C(C)=O    7.343
*16008 COC1=CC2=C(C[CH]([CH](CO)[CH]2O)C(O)=O)C=C1   14.400
*16033 CCCCNC(=O)C=CC1=CC=CC=C1    8.866
*16041 OC(=O)[CH](N1CCCCC1)C2=CC=CC=C2    9.346
*16061 CCC(CC)(NC(=O)C1=CC=CC=C1)C(O)=O   11.650
*16090 CC1=CC=C(C=C1)S(=O)(=O)N(CCC(O)=O)CCC(O)=O   15.660
*16104 CC1=C(C)C=C(NS(=O)(=O)CC[CH]2NC(=O)NC2=O)C=C1   13.273
*16112 CCCCSC1=CC=C(NC2=NC(=NC=N2)N)C=C1   10.697
*16131 COC1=CC2=C(CCC[CH]2CC(=O)NN)C=C1   12.595
*16163 CCCN(CCC)C1=CC=C(SC#N)C=C1    6.364
*16200 CCCC(=O)OC1=C(C=CC=C1)C(C)C    3.654
*16213 CC(C)CCOC(=O)C1=CC(=CC=C1)C    3.924
*16224 C[CH]1CCO[CH](CCC2=CC=CC=C2)O1    5.253
*16225 C[CH]1O[CH](CCC2=CC=CC=C2)O[CH]1C    5.253
*16238 CCC1=CC(=C(C(O)=O)C(=C1)CC)CC    6.467
*16261 CC(C)(C)C1=CC=C(OCCOC=O)C=C1    5.449
*16266 CCCC(=O)O[CH](C)COC1=CC=CC=C1    5.627
*16274 CO[CH](C)CCOC(=O)C1=C(C)C=CC=C1    5.979
*16276 CCCC[C](O)(CC(O)=O)C1=CC=CC=C1   11.176
*16297 CC(=O)OC[CH]1[CH]2C[CH](C=C2)[CH]1COC(C)=O    6.162
*16298 O=COCCCOCCCOC1=CC=CC=C1    7.423
*16310 CCCCOC(=O)COC1=CC=C(OC)C=C1    6.129
*16317 CC1=CC=C(C=C1)S(=O)(=O)OC[CH]2COC(C)(C)O2    9.201
*16319 OC[CH]1O[CH](OC2=C(CO)C=CC=C2)[CH](O)[CH](O)[CH]1O   16.333
*16321 CS(=O)(=O)O[CH]1[CH](O)[CH](O)CO[CH]1OCC2=CC=CC=C2   16.411
*16331 CCCC[CH](C)NC(=O)C1=CC=CC=C1    7.699
*16359 CCOC1=C(C=CC=C1)C(=O)N(CC)CC    8.830
*16370 CN(C)C(=O)OC1=CC=C(C=C1)C(C)(C)C    6.740
*16389 CC1(C)[CH]2CC[C]1(C)[CH](C2)OC(=O)CSC#N    6.585
*16443 CN1C(=O)N(C)C2=C(N(C)C(=N2)N3CCCCC3)C1=O   12.231
*16450 CCCSC1=C2N=CN([CH]3O[CH](CO)[CH](O)[CH]3O)C2=NC(=N1)N   18.103
*16471 CCN(CC)CC(=O)NC1=CC=C(CO)C=C1   14.363
*16483 COC1=CC(=CC(=C1OC)OC)C(=O)NNC(C)C   14.130
*16491 C1N2CN3CN1C[N+](C2)(C3)CC4=CC=CC=C4   10.022
*16509 CC(=O)C=CC1=C(C)CCCC1(C)C    3.759
*16577 CCOC(=O)CC[CH](NC(=O)OCC=C)C(=O)OCC   10.397
*16602 CCN(CC)CCN(C)C1=CC=CC=C1    7.003
*16610 CCN(CC)CCOC1=CC=C(CN)C=C1   10.377
*16629 O=C(C1CCCCC1)C2CCCCC2    3.785
*16640 OC(=O)[CH](C1CCCCC1)C2(O)CCCC2   10.056
*16668 CN1C(=O)N(C)C2=C(N(C)C(=N2)OCC[N+](C)(C)C)C1=O   22.996
*16671 CC[CH](C)OC(=N)N(CC(C)=C)CC(C)=C    6.896
*16674 CCCCCCCCC[C]1(C)NC(=O)NC1=O    7.573
*16676 CCCCCC[C]1(NC(=O)N(C)C1=O)C(OC)OC   10.764
*16769 CCN[CH](CCCC1CCCCC1)C(O)=O    7.733
*16790 CN(C)CCCN1C[CH]2CCCC[CH]2C1    7.469
*16815 CCCCCC(=O)O[CH](CC)CCCC    2.526
*16823 CCCCCCCC[CH]1OCC[CH](C)O1    3.421
*16842 CCCCCCC[C]1(C)OCC[CH](C)O1    3.421
*16849 CCCCCC[CH]1OC[CH](CCCCO)O1    7.857
*16850 CC(C)CO[CH]1CCC[CH](OCC(C)C)O1    6.376
*16852 OCCSCCCCCCCCCCC(O)=O   11.440
*16861 C[CH]1C[CH](C)[CH](C)[C](C)(C1)CN(C)C    3.562
*16867 CCCCCN(CCCCC)C(=O)[CH](C)O    6.967
*16932 O=C1C=CC(=O)N1C2=C3N=CC=CC3=CC=C2   11.380
*16942 OC(=O)C1=C(C2=CC=CC=C2)C(=CC(=C1)[N+]([O-])=O)[N+]([O-])=O   12.886
*16971 O=C(CC#N)C1=CC2=C(C=CC=C2)C=C1    9.401
*16986 OC1=CC(=C(C=C1)C2=NC3=CC=CC=C3S2)O   15.507
*16991 [O-][N+](=O)C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2    7.296
*16993 OC(=O)C1=C(SC2=CC=CC=C2)C=CC(=C1)[N+]([O-])=O   11.604
*17013 CC1=CC(=C(OC2=C(C=C(C=C2)[N+]([O-])=O)[N+]([O-])=O)C=C1)[N+]([O-])=O   11.097
*17016 [O-][N+](=O)C1=CC=C(C=C1)C2=NN=NN2C3=CC=CC=C3   12.172
*17050 NC1=CC=C(O)C2=C1C(=O)C3=C(C(=CC=C3O)N)C2=O   17.167
*17072 OC1=CC2=C(C=C1)C3=C(C=CC=C3)C=C2    8.272
*17075 OC1=C2C=CC=CC2=CC3=C1C=CC=C3    8.272
*17078 CC(=O)C1=CC2=C(C=C1)C3=CC=CC=C3S2    7.701
*17092 O=C(SSC(=O)C1=CC=CC=C1)C2=CC=CC=C2    6.523
*17097 OC(=O)C(=O)C1=CC=C(C=C1)C2=CC=CC=C2   10.480
*17134 N1C2=C(C=CC=C2)C=C1C3=CC=CC=C3    7.167
*17142 CC(=O)N1C2=C(C=CC=C2)C3=CC=CC=C13    7.955
*17167 COC(=O)C1=C2NC3=CC=CC=C3SC2=CC=C1    9.747
*17178 OC(=O)C1=C(C=CC=C1)C(=O)NC2=CC=CC=C2   13.609
*17218 CC1=NC2=C(C=CC=C2)C3=C(N)C=CC=C13   10.582
*17225 O=C(C=NNC1=CC=CC=C1)C2=CC=CC=C2    7.870
*17234 COC1=C(NC2=NC3=CC=CC=C3S2)C=CC=C1   11.366
*17240 NC1=CC=C(N)C2=C(O)C3=C(C=CC=C3)C(=C12)O   19.159
*17246 O=CNC1=CC=C(C=C1)C2=CC=C(NC=O)C=C2   11.793
*17251 C[C]1(NC(=O)NC1=O)C2=C3C=CC=CC3=CC=C2   10.785
*17301 OC1=CC2=C(C=C1)C3=C(CC2)C=CC=C3    7.636
*17305 O=C1CCCC2=C1C=CC3=C2C=CC=C3    6.208
*17307 O1[CH]([CH]1C2=CC=CC=C2)C3=CC=CC=C3    6.106
*17320 COC1=CC=C(C=C1)C(=O)C2=CC=CC=C2    6.939
*17343 OC(=O)C(O)(C1=CC=CC=C1)C2=CC=CC=C2    9.254
*17354 CC1=C(OC2=C(C=CC=C2)C(O)=O)C=CC=C1    8.582
*17373 O=S(=O)(OCC1=CC2=C(OCO2)C=C1)C3=CC=CC=C3   10.121
*17389 CC(=O)NC1=CC=C(C=C1)C2=CC=CC=C2    9.324
*17394 NC(=O)CC1=C2C=CC=C3CCC(=C23)C=C1    7.996
*17402 ON=C(CC1=CC=CC=C1)C2=CC=CC=C2    7.417
*17419 CC(=O)NC1=CC(=CC=C1O)C2=CC=CC=C2   13.307
*17432 CC1=CC(=O)C(=C(C)N1C2=CC=CC=C2)C(O)=O   12.573
*17445 CCOC1=C(OCC)C(=O)C2=C(C=CC=C2C1=O)[N+]([O-])=O   11.228
*17464 CC1=CC=C(C=C1)C=NNS(=O)(=O)C2=CC=C(C=C2)[N+]([O-])=O    9.401
*17486 N=C(NCC1=CC=CC=C1)C2=CC=CC=C2    8.488
*17487 CC1=C(C=CC=C1)N=NC2=C(C)C=CC=C2    4.747
*17494 O=NN(CC1=CC=CC=C1)CC2=CC=CC=C2    7.873
*17499 NNC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2   12.517
*17515 [O-][N+](=O)C[CH](NC1=CC=CC=C1)C2=CC=CC=C2    9.592
*17523 NNC(=O)C(O)(C1=CC=CC=C1)C2=CC=CC=C2   13.323
*17530 CC1=CC=C[N+](=C1)CC(=O)C2=CC=C(C=C2)[N+]([O-])=O   16.059
*17533 CC(=O)C1=CC=C(NS(=O)(=O)C2=CC=C(N)C=C2)C=C1   12.824
*17551 N#CC1CC2CC1C3N=NN(C23)C4=CC=CC=C4    9.134
*17555 C(CSCC1=CC=CC=C1)OC2=C3N=CNC3=NC=N2   12.910
*17563 CN1C(=O)N(C)C2=C(N=C(NCC3=CC=CC=C3)S2)C1=O   15.971
*17565 CC1=CC2=C(C=C1C)N(CCO)C3=NC(=O)NC(=O)C3=N2   14.503
*17567 CN1C(=O)N(C)C2=C(N=C(COC3=CC=CC=C3)N2)C1=O   14.096
*17619 CCC(=O)C1=C2C=CC=CC2=C(OC)C=C1    7.124
*17637 CC(C)CC1=C(O)C(=O)C2=C(C=CC=C2)C1=O    8.049
*17639 CC(C)(C)C(=O)C1C(=O)C2=CC=CC=C2C1=O   11.030
*17675 C[N+]1=C(C=CC=C1)C=CC2=CC=CC=C2   11.462
*17694 C[CH](CC1=C2C=CC=CC2=CC=C1)C(N)=O    9.810
*17747 CCOC(=O)C1=C(O)C2=C(OC)C=CC(=C2N=C1)OC   11.569
*17748 CCOC(=O)C1=NC2=C(OC)C=CC(=C2C(=C1)O)OC   14.670
*17777 COC1=CC=C(C=C1)C=NNS(=O)(=O)C2=CC=C(N)C=C2   11.719
*17804 CCNC1=C2N=CN(CC3=CC=CC=C3)C2=NC=N1   12.453
*17809 CN1N=CC2=C1N=C(O)N=C2NC3=C(C)C=C(C)C=C3   15.987
*17870 CCOC(=O)C1=C(NC(=C1CCC(=O)OC)C(=O)OC)C#N   13.772
*17889 CC(=O)NC1=C(N2CC2)C(=O)C(=C(N3CC3)C1=O)NC(C)=O   19.507
*17917 OC(=O)[CH](C1=CC=CC=C1)[C]2(O)CCCC=C2   11.465
*17918 CCCCC1=C2C=CC=CC2=CC=C1S(O)(=O)=O    9.198
*17926 O[C]1(CCCCC1=O)CC2=CC3=C(OCO3)C=C2    9.003
*17940 CCC(=O)OC1=CC=C(C=C1)C(OC(C)=O)OC(C)=O    9.269
*17974 CCOC(=O)[CH]1CCC(=O)N1S(=O)(=O)C2=CC=C(C)C=C2    9.914
*17975 CCOC(=O)C1=C(NC(=C1CCC(=O)OC)C(=O)OC)C(O)=O   16.455
*17978 NNC(=O)C1=C[N+](=CC=C1)CCC2=CC=CC=C2   19.558
*17980 CC(C)C(=O)NC1=CC2=C(N)C=C(C)N=C2C=C1   15.266
*18008 CC(C)N1C[CH](C)C(=O)N(C1=S)C2=CC=CC=C2    7.883
*18018 CCOC(=O)C=C(C)NC1=CC=C(NC(C)=O)C=C1   13.583
*18022 CC1=CC(=C(C=C1)N2C(=CC(C)(C)NC2=S)C)S(O)(=O)=O   11.293
*18026 CCN(CC)C(=O)CNC(=O)C1=CC2=C(OCO2)C=C1   12.636
*18035 CC1=CC=CC(=C1)N2C(=CC(C)(C)NC2=S)C    4.963
*18077 OC1CCC(CC1)C2=CC=C(CC(O)=O)C=C2   11.489
*18086 CCOC(=O)[C](CC)(C(=O)OC)C1=CC=CC=C1    7.103
*18113 COC1=C(OC(C)=O)C=CC(=C1)CCCCC(O)=O   10.133
*18159 CC[CH](C)[CH](NC(=O)CC1=CC=CC=C1)C(O)=O   12.039
*18178 CO[CH]1O[CH]2CO[CH](O[CH]2[CH](N)[CH]1O)C3=CC=CC=C3   18.917
*18211 CCCC=C(C)C#CC1=CCCCC1    0.893
*18215 CC1(C)CCC(C)(C)C2=C1C=CC=C2    1.801
*18217 CC(C)C1=C2[CH](C)CCC2=C(C)C=C1    1.963
*18232 CC(=O)C1=CC(=C2C=CC=CN12)C[N+](C)(C)C   21.407
*18266 CN1C(=O)N(C)C2=C(N=C(CCCCCCC(O)=O)N2)C1=O   16.246
*18267 CCCCOC(=O)CCC1=NC2=C(N1)N(C)C(=O)N(C)C2=O   13.863
*18294 CCCCCCOC(=O)C1=CC(=CC=C1)C    3.801
*18301 C[CH]1CCO[CH](O1)C2=CC=C(C=C2)C(C)C    5.210
*18322 C[CH]1O[CH](OCC1(C)C)C2=CC=C(C)C=C2    5.210
*18326 CCC1(C)COC(C)(OC1)C2=CC=CC=C2    5.130
*18339 CCCCCCOC(=O)COC1=CC=CC=C1    4.656
*18349 C[CH](COC1=CC=C(C=C1)C(C)(C)C)OC=O    5.325
*18351 CCCCOCCOC(=O)C1=CC=C(C)C=C1    5.857
*18368 COC1=CC=C(C=C1OC)C2OCC(C)(C)CO2    7.833
*18373 COC1=CC(=CC(=C1O)OC)C(=O)OCCC(C)C   10.406
*18374 CCC(CC)OC(=O)C1=CC(=C(O)C(=C1)OC)OC   10.406
*18401 C[CH](CC1=CC=CC=C1)N(C)CCC(C)=O    8.333
*18455 OC[CH](O)[CH](O)[CH](O)[CH](O)C(=O)NCCC1=CC=CC=C1   14.642
*18469 CCCCNC1=C2C=NN([CH]3CCCCO3)C2=NC=N1   13.939
*18499 COCCCNCC(=O)NC1=C(C)C=CC=C1C   12.156
*18510 ON=C1C2(CCCCC2)N(O)C(=O)C13CCCCC3   14.243
*18518 CCCCCCC1=NC2=C(N1C)C(=O)N(C)C(=O)N2C    9.788
*18528 CC(C)=CCCC1=CC[C](C)(CC1)C=O    3.015
*18546 CC(C)OCC1=CC(=CC=C1O)C(C)(C)C    7.481
*18551 CCOC(=O)[CH]1C2CCC(CC2)[CH]1C(=O)OCC    5.983
*18561 CCOC(=O)[CH](C)OC(=O)CCC(=O)O[CH](C)C(=O)OCC    9.311
*18585 COC1=CC=C(C[CH](O)CNCC(C)C)C=C1   10.921
*18594 CCN(CC)CCCNC(=O)C1=CC=C(N)C=C1   14.577
*18599 CC=CC(=O)NCCN1CCN(CC1)C(=O)C=CC   14.125
*18605 CCCC[CH](CC)CNC1=C2C=NN(C)C2=NC=N1   10.629
*18637 C[CH](O)CCC1=C(C)CC[C]1(C)C(C)=C    4.293
*18650 CCC1(C)COC(OC1)[CH]2CC=CC[CH]2C    3.710
*18659 CCO[CH]1C[CH](CCC=C)O[CH](CCC=C)O1    5.609
*18697 CCCC[CH]1CC[CH]2CCCC[CH]2C1   -0.037
*18721 CC(C)[CH]1OC2(CCCCC2)OCC1(C)C    3.654
*18738 CCC=C(C)CO[CH](C)OCC(C)=CCC    2.910
*18759 CCCCCCCCCCCC(C(O)=O)C(O)=O   10.037
*18782 CCN(CC)CCOC(=O)CC1CCCCC1    6.309
*18807 OCCN(CCO)C(=O)CCCCC(=O)N(CCO)CCO   18.090
*18811 S=C(NCCN1CCNCC1)C(=S)NCCN2CCNCC2   22.810
*18815 C[CH](CO)CC1CCC(CC1)C(C)(C)C    4.326
*18820 CC(C)(C)COC(=O)C(C)(C)CC(C)(C)C    2.402
*18830 CCCCCCCCC1OCC(C)(C)CO1    3.298
*18847 CCCSCCCCCCCCCCC(O)=O    6.879
*18858 CCCS(=O)(=O)CCCCCCCCCCC(O)=O    8.979
*18868 CCCCCCCCCCOC(=O)NCCSC(N)=N   13.313
*18885 CCCCC(O)(CCCC)CC(C)(C)C    3.770
*18897 CCCCCS(=O)(=O)OCCCCOS(=O)(=O)CCCCC    8.303
*18907 CCCCCCCCCC[N+](C)(C)CC(O)=O   15.300
*18923 OC1=CC=C(C2=C1C(=O)C3=C(C(=CC=C3[N+]([O-])=O)O)C2=O)[N+]([O-])=O   15.071
*18936 OS(=O)(=O)C1=CC2=C(C=C1)C(=O)C3=C(C=CC=C3[N+]([O-])=O)C2=O   17.232
*18958 N#CC1(C#N)[CH]2C=C[CH]([CH]3C=C[CH]23)C1(C#N)C#N   14.733
*18959 NC1=NC(=C2N=C3C(=CC(=O)C4=C3C=CC=C4)OC2=N1)O   14.306
*19103 [O-][N+](=O)C1=CC=C(C=C1)C(=O)C=CC2=CC=CC=C2    9.039
*19110 CC1=C(O)C2=C(C(=C1)N)C(=O)C3=C(C=CC=C3)C2=O   12.790
*19131 NC1=C2N=C(NC2=NC=N1)N=NC3=C(O)C=CC4=C3C=CC=C4   20.710
*19133 N#CCCN1C2=C(C=CC=C2)C3=CC=CC=C13    8.384
*19153 O=C(NC(=O)C1=CC=CC=C1)NC(=O)C2=CC=CC=C2   13.863
*19156 CC1=CC=C(C=C1)S(=O)(=O)N2C=NC3=C(C=CC=C3)C2=O   10.307
*19165 N=C1NC(=C(S1)C2=CC=CC=C2)C3=CC=CC=C3   10.682
*19167 N(N=CC1=NC2=C(C=CC=C2)C=C1)C3=CC=NC=C3   13.163
*19191 O=C1OCC1(C2=CC=CC=C2)C3=CC=CC=C3    6.298
*19219 O=C(C=CS(=O)(=O)C1=CC=CC=C1)C2=CC=CC=C2    9.533
*19227 OC(=O)COC1=CC=C(C=C1)C(=O)C2=CC=CC=C2   11.218
*19233 CC(=O)OC1=CC=C(C=C1C(O)=O)C2=CC=CC=C2   10.000
*19235 OC1=CC=C(C=C1)[CH]2CC(=O)C3=C(O2)C=C(O)C=C3O   16.533
*19265 O=C(C[N+]1=CC2=CC=CC=C2C=C1)C3=CC=CS3   14.975
*19267 NC1=C(C=CC=C1)C=C(C(O)=O)C2=CC=CC=C2   12.688
*19282 CC(=O)NC1=CC=C2C(=C1O)CC3=CC=CC=C23   13.701
*19337 CCOC1=CC=C(NC2=NC3=CC=CC=C3S2)C=C1   11.242
*19374 OC1=C(C=CC=C1)C=NNC(=S)NN=CC2=C(O)C=CC=C2   16.099
*19395 OC1=CC=C(C=C1)[CH]2CCC3=C2C=CC=C3    7.491
*19414 C[CH](C(O)=O)C1=CC=C(C=C1)C2=CC=CC=C2    8.346
*19422 COC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2    5.943
*19428 COC1=CC(=CC(=C1)O)C=CC2=CC=CC=C2    9.118
*19430 CC1=CC=CC(=C1)OC(=O)CC2=CC=CC=C2    5.239
*19440 COC1=CC=C(C=C1)C(=O)C2=CC=C(OC)C=C2    8.167
*19470 COC1=C(O)C(=C(C=C1)C(=O)C2=CC=CC=C2)OC   12.151
*19487 CN(C)C1=CC2=C(C=C1)C3=CC=CC=C3C2    5.575
*19488 CCNC1=CC2=C(C=C1)C3=CC=CC=C3C2    6.764
*19514 NCCCC1=CC2=C(C=C1)C3=CC=CC=C3O2    8.085
*19520 CCOC(=O)N(C1=CC=CC=C1)C2=CC=CC=C2    6.827
*19552 COC1=CC=C(C=C1)N2C(=O)[CH]3[CH]4CC[CH](O4)[CH]3C2=O   11.287
*19558 CC1=CC(=C(C(=C1)C)S(=O)(=O)OC2=C(C=CC=C2)[N+]([O-])=O)C    8.801
*19588 CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NN=CC2=CC=C(O)C=C2   16.963
*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
*19701 COCCOC(=O)CC1=C2C=CC=CC2=CC=C1    7.668
*19703 CC1=CC(=C(C(=C1)C)S(=O)(=O)OC2=CC=CC=C2)C    6.398
*19722 C(CCC1=CC=CC=N1)CC2=CC=CC=C2    5.833
*19743 CN(C)CCC(=O)C1=C2C=CC=CC2=CC=C1    9.201
*19757 C[CH]1OC2=CC=C3C=CC=CC3=C2[CH](C)N1C    6.701
*19782 CC1=CC=C(NS(=O)(=O)C2=C(C)C=CC(=C2)C)C=C1    6.504
*19784 COC1=CC(=C(C=C1)C(=O)C[N+]2=CC=CC=C2)OC   16.154
*19827 C1CCN2CC3=C(C[CH]2C1)C4=C(N3)C=CC=C4    9.614
*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
*19857 CN(C)C1=CC=C(C=C1)C=NNS(=O)(=O)C2=CC=C(N)C=C2   12.291
*19860 CC1=CC=C(C=C1)S(=O)(=O)NNC(=O)NNS(=O)(=O)C2=CC=C(C)C=C2   15.936
*19885 CCOC(=O)[CH]1CCC(=O)[C](O)(C1)C2=CC=CC=C2    8.693
*19916 CC1=C(N2CCCCC2)S(=O)(=O)C3=CC=CC=C3C1    5.801
*19931 CC(=O)O[CH]1CCC(=O)[CH](C1)C(=O)CC2CC(=O)NC(=O)C2   16.305
*19957 O=C1C=CC=C2[CH]3C[CH](CN12)[CH]4CCCCN4C3   11.041
*20005 CC(C)C1=CC=C(C=C1)[CH](CC=C)OC(C)=O    4.319
*20047 C[CH](CN1CCCCC1)C(=O)C2=CC=CC=C2    8.054
*20072 CCCCCCC(=NOCC1=CC=CC=C1)C(O)=O    7.032
*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
*20130 COC(=O)CCN1CCN(CC1)C2=C(C)C=CC=C2   10.062
*20178 CCCC(=O)OC1=C(C=CC(=C1)C)C(C)(C)C    3.487
*20179 CCCC(=O)OC1=C(C)C=C(C=C1)C(C)(C)C    3.487
*20180 CCCC[CH](CC)OC(=O)CC1=CC=CC=C1    4.111
*20194 CCCCCCC(=O)OCCC1=CC=CC=C1    4.111
*20224 CCCCCCCOC(=O)[CH](O)C1=CC=CC=C1    4.917
*20232 CCC(CC)C(=O)O[CH](C)COC1=CC=CC=C1    5.382
*20252 CCC(=O)OCCCOCCCOC1=CC=CC=C1    7.437
*20257 CCC1(C)COC(OC1)C2=CC=C(OC)C(=C2)OC    7.708
*20293 CCOC(=O)C1=CC=C(OCCN(CC)CC)C=C1    8.500
*20294 CCOC(=O)C1=C(OCCN(CC)CC)C=CC=C1    8.500
*20300 COC(=O)CCC1=CC=C(CN(CCO)CCO)C=C1   13.616
*20309 C1CCN(CC1)C2(CCCCC2)C3=CC=CS3    5.523
*20318 C[N+](C)(C)CCN(CC1=CC=CS1)C2=CC=CC=N2   19.633
*20335 CCCCNC(OC1=CC=CC=C1)=NCCCC    7.585
*20351 CCCCOC1=C(N)C=C(C=C1)C(=O)OCCNCC   12.170
*20425 CCCCN(CCCC)CC1=C(O)C(=NC=C1)C   11.614
*20428 CC[N+](C)(CC)CCN1C(=O)[CH]2CC=CC[CH]2C1=O   18.251
*20435 CC(=O)[C]1(C)CC[CH]2CCCC(C)(C)[CH]2C1    3.539
*20448 OC(=O)[CH](C1CCCCC1)C2(O)CCCCCC2    9.810
*20469 CC(C)(C)OC1=NC(=NC(=N1)OC(C)(C)C)OC(C)(C)C    5.614
*20475 CN(C)C[CH]1CCC[CH](CN2CCCCC2)C1=O   10.640
*20496 CC(C)[CH]1C[CH](OC(C)=O)[CH](C)[CH](C1)C(C)C    2.635
*20545 C[N+]1(C)CCC[CH](C1)C#CC[N+]2(C)CCCC2   18.959
*20557 CCN(CC)C1=NC(=NC(=N1)N(CC)CC)N(CC)CC    7.025
*20583 CCCCCCCCC1OCC(C)(CC)CO1    3.175
*20604 CCCCCCCCCCCCNC(=O)OCCO   10.021
*20620 CCCCS(=O)(=O)OCC(CC)(CC)COS(=O)(=O)CCCC    8.180
*20624 CC[N+]1(CC)CC[N+]2(CCC[CH](C)CC2)CC1   17.752
*20646 OC(=O)C1=CC2=C(C(=C1)O)C(=O)C3=C(C=CC=C3O)C2=O   14.959
*20664 OC1=C(C=CC=C1)C2=NC3=C(S2)N=C(S3)C4=C(O)C=CC=C4   19.770
*20670 OS(=O)(=O)C1=CC2=C(NC(C2=O)=C3NC4=CC=C(C=C4C3=O)S(O)(=O)=O)C=C1   25.963
*20671 S1C(=NC2=C1N=C(S2)C3=CC=CC=C3)C4=CC=CC=C4   11.804
*20689 CC1=CC(=C2C(=C1C(O)=O)OC3=CC(=C4C(=O)OCC4=C23)O)O   16.648
*20704 CC(=O)NC1=CC2=C(C=C1)C(=O)C3=C(C=CC=C3)C2=O   14.439
*20752 O=C(CN1C(=O)C2=C(C=CC=C2)C1=O)NC3=CC=CC=C3   13.426
*20755 OS(=O)(=O)C1=CC=C(C=C1)N=NSC2=CC3=C(C=CC=C3)C=C2   12.078
*20758 OC1=C(N=NC2=CC=C(C=C2)S(O)(=O)=O)C3=C(C=CC=C3)C=C1   16.156
*20764 OC1=C(N=NC2=CC=CC=C2)C(=CC3=CC=CC=C13)S(O)(=O)=O   16.156
*20768 CC(=CC(=O)C1=CC(=CC=C1)[N+]([O-])=O)C2=CC(=CC=C2)[N+]([O-])=O   11.248
*20791 CC(=O)C1=C2C=CC=CC2=C3C=CC=CC3=C1    7.029
*20792 O(C1=CC=CC=C1)C2=C3C=CC=CC3=CC=C2    4.939
*20801 COC(=O)C1=C2C=CC=CC2=C3C=CC=CC3=C1    6.480
*20814 OC(=O)C=CC1=CC=C(OC(=O)C2=CC=CC=C2)C=C1   10.511
*20826 O=C(CC1=CC2=C(OCO2)C=C1)C3=CC4=C(OCO4)C=C3   11.971
*20827 OC1=CC(=C(C=C1)C(=O)C=CC2=CC3=C(OCO3)C=C2)O   14.435
*20835 CC1=C2C=CC=CC2=NC(=C1)C3=CC=CC=C3    7.234
*20845 COC1=CC=C(C=C1)C(=O)[CH](C#N)C2=CC=CC=C2   10.712
*20853 OC(=O)C1=C(CC2=CNC3=C2C=CC=C3)C=CC=C1   11.799
*20862 OC(=O)CCC(=O)N1C2=C(SC3=C1C=CC=C3)C=CC=C2   14.081
*20878 NC1=C2C=CC=CC2=C(C=C1)N=NC3=CC=CC=C3    9.295
*20885 [O-][N+](=O)C1=C(NC(=N1)SOCC2=CC=CC=C2)C3=CC=CC=C3   11.762
*20891 [O-][N+](=O)C1=C(NCCN2C(=O)C3=C(C=CC=C3)C2=O)C=CC=C1   12.836
*20899 NC1=CC2=C(O)C(=C(C=C2C=C1S(O)(=O)=O)S(O)(=O)=O)N=NC3=CC=CC=C3   25.939
*20909 N#CCCNC1=CC2=C(C=C1)C3=CC=CC=C3C2   10.146
*20919 COC1=CC=C(C=C1)C2=C(N)C=C3C=CC=CC3=N2   11.955
*20922 O=C(C[N+]1=CC=NC=C1)C2=CC3=C(C=CC=C3)C=C2   15.092
*20923 O=C(C[N+]1=C2C=CC=CC2=NC=C1)C3=CC=CC=C3   15.092
*20929 O=C1NC(=O)[C](CC2=CC=CC=C2)(N1)C3=CC=CC=C3   10.866
*20931 O=C1CCC(=O)NC2=CC=C(C=C2)C3=CC=C(N1)C=C3   12.421
*20942 COC1=CC(=C(OC)C=C1)NC(=O)C(=CC2=CC=CO2)C#N   14.947
*21009 COC1=CC2=C(O[CH](CC2=O)C3=CC=CC=C3)C=C1    8.914
*21011 COC1=CC=C(C=C1)C(=O)CC(=O)C2=CC=CC=C2   10.112
*21038 COC1=CC=C(C=C1)C(=O)OCC2=CC3=C(OCO3)C=C2    9.714
*21053 C[N+]1=C(OC2=C1C=CC=C2)C=CC3=CC=CC=C3   12.472
*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
*21090 CC[CH](N1C(=O)C2=CC=CC=C2S1(=O)=O)C3=CC=CC=C3    9.416
*21094 COC1=C(OCC2=CC=CC=C2)C=C(C=C1)C=C[N+]([O-])=O    9.008
*21107 CCOC1=C(C=CC=C1)C=NNC2=NC3=CC=CC=C3O2   11.385
*21117 OC(=O)CC[CH](NC(=O)C1=CC=C(C=C1)N2N=C3NC(=N)NC(=O)C3=N2)C(O)=O   30.975
*21170 CN(C(=S)SSC(=S)N(C)C1=CC=CC=C1)C2=CC=CC=C2    3.833
*21173 CN(C)C1=CC(=C(C=C1)N=NC2=CC=C(C=C2)[N+]([O-])=O)C=C    9.325
*21186 OC1=CC(=C(C=C1)C=NNC(=N)C(=N)NN=CC2=C(O)C=C(O)C=C2)O   29.293
*21195 CCCC(=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
*21264 COC1=C(OC(=O)C2=CC=CC=C2)C=CC(=C1)[CH](C)O   10.390
*21269 COC1=CC=C(C=C1)C(O)(C(O)=O)C2=CC=C(OC)C=C2   11.710
*21272 CC1=CC=C(SC=CSC2=CC=C(C)C=C2)C=C1    5.417
*21303 CCOC(=O)[CH](NC1=CC=CC=C1)C2=CC=CC=C2    7.672
*21319 NC[CH]1COC(O1)(C2=CC=CC=C2)C3=CC=CC=C3   10.703
*21332 COC1=C(NOC(=O)CCOC2=CC=CC=C2)C=CC=C1   10.074
*21362 CCN(CC)C1=CC(=C(C=C1)N=NC2=C(C=CC=C2[N+]([O-])=O)[N+]([O-])=O)S(O)(=O)=O   17.523
*21371 CC(=C(C)C1=CC=C(N)C=C1)C2=CC=C(N)C=C2   10.420
*21377 CN(C)C1=CC=C(C=C1)N=C2C=C(C)C(=O)C(=C2)C    8.139
*21432 CC(C)(C)C1=CC=C(OC2=CC=CC=C2)C=C1    3.517
*21443 CCCC(C1=CC=C(O)C=C1)C2=CC=C(O)C=C2   10.914
*21506 CN(CC1=CC=CC=C1)[CH](CO)C2=CC=CC=C2   10.936
*21514 C[CH]1CCCN(C1)C2=C(O)C=CC3=C2C=CC=C3    8.924
*21523 COC1=CC=C(C=C1OC)[CH](N)CC2=CC=CC=C2    9.640
*21533 CCOC(=O)C1=CC=C(C=C1)N=C[CH]2CCCCC2=O    8.017
*21539 CCN(CC1=CC=C(C=C1)S(O)(=O)=O)C2=CC=CC(=C2)C   11.325
*21552 CCN(CC)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)S(O)(=O)=O   12.717
*21554 CC1=CC(=C(N=NC2=C(C)C=C(N)C(=C2)C)C(=C1)C)S(O)(=O)=O   14.444
*21564 OCCN(CCO)C1=C2N=CN(CC3=CC=CC=C3)C2=NC=N1   16.893
*21569 CCCN1C=NC2=C1N=C(N)N=C2SCCC3=CC=CC=C3    8.943
*21573 NC(=N)NC(=N)NC1=CC=C(SC2=CC=C(NC(=N)NC(N)=N)C=C2)C=C1   32.083
*21589 CC(=O)CC(C)=NC1=CC=CC(=C1)N=C(C)CC(C)=O    9.411
*21597 CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(N)C=CC=C2    9.672
*21654 CCN(CC)C[CH](O)C1=CC2=C(C=CC=C2)C=C1   10.609
*21668 CCCC[CH](CC)CN1C(=O)C2=C(C=CC=C2)C1=O    6.788
*21671 CCN(CC)CCOC(=O)CC1=CSC2=C1C=CC=C2    9.060
*21693 C[CH]1CCCCN1CCCOC2=C(C=CC(=C2)[N+]([O-])=O)C#N   10.839
*21726 CCN(CC)CCCCNC(=O)C1=NOC2=C1C=CC(=C2)[N+]([O-])=O   16.395
*21751 CCOC(=O)[CH](CCC(C)C)C(=O)C1=CC=CC=C1    6.893
*21754 CCCCOC(=O)C1=CC(=CC=C1)C(=O)OCCCC    5.914
*21853 CCCNCC(=O)NC1=CC=C(C=C1)C(=O)OCC(C)C   12.131
*21863 CCOC(=O)[CH](CS(=O)(=O)N(CC)CC)NC(=O)C1=CC=CC=C1   13.003
*21867 CC(C)(C)C1=CC(=C(O)C=C1)C2CCCCC2    5.538
*21901 C[CH]1CC(C)(C)O[CH](O1)C2=CC=C(C=C2)C(C)C    4.963
*21922 CCCCOCCOCCOC(=O)CC1=CC=CC=C1    8.097
*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
*21945 CCN(CC)CCOCC1=CC2=C(CCC2)C=C1    7.240
*21965 C[CH]1CCCCN1CCCNC(=O)C2=CC=C(N)C=C2   14.686
*21991 CCOC[CH](CN(CC)CC)OC(=O)C1=CC=C(N)C=C1   12.532
*22029 CCN(CC)CCOC1=C(C=CC(=C1)C)C(C)C    6.100
*22049 CCN(CC)CC1=C(O)C=C(CN(CC)CC)C(=C1)O   16.265
*22105 O=C1CCCCCCCCCCCCCCCO1    2.511
*22119 CCCCCC(=O)OCCCCOC(=O)CCCCC    5.026
*22161 CCCCCCCCC1OCC(CC)(CC)CO1    3.052
*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
*22253 S1C2=CC=CC=C2C=C1C3=NC4=CC=CC=C4C=C3    8.553
*22254 OC1=NN=C(C2=CC=CC=C2)C(=C1C#N)C3=CC=CC=C3   13.654
*22284 O=C(C1=CC=CC=C1)C2=C3C=CC=CC3=CC=C2    6.721
*22293 CC12C(=O)OC(=O)C(C3=C1C=CC=C3)C4=C2C=CC=C4    7.383
*22294 O=C1C[CH]2C(=O)C3=C(C=CC=C3)[C]2(O1)C4=CC=CC=C4    9.394
*22300 C1=CC2=C(C=C1)C3=C[N+]4=C(C=CC=C4)C=C3C=C2   15.394
*22306 OC1=CC=C(C=C1)C=CC2=CC=C3C=CC=CC3=N2   11.783
*22315 OC(=O)C1=C(NC2=CC3=C(C=CC=C3)C=C2)C=CC=C1   11.686
*22371 O[CH](CC1=NC2=C(C=CC=C2)C=C1)C3=CC=C(C=C3)[N+]([O-])=O   13.932
*22403 O=C(NCSC1=NC2=CC=CC=C2S1)NCSC3=NC4=CC=CC=C4S3   17.074
*22420 C[CH]1CCC2=CC3=C(SC4=CC=CC=C34)C=C2C1=O    7.883
*22431 O=C1O[CH](CC2=CC=CC=C2)[CH](C1=O)C3=CC=CC=C3    8.575
*22432 OC(=O)C1=C(C=CC=C1)C(=O)C2=CC3=C(CCC3)C=C2   10.554
*22437 CC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=CC=C3)C=C2    7.493
*22454 CC1=CC=C(NC2=CC3=C(C=CC=C3)C=C2)C=C1    6.947
*22456 CC1=C2C=C(CC3=CC=CC=C3)C=CC2=NC(=C1)O   11.152
*22459 CC1=CC=C(C=C1)[CH](O)C2=C3C=CC=CC3=CC=N2   11.607
*22470 CC1=C(CC(O)=O)C2=C(N1)C=CC(=C2)C3=CC=CC=C3   12.210
*22480 CC1=CC=C(C=C1)S(=O)(=O)NC2=C3C=CC=CC3=CC=C2    7.600
*22506 COC1=CC(=C(OC)C=C1)N=NC2=C(O)N=C3C=CC=CC3=C2O   19.148
*22516 C[N+]1=C2C=CC=CC2=C(C=CC3=CC=NC=C3)C=C1   15.356
*22520 NNC(=O)CCC1=CC2=C3C=CC=CC3=CC=C2C=C1   13.321
*22538 OC(=O)[CH]1[CH]2CC[CH](O2)[CH]1C(=O)NC3=C4N=CC=CC4=CC=C3   20.282
*22540 CC1=NC(=CC=C1)NC2=C(C)C(=O)N(C2=O)C3=NC(=CC=C3)C   15.599
*22541 CC(=O)[CH](N=NC1=C(C=C(C)C=C1)[N+]([O-])=O)C(=O)NC2=CC=CC=C2   15.542
*22579 COC1=CC=CC(=C1OC)C=C(C(O)=O)C2=CC=CC=C2   11.693
*22586 CCOC(=O)C1=CC=C(C=CC2=CC=C(C=C2)S(O)(=O)=O)C=C1   12.306
*22592 COC1=CC(=CC(=C1OC)OC)C(=O)C2=CC3=C(OCO3)C=C2   12.331
*22607 O[CH](C[N+]1=CC2=CC=CC=C2C=C1)C3=CC=CC=C3   16.240
*22614 CCCC(=O)NC1C2=C(OC3=C1C=CC=C3)C=CC=C2   10.553
*22635 CCNC(=N)NC1=C2C=CC=CC2=C3C=CC=CC3=C1   12.446
*22675 CC1=CC(C)(C)NC(=S)N1C2=CC3=C(C=CC=C3)C=C2    6.016
*22718 CCCOC1=CC=C(OCC(=O)C2=CC=CC=C2)C=C1    7.504
*22760 CN(C)CCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2    9.305
*22805 COC1=CC=C(C=C1)C(=O)[CH](NCCO)C2=CC=CC=C2   13.991
*22832 NC1=NC(=C2N=CN([CH]3O[CH](CO)[CH](O)[CH]3O)C2=N1)SCC4=CC=CC=C4   19.442
*22834 CN1C(=O)N(C)C2=C(N(C)C(=N2)NN=CC3=CC=C(NC(C)=O)C=C3)C1=O   20.504
*22851 CCOC(=O)C1=C2C=CC=CC2=NC(=C1)N3CCCCC3   10.015
*22889 CN1C(=O)N(C)C2=C(N(C)C(=N2)CC3=NC4=C(N3C)C(=O)N(C)C(=O)N4C)C1=O   22.873
*22935 CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2    8.432
*22944 CC(C)CC[N+]1=CC=CC(=C1)C(=O)C2=CC=CC=C2   12.775
*22950 CC(C)(C)C1=CC(=C(O)C=C1)CNC2=CC=CC=C2   10.042
*22959 CN[CH](CC1=CC=C(OC)C=C1)C2=CC=C(OC)C=C2    9.298
*22964 CN(CC1=C(O)C(=CC=C1)C)CC2=C(O)C(=CC=C2)C   14.503
*23014 CC(C)NC1=NC(=C2C=NN(C3=CC=CC=C3)C2=N1)NC(C)C   14.327
*23018 CC1=C2C(=O)CCC2=C3C(=C1)C(C)(C)CC3(C)C    4.932
*23023 CCC1=C(CC[CH]([CH]1C)C(O)=O)C2=CC=C(OC)C=C2    8.193
*23024 COC1=CC=C(C=CC(=O)OCC2CCCCC2)C=C1    6.228
*23087 C[CH]1CCCCCN1CCCOC(=O)C2=CC=C(C=C2)[N+]([O-])=O    9.662
*23105 O=C(CCC1CCCCC1)OCCOC2=CC=CC=C2    5.491
*23107 CCOC(=O)C(C(=O)OCC)C(C)(C)CC1=CC=CC=C1    6.735
*23119 CCCC1=C(OCC=C)C(=CC(=C1)C(=O)NC)CCC    8.845
*23144 CCCN(CC)CCNC1=C2N=CC=CC2=CC(=C1)OC   13.312
*23164 CC1=C[N+](=CC=C1)CCCCC[N+]2=CC(=CC=C2)C   11.936
*23200 CCC[CH]1O[C](C)(CC2=CC=CC=C2)OC[CH]1CC    4.759
*23225 CCCCC1(CC)COC(OC1)C2=C(OC)C=CC=C2    6.111
*23243 CCN(CC)CCOC1=CC=C(C[CH](C)C(C)=O)C=C1    9.315
*23249 CCCCNC1=CC(=C(C=C1)C#N)OCCN(CC)CC   11.188
*23262 CCN(CC)C1=CC=CC(=C1)C(=O)OCCNCC(C)C    9.166
*23263 CCCCNC1=CC(=CC=C1)C(=O)OCCNCC(C)C   10.355
*23289 CC(C)C1=CC(=C(CN(C)C)C(=C1C)C)C(C)C    4.866
*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
*23313 CN(C)CCOC(=O)C1CC2(C1)CC(C2)C(=O)OCCN(C)C   12.714
*23325 O=C(CCCCCC1CCCCC1)OC[CH]2CCCO2    5.699
*23361 CCCCCC[CH](C)C(CC)(C(=O)OCC)C(=O)OCC    4.903
*23369 CCCCCCCCCCCC(=O)CN1CCOCC1    7.243
*23384 CCCCCCCCCCCCOC(=N)N1CCOCC1    8.703
*23416 CCCCN(CCCC)C(=N)OCC(C)(C)CC(C)C    6.292
*23421 CCCCCCCCCCCCCCCCCO    3.401
*23435 O=C1C=CC(=O)N1C2=C3C=CC=C(N4C(=O)C=CC4=O)C3=CC=C2   16.914
*23441 O=C1OC(=O)C2=C1C3C4=C(C=CC=C4)C2C5=C3C=CC=C5    8.073
*23460 [O-][N+](=O)C1=CC(=C(NN2C3=C(C=CC=C3)C4=CC=CC=C24)C(=C1)[N+]([O-])=O)[N+]([O-])=O   11.545
*23462 C1=CC2=CC3=C(C=C2C=C1)C4=C(C=CC=C4)C=C3    5.300
*23465 O=C1C=CC(C=C1)=NC2=CC3=C(NC4=CC=CC=C34)C=C2   11.013
*23494 C1C2=CC=CC=C2C3=C1C=C(C=C3)N=CC4=CC=CO4    5.516
*23504 C1C2=CC=CC=C2C3=C1C=C(C=C3)N=CC4=CC=CS4    5.780
*23512 NC1=NC(=C2N=C(C3=CC=CC=C3)C(=NC2=N1)C4=CC=CC=C4)S   11.251
*23513 C1=CC=C(C=C1)C2=CC=CC(=C2)C3=CC=CC=C3    4.498
*23517 COC1=CC2=C(SC3=NC4=CC=CC=C4S3)C=C(C)N=C2C=C1   13.740
*23554 [O-][N+](=O)C1=CC=C(C=C1)N=NNC2=CC=C(C=C2)N=NC3=CC=CC=C3   12.179
*23566 CC(=O)OC1=C2C=CC=CC2=C(OC(C)=O)C3=C1C=CC=C3    8.129
*23576 CC1=C2C(=C[N+]3=CC=CC=C13)C=CC4=C2C=CC=C4   15.351
*23579 OC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CN=C3   11.733
*23587 COC(=O)C1=C2C=CC=CC2=NC(=C1C)C3=CC=CC=C3    9.425
*23590 CC1=CC=C(NC(=O)C2=CC3=C(C=CC=C3)C=C2O)C=C1   10.764
*23596 COC1=CC=C(NC(=O)C2=CC3=C(C=CC=C3)C=C2O)C=C1   12.034
*23605 OS(=O)(=O)C1=CC=CC(=C1)N=NC2=CC=C(NC3=CC=CC=C3)C=C2   14.873
*23617 O=S(=O)(NC1=CC(=C(NS(=O)(=O)C2=CC=CC=C2)C=C1)N3N=N3)C4=CC=CC=C4   13.240
*23632 O=C(N1CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)N4CC4   12.301
*23641 CC1=CC(=C(C=C1)N=NC2=C3C=CC(=CC3=CC=C2O)S(O)(=O)=O)C   16.071
*23647 NC1=CC2=[N+](C3=CC=CC=C3)C4=CC(=CC=C4N=C2C=C1)N   22.900
*23670 O=C(OCC=CC1=CC=CC=C1)C=CC2=CC=CC=C2    6.614
*23694 CNC(=O)C1(CC=C)C2=C(C=CC=C2)C3=CC=CC=C13   10.012
*23702 COC1=CC2=C(C=C1)N=C(CCC3=CC=CC=C3)C=C2    8.317
*23708 CSC1=CC=C(C=C1)C(=O)C[N+]2=CC3=CC=CC=C3C=C2   16.244
*23712 COC1=CC=C(C=C1)C(=O)C[N+]2=CC3=CC=CC=C3C=C2   15.936
*23730 CCOC1=CC=C(NC2=CC3=CC(=CC(=C3C=C2)O)S(O)(=O)=O)C=C1   18.408
*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
*23783 CC1=CC2=C(C=C1C)N(CCOC(=O)CCC(O)=O)C3=NC(=O)NC(=O)C3=N2   17.695
*23795 C[C](O)(C#C[C](C)(O)C1=CC=CC=C1)C2=CC=CC=C2    9.783
*23820 CC(=O)O[CH]([CH](OC(C)=O)C1=CC=CC=C1)C2=CC=CC=C2    8.442
*23821 CCCCOC(=O)C1=CC=C(OC(=O)C2=CC=CC=C2)C=C1    6.714
*23845 CN(C)C[CH](O)C1=C2C=CC=CC2=C3C=CC=CC3=C1   11.866
*23846 CC1=CC2=CC=CC=C2C=[N+]1C[CH](O)C3=CC=CC=C3   16.197
*23851 S=C(CC1=CC=C(C=C1)C2=CC=CC=C2)N3CCOCC3    8.879
*23856 CC(=O)OC1=CC(=CC=C1)CN2CCC3=C(C2)C=CC=C3    8.857
*23861 CCCCN1C(=C2C(=O)C3=C(C=CC=C3)C(=O)C2=C1C)C    9.488
*23888 COC1=CC=C(NC2=NC(=NC(=C2)NC3=CC=C(OC)C=C3)N)C=C1   15.312
*23921 CCN(CCOC(=O)COC1=CC=C(C=C1)[N+]([O-])=O)C2=CC=CC=C2   10.363
*23938 COC1=C(C=CC=C1)C=NNC(=N)C(=N)NN=CC2=C(OC)C=CC=C2   15.818
*23942 S=C(NCCNC(=S)SSC(=S)NNC1=CC=CC=C1)SSC(=S)NNC2=CC=CC=C2   15.213
*23960 CCC[CH]1[CH](CC2=C1C=CC(=C2)O)C3=CC=C(O)C=C3   11.105
*23989 CCN(CC)C(=O)C(C1=CC=CC=C1)C2=CC=CC=C2    9.208
*24038 C[C]12CC[CH]3[CH](CCC4=C3C=C(C(=C4)O)[N+]([O-])=O)[CH]1CCC2=O    8.324
*24089 COC1=C(NC(=O)NC2=CC(=C(O)C=C2C)C(C)C)C=CC=C1   14.833
*24100 CC1=CC=C(C=C1)N2CCN(CC2)CSC3=CC=CC=C3    7.562
*24165 C[N+](C)(CC=CC1=CC=CC=C1)CC2=CC=CC=C2   14.903
*24182 C[CH](O)CN[CH](CC1=CC=CC=C1)C2=CC=C(C)C=C2   10.991
*24202 COCCN(C)[CH]([CH](O)C1=CC=CC=C1)C2=CC=CC=C2   12.745
*24204 O=C1CC2(CCCCC2)CC(=O)N1CCC3=CC=CC=C3    7.842
*24219 COC1=C(OC)C=C(C[CH](N)C2=CC=C(OC)C(=C2)OC)C=C1   12.095
*24231 CCOC(=O)C(CCC(=O)C1=CC=CC=C1)(NC(C)=O)C(=O)OCC   14.939
*24272 CC1=C2CCC(=O)C2=C3C(=C1)C(C)(C)CCC3(C)C    4.810
*24286 COC1=C(COC(=O)[CH]2[CH](C=C(C)C)C2(C)C)C=CC=C1    5.432
*24289 CC[CH]1C2=C(CC[C]1(C)C(O)=O)C3=C(C[CH](O)CC3)C=C2   11.513
*24308 CCCC[CH](CC)CN1C(=O)C=C(C)C2=C1C=CC=C2    6.812
*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
*24325 COC1=CC(=C2N=CC=CC2=C1)NCCCC3CCNCC3   13.764
*24330 C1CN(CCO1)CCN2CC[CH](C2)C3=CNC4=C3C=CC=C4   14.770
*24344 O=S(=O)(N1CCC[CH]2CCCC[CH]12)C3=CC4=C(NCCC4)C=C3    8.842
*24353 CCC[CH](C)OC(=O)C1=CC=CC(=C1)NC(=O)CN2CCOCC2   14.077
*24363 CC(C)[CH]1CCC(C)(C)C2=C1C=C(C)C(=C2)C(C)=O    4.375
*24402 COC1=C2CCCCC2=C(C=C1)[CH](O)CN3CCCCC3   11.082
*24404 CCCCOC1=CC=C(C=C1)C(=O)CCN2CCCCC2    9.035
*24440 CC(C)(C)C1=CC2=C(C=C1)C(C)(C)CCC2(C)C    1.388
*24443 CN(C)CC[C](C1CCCCC1)(C(N)=O)C2=CC=CC=C2   11.721
*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
*24458 CCCCN(CCCC)CCCN1C(=O)C2=C(C=CC=C2)S1(=O)=O   10.889
*24487 CCCCCCCCCCOC(=O)C1=CC=C(OC)C=C1    4.580
*24500 CCCCOCCOCCOC(=O)CC1=CC(=C(OC)C=C1)OC   10.553
*24514 CCC[CH](O)[CH](C(=O)OCCN(CC)CC)C1=CC=CC=C1   11.728
*24545 CCCOC(=O)[CH](C)OC(=O)OCCOCCOC(=O)O[CH](C)C(=O)OCCC    9.775
*24546 CC(C)COC(=O)COC(=O)OCCOCCOC(=O)OCC(=O)OCC(C)C    9.775
*24562 CCCCCC[CH](C)C1=CC(=C(O)C(=C1)CN(C)C)C    8.565
*24563 CCN(CC)CCOC1=C(C=CC=C1C(C)C)C(C)C    5.854
*24625 CCC[CH](C)OC1=NC(=NC(=N1)O[CH](C)CCC)O[CH](C)CCC    5.246
*24631 CCCCCC[C](C)(O)C#C[C](C)(O)CCCCCC    6.120
*24640 CCCCCCCCCCCC[CH](C(C)=O)C(=O)OCC    5.329
*24656 CCCCCCCCC=CCCCCCCCC(N)=O    6.038
*24669 OCCN(CCO)C(=O)CCCCCCCCC(=O)N(CCO)CCO   17.599
*24701 CCCCCCCCCC(CO)CCCCCCC    3.278
*24715 CCCCN(CCCC)CCCCCCCCCCO    7.029
*24731 [O-][N+](=O)C1=CC(=C(NN=C2C3=C(C=CC=C3)C4=CC=CC=C24)C=C1)[N+]([O-])=O   11.405
*24743 O=C(N1C2=CC=CC=C2C3=CC=CC=C13)C4=CC=CC=C4    8.660
*24745 O=C1C2=C(C=CC=C2)N(C3=CC=CC=C3)C4=C1C=CC=C4    8.053
*24778 O=C(C=CC1=C2C=CC=CC2=CC=C1)C3=CC=CC=C3    7.646
*24795 OC1=CC=C(C=C1)C2(OS(=O)(=O)C3=CC=CC=C23)C4=CC=C(O)C=C4   16.682
*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
*24846 CC1=C(C=CC=C1)C2=NC3=C(N)N=C(N=C3N=C2N)C4=CC=CC=C4   18.903
*24850 O=C(NNC(=O)C1=CC=NC=C1)NC2=CC=C(C=C2)N=NC3=CC=CC=C3   20.714
*24851 NC1=NC2=C(N=CN2CC3=CC=CC=C3)C(=N1)SCC4=C(C=CC=C4)[N+]([O-])=O   12.810
*24852 OC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3    8.848
*24881 O=C([CH](C1=CC=CC=C1)[N+]2=CC=CC=C2)C3=CC=CC=C3   14.790
*24883 OC(CC1=CC=CN=C1)(C2=CC=CC=C2)C3=CC=CC=C3   11.609
*24887 C1OC2=CC=C3C=CC=CC3=C2CN1CC4=CC=CC=C4    8.040
*24900 CCOC=C1N=C(OC1=O)C(C2=CC=CC=C2)C3=CC=CC=C3    7.046
*24905 COC1=CC=C(C=C1OC)C(=O)NC2=C3C=CC=CC3=CC=C2O   16.363
*24930 C1CN(CCO1)C2=C(N=C3C=CC=CC3=C2)C4=CC=CC=C4   11.240
*24978 CC[N+]1=C2C=C(N)C3=C(C=CC=C3)C2=NC4=CC(=CC=C14)C   16.523
*24982 CN(CCOC(=O)C1=CC=C(C=C1)[N+]([O-])=O)CCOC(=O)C2=CC=C(C=C2)[N+]([O-])=O   15.652
*24990 CC(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3[CH]2N4CCOCC4   15.186
*24995 CN1C(=NC2=C1C=CC=C2)CCCC3=NC4=CC=CC=C4N3C    8.750
*25021 OC[CH]1O[CH](O[CH]2CO[CH](O[CH]12)C3=CC=CC=C3)C4=CC=CC=C4   15.247
*25050 O=C([CH](CC1=CC=CC=C1)N2CCOCC2)C3=CC=CC=C3   10.147
*25051 O=C(C[CH](N1CCOCC1)C2=CC=CC=C2)C3=CC=CC=C3   11.447
*25052 CCN(CC)CCOC1=CC2=C(C=C1)C3=CC=CC=C3C2=O   10.333
*25106 COC1=C(OC)C=C(C=C1)C=NNC(=S)NN=CC2=CC(=C(OC)C=C2)OC   13.045
*25121 CCOC(=O)[CH](CC)C(O)(C1=CC=CC=C1)C2=CC=CC=C2    9.886
*25154 CCN(CC)C[CH](OC1=CC=CC=C1)C(=O)C2=CC=CC=C2    9.457
*25176 CCOC(=O)CCC1=C(NC2=C1C(=CC=C2)C(=O)OCC)C(=O)OCC   12.523
*25177 CCOC(=O)[CH](C#N)[CH](C(C(=O)OCC)C(=O)OCC)C1=CC=CC=C1   12.863
*25181 COC1=CC2=C(NCCNC[CH](C)O)C3=C(C=CC=C3)N=C2C=C1   19.225
*25189 CN1CCC[CH](C1)NC(C2=CC=CC=C2)C3=CC=CC=C3   10.256
*25204 CCN(CC)C[CH](OC(=O)C1=CC=C(N)C=C1)C2=CC=CC=C2   11.939
*25206 CCOC1=CC=C(NC(=O)NC2=CC(=CC=C2C)C(C)C)C=C1   10.728
*25214 CCCCCC(=O)NC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(NCS(O)(=O)=O)C=C2   19.260
*25236 CC1=CC(=CC2=C1[CH]3CC[C]4(C)[CH](O)CC[CH]4[CH]3C=C2)O   10.780
*25250 C[C]12CC[C]3(O)[CH](CCC4=CC(=O)C=C[C]34C)[CH]1CCC2=O   12.200
*25256 C[C]12C[CH](O)[CH]3[CH](CCC4=CC(=O)C=C[C]34C)[CH]1CCC(=O)O2   11.652
*25261 CCN(CC)CCC(C1=CC=CC=C1)C2=CC=CC=C2    6.131
*25276 CCN(CC)CCCOC(=O)CC1=C2C=CC=CC2=CC=C1    8.672
*25281 CCCCN[CH]([CH](O)C1=CC=C(OC)C=C1)C2=CC=CC=C2   12.138
*25301 CN(CC(O)CN(C)CC1=CC=CC=C1)CC2=CC=CC=C2   14.119
*25316 C[CH]1CCC(=O)C2=C3C(=CC(=C12)C)C(C)(C)CC3(C)C    4.686
*25321 COC1=CC2=C(C=C1)[CH]3CC[C]4(C)[CH](S)CC[CH]4[CH]3CC2    4.697
*25328 C[C]12CC[CH]3[CH](CC=C4CC(=O)CC[C]34C)[CH]1CCC2=O    7.161
*25329 C[C]12CCC(=O)C[CH]1CC=C3[CH]2CC[C]4(C)[CH]3CCC4=O    7.161
*25388 C[C]12CC[CH]3[CH](CCC4=CC(=O)CC[C]34C)[CH]1CC[CH]2S    5.466
*25412 CCCCCCC(C(=O)OCC)(C(=O)OCC)C1=CC=CC=C1    6.488
*25418 CC[N+](CC)(CC)CCOCC1=C2C=CC=CC2=CC=C1   16.122
*25421 CCN(CC)CCOC(=O)C1(CCCCC1)C2=CC=CC=C2    7.524
*25431 CCN(CC)CC[C](C(O)=O)(C1=CC=CC=C1)C2(O)CCCC2   14.344
*25439 CCCCOC(=O)C[CH](NS(=O)(=O)C1=CC=C(C)C=C1)C(=O)OCCCC    9.075
*25467 CCCCCOC(=O)C1=CC=C(NC(=O)CCN(CC)CC)C=C1   12.845
*25471 CCCCN(CCCC)CCOC(=O)C1=C(C)C(=CC=C1C)[N+]([O-])=O    9.221
*25487 CCCCC1(CC)COC(OC1)C2=CC=C(C=C2)C(C)C    4.595
*25500 COC1=CC=C(CC[C]2(C)OCC(C)(C)[CH](O2)C(C)C)C=C1    5.866
*25527 CC(C)(C)CC(C)(C)C1=CC=C(OCCOCCSC(N)=N)C=C1   11.759
*25559 CC[N+](CC)(CCC#CC[N+](CC)(CC)CC#C)CC#C   19.569
*25604 CCCCCCCCCCCCCCCCCCOC=O    1.527
*25625 CCCCCCCCCCCCCCCCSC(NC)=NC    6.086
*25627 CCCCCCC(O)(CCCCCC)CCCCCC    3.155
*25632 CCCCN(CCCC)CCCN(CCCC)CCCC    6.020
*25641 [O-][N+]1=C(C(=O)C2=CSC3=C2C=CC=C3)C(=NO1)C(=O)C4=CSC5=C4C=CC=C5   18.160
*25658 OC1=C2C=CC3=CC=CC4=CC=C(C5=C1C=CC=C5)C2=C34   10.074
*25680 C1=CC=C2C=C(C=CC2=C1)C3=C4C=CC=CC4=CC=C3    5.405
*25683 C1=CC=C(C=C1)N=NC2=CC3=C(C=C2)C4=C(C=CC=C4)C=C3    6.854
*25686 N#CC(C1=CC=CC=C1)=C(C2=CC=CC=C2)C3=CC=NC=C3   10.790
*25692 O=NN(C1=CC2=C(C=CC=C2)C=C1)C3=CC4=C(C=CC=C4)C=C3    7.936
*25716 OC1=C(N=NC2=CC3=C(C=C2)C=C(C=C3)S(O)(=O)=O)C4=C(C=CC=C4)C=C1   17.167
*25762 OC1=CC=C(C=C1)C2(OC(=O)C3=C2C=CC=C3)C4=CC=C(O)C=C4   15.047
*25765 OC1=CC=C(C=C1)C(=O)C2=CC=CC(=C2)C(=O)C3=CC=C(O)C=C3   17.120
*25772 N#CC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3    7.793
*25781 O=C(NC1C2=C(OC3=C1C=CC=C3)C=CC=C2)C4=CC=CC=C4   11.502
*25784 O=C(NC1C2=C(OC3=C1C=CC=C3)C=CC=C2)C=CC4=CC=CO4   12.427
*25785 ON=C1OC(C2=CC=C(O)C=C2)(C3=CC=C(O)C=C3)C4=C1C=CC=C4   18.967
*25833 COC1=CC=C2C=CC=CC2=C1C(=O)C=CC3=CC=CC=C3    8.873
*25843 O=C(OC1=CC=C(OCC2=CC=CC=C2)C=C1)C3=CC=CC=C3    7.213
*25855 O[C](CC1=CC=CC=N1)(C(=O)C2=CC=CC=C2)C3=CC=CC=C3   10.762
*25863 COC(=O)CCC1=CC=C(C=C1)C(=O)CN2C(=O)C3=C(C=CC=C3)C2=O   12.682
*25872 C(C1=CC=CC=C1)C2=CC=C(CC3=CC=CC=C3)C=C2    4.369
*25924 OC(=O)C[CH]1CCCC2=C1C=C3C=CC4=C(C=CC=C4)C3=C2    9.319
*25928 O=S(=O)(SCC1=CC=CC=C1)C(C2=CC=CC=C2)C3=CC=CC=C3    8.295
*25949 O=C(C1=CC=CC=C1)C2=C[N+](=CC=C2)CCC3=CC=CC=C3   14.236
*25976 CC(=O)N(CC1=CC=CC=C1)[CH]2CC(=O)N(CC3=CC=CC=C3)C2=O   14.276
*26018 O=C(NC1C2=C(OC3=C1C=CC=C3)C=CC=C2)OC4CCCCC4    9.991
*26031 CN(C)C1=CC=C(C=C1)C=CC2=C3C=CC=CC3=[N+](C)C=C2   14.271
*26048 CC(=O)NC1=CC=C(C=C1)C=NCCN=CC2=CC=C(NC(C)=O)C=C2   14.240
*26050 O=C(CCSCCC(=O)NN=CC1=CC=CC=C1)NN=CC2=CC=CC=C2   14.627
*26052 CC(=NNC(=O)CSCC(=O)NN=C(C)C1=CC=CC=C1)C2=CC=CC=C2   14.627
*26101 O=C(C[CH](N1CCCCC1)C2=CC=CC=C2)C3=CC=CC=C3    9.269
*26106 CCCCCCSC(=S)NC1C2=C(OC3=C1C=CC=C3)C=CC=C2    6.848
*26107 CCN(CC)C[CH](O)C1=CC2=C3C=C(O)C=CC3=CC=C2C=C1   15.602
*26122 CCCCCCOC(=O)NC1C2=C(OC3=C1C=CC=C3)C=CC=C2    9.635
*26136 COC1=CC(=CC(=C1OC)OC)C2=[N+](C)CCC3=C2C=C4OCOC4=C3   19.573
*26140 COC1=CC(=CC(=C1OC)OC)[C]2(O)N(C)CCC3=C2C=C4OCOC4=C3   16.693
*26143 CN(C)CCN(CC1=CC=CC=C1)C2=NC3=C(C=CC=C3)C=C2   12.235
*26152 C[N+]1(C)CCN(CC1)C(=O)C2C3=C(C=CC=C3)C4=CC=CC=C24   21.592
*26156 CN(C(=O)CCCCC(=O)N(C)C1=CC=CC=C1)C2=CC=CC=C2    9.094
*26172 C(CNC[CH]1COC2=C(O1)C=CC=C2)NC[CH]3COC4=C(O3)C=CC=C4   15.951
*26183 COC1=C(NC(=O)N2CCN(CC2)C(=O)NC3=C(OC)C=CC=C3)C=CC=C1   22.783
*26190 COC1=CC=CC(=C1OC)C=NNC(=N)C(=N)NN=CC2=C(OC)C(=CC=C2)OC   18.274
*26198 CCC(=C(CC)C1=CC=C(OC)C=C1)C2=CC=C(OC)C=C2    5.728
*26245 C[C](CN1CCCC1)(OC2=CC=CC=C2)[CH](O)C3=CC=CC=C3   12.072
*26260 C(COC1=C(OCC2=CC=CC=C2)C=CC=C1)CN3CCOCC3   11.040
*26275 C[CH](N1CCN(CC1)[CH](C)C2=CC=CC=C2)C3=CC=CC=C3    9.914
*26291 CC(C)(C)C1=CC=C(C=C1)N=[N+]([O-])C2=CC=C(C=C2)C(C)(C)C   11.104
*26304 OC1=C(C=CC=C1)C=NCCNCCNCCN=CC2=C(O)C=CC=C2   20.570
*26318 C[C]12CC[CH]3[CH](CCC4=C3CCC(=O)C4)[CH]1CC[C]2(O)C#C    8.893
*26325 CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)C(C)(C)C    5.780
*26326 CCCC1=C(O)C=C(CSCC2=CC=C(C(C)C)C(=C2)O)C=C1   12.678
*26336 CCCOC(=O)[CH]1[CH](C)CC2=C(C=C3OCOC3=C2)[CH]1C(=O)OCCC    9.860
*26339 CC(C)C1=CC2=C(C=C1)[C]3(C)CCC[C](C)(C#N)[CH]3CC2    5.003
*26349 CC(C)C1=CC2=C(C=C1)[C]3(C)CCC[C](C)(N=C=O)[CH]3CC2    3.521
*26355 OC[CH]1O[CH](OC[CH]2O[CH](O[CH](C#N)C3=CC=CC=C3)[CH](O)[CH](O)[CH]2O)[CH](O)[CH](O)[CH]1O   22.500
*26359 COC1=C(C[CH](C)N[CH](C)CC2=C(OC)C=CC=C2)C=CC=C1    8.928
*26367 CCOCCOC1=C(C=CC=C1)[CH](CC2=CC=CC=C2)NCCO   14.069
*26372 CC(=O)OCC(C(=O)OC1CC2C3OC3C(C1)[N+]2(C)C)C4=CC=CC=C4   21.801
*26384 CCN(CC)CCN[CH]([CH](O)C1=CC=CC=C1)C2=CC=CC=C2   14.214
*26391 CCCNS(=O)(=O)C1=CC=C(OCCOC2=CC=C(C=C2)S(=O)(=O)NCCC)C=C1   12.775
*26394 C1CCC(CC1)N(CSC2=NC3=C(S2)C=CC=C3)C4CCCCC4    8.078
*26463 CC(C)C1=CC2=CC[CH]3[C](C)(CCC[C]3(C)C(O)=O)[CH]2CC1    5.170
*26471 CCCCCC(=CC1=CC=CC=C1)[CH]2O[CH](C)CC(C)(C)O2    4.703
*26490 CCCCOC(=O)C1=CC=CC(=C1)C(=O)OC[CH](CC)CCCC    5.420
*26516 CCN(CC)CCC[CH](C)NC1=C2C=C(C)C(=CC2=NC=C1)C   11.752
*26537 C[CH](N1CCN(C)CC1)[C](O)(C2CCCCC2)C3=CC=CC=C3   12.876
*26556 CCCCCCCCCCCCC1=CC=C(C=C1)C(C)=O    3.613
*26566 C[CH]1C[C]2(C)[CH](CC[CH]3[CH]4CC[CH](O)[C]4(C)CC[CH]23)CC1=O    8.073
*26584 CCCCCCCCCCCCN1C(=O)[CH]2CC=CC[CH]2C1=O    5.821
*26595 C[CH]1CC[C]2(C)[CH](CC[CH]3[CH]4CC[CH](O)[C]4(C)CC[CH]23)C1    4.654
*26623 O=C(CCCCCCCCC(=O)N1CCCCC1)N2CCCCC2    9.315
*26631 CCCCCC=CCC=CCCCCCCCC(=O)OCC    1.775
*26634 CCCC[CH](C)CCOC(=O)C=CC(=O)OCC[CH](C)CCCC    5.135
*26635 CCCCCCC(C1CCCCCC1)(C(=O)OCC)C(=O)OCC    4.889
*26636 CCCCOCCOCCOC(=O)CCCCC[CH]1CCCC=C1    6.185
*26663 CC1CCC(CC1)CCN(C)CCC2CCCCCCC2    3.057
*26670 CC(C)(C)CC(C)(C)NCC#CCNC(C)(C)CC(C)(C)C    7.538
*26676 CCCCCCCCCCCCCCCC(=O)OCCCC    1.664
*26677 CCCCCCCCCCCCCCCCCCOC(C)=O    1.664
*26678 CCCCCCCCCCCCCCCCCC(=O)OCC    1.664
*26680 CCCCCCCCCCCCCCCC(=O)O[CH](C)COC    3.719
*26684 CCCCCCCCCCCC(=O)OCCOCCOCCCC    5.775
*26715 [O-][N+](=O)C1=CC2=C(C=C1)C(=O)N(C3C4=C(OC5=C3C=CC=C5)C=CC=C4)C2=O   13.242
*26719 O=C1N(C2C3=C(OC4=C2C=CC=C4)C=CC=C3)C(=S)SC1=CC5=CC=CS5   11.799
*26720 O=C1N(C2C3=C(OC4=C2C=CC=C4)C=CC=C3)C(=O)C5=C1C=CC=C5   10.839
*26749 CC1=CC=C(NC2=C3C(=O)C4=CC=CC=C4C(=O)C3=C(O)C=C2)C=C1   13.048
*26776 COC1=CC=C(C=C1)C=C2C3=C(C=CC=C3)C4=CC=CC=C24    6.943
*26777 COC1=CC=C(C=C1)C23C(C4=CC=CC=C24)C5=CC=CC=C35    6.388
*26782 COC1=C(C=CC=C1)C23C4=CC=CC=C4C2(O)C5=CC=CC=C35   10.827
*26831 C1=CC=C(C=C1)C=NC(N=CC2=CC=CC=C2)C3=CC=CC=C3    4.274
*26881 CN(C1=CC2=C(C=C1)C3=CC=CC=C3C2)S(=O)(=O)C4=CC=C(C)C=C4    6.785
*26903 CCN(CC1=CC=CC=C1)C2=CC(=C(C=C2)N=NC3=CC=C(C=C3)[N+]([O-])=O)S(O)(=O)=O   16.335
*26929 CC1=CC=C(C=C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3    6.210
*26930 C(N(CC1=CC=CC=C1)CC2=CC=CC=C2)C3=CC=CC=C3    7.717
*26979 CCOC(=O)C(CC1=CC=C(C=C1)[N+]([O-])=O)(CC2=CC=C(C=C2)[N+]([O-])=O)C(=O)OCC   12.879
*26984 CCC(=O)OC1=CC=C(C=C1)C(=CC)C2=CC=C(OC(=O)CC)C=C2    7.305
*27015 CC1=C2SC3=CC=CC=C3C(=O)C2=C(NCCN4CCCCC4)C=C1   13.524
*27029 CC(C)(C1=CC=C(OC[CH]2CO2)C=C1)C3=CC=C(OC[CH]4CO4)C=C3   10.358
*27030 CCOC(=O)C(CC1=CC=CC=C1)(CC2=CC=CC=C2)C(=O)OCC    8.073
*27033 CCOC(=O)[CH]([CH](C(=O)OCC)C1=CC=C(OC)C=C1)C2=CC=CC=C2    9.424
*27040 CCOC(=O)C[C](O)(C1=CC2=C(OCO2)C=C1)C3=CC(=C(OC)C(=C3)OC)OC   16.752
*27044 O=C1CCCC[CH]1CN(CC2=CC=CC=C2)CC3=CC=CC=C3    9.660
*27052 CCOC(=O)C(N1CCCCC1)(C2=CC=CC=C2)C3=CC=CC=C3    7.810
*27053 CN1O[CH]2CC[CH]1C[CH](C2)OC(C3=CC=CC=C3)C4=CC=CC=C4    9.186
*27055 CCN(CC)C[CH]1CC(C(=O)O1)(C2=CC=CC=C2)C3=CC=CC=C3    9.110
*27063 CCOC(=O)N1CCCC[CH]1C(O)(C2=CC=CC=C2)C3=CC=CC=C3   13.082
*27067 CCOC(=O)[CH](NC(=O)C1=CC=CC=C1)C(C)(C)SCC2=CC=CC=C2   12.209
*27093 COC(=O)[CH]1[CH](O)CC[CH]2CN3CCC4=C(NC5=CC=CC=C45)[CH]3C[CH]12   16.538
*27098 COC1=CC(=CC(=C1OC)OC)C(=O)NC2=CC=C(C=C2)N3CCCCC3   14.382
*27101 CCN(CC)CCOC(=O)C1=CC=C(C=C1)N=NC2=C(O)C=CC(=C2)NC(C)=O   19.883
*27109 CC1=CC=C(O)C2=C1CC[CH]3[CH]2CC[C]4(C)[CH]3CC[C]4(O)C#C   11.057
*27120 CC(=O)OC1=CC2=CC[CH]3[CH]4CCC(=O)[C]4(C)CC(=O)[C]3(S)[C]2(C)CC1   10.479
*27128 CCCCN(CCCC)C1=CC2=C(C=C1)C3=CC=CC=C3[CH]2O    9.274
*27129 CCC(=O)C(C[CH](C)N(C)C)(C1=CC=CC=C1)C2=CC=CC=C2    9.304
*27131 CCC(=O)C(CCCN(C)C)(C1=CC=CC=C1)C2=CC=CC=C2    9.304
*27134 C1CCN(CC1)CCOC2=CC=C(CCC3=CC=CC=C3)C=C2    7.592
*27143 C[CH]1COC[CH](C)N1C[CH](OCC2=CC=CC=C2)C3=CC=CC=C3   10.350
*27145 CC[N+](C)(CC)CC[C]1(C(=O)OC2=C1C=CC=C2)C3=CC=CC=C3   16.672
*27146 OCCOC1=C(C=CC=C1)[CH](CC2=CC=CC=C2)N3CCCCC3   12.029
*27166 CC=C1CN2CC[CH]1C[CH]2[CH](O)C3=C4C=C(NCCO)C=CC4=NC=C3   18.119
*27167 CN(C)CCC(C(=O)NCC1=CC=CC=C1)C(=O)NCC2=CC=CC=C2   16.131
*27185 CCN(CC)C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)N(CC)CC    8.818
*27197 CCOC(=O)C1=C(C)C(=C(CC2=C(C)NC(=C2C(=O)OCC)C)N1)C(=O)OCC   14.939
*27210 CC(C)(C)C1=CC(=C(O)C=C1)CC2=C(O)C=CC(=C2)C(C)(C)C   10.461
*27211 OC(=O)CCCCCCCCCCSC1=CC2=C(C=CC=C2)C=C1    8.836
*27228 CC(=O)S[CH]1CC(=O)C=C2CC[CH]3[CH]4CCC(=O)O[C]4(C)CC[CH]3[C]12C    9.959
*27229 C[C]12CCC(=O)C=C1CC[CH]3[CH]4CC[C](O)(C(=O)CS)[C]4(C)CC(=O)[CH]23   12.863
*27253 CC[CH]([CH](CC)C1=CC=C(C=C1)N(C)C)C2=CC=C(OC)C=C2    5.730
*27271 CN(C)CC1=CC2=C(CC[CH]3[CH]2CC[C]4(C)[CH]3CCC4=O)C=C1O   12.682
*27322 C[CH]1C[C]2(C)C(=CC1=O)CC[CH]3[CH]4CC[C](C)(O)[C]4(C)C[CH]5O[C]235   11.117
*27332 C[C]12CCC(=O)C=C1CC[CH]3[CH]2CC[C]4(C)[CH]3CC[C]4(O)C(=O)CO    5.801
*27352 CC[CH]1CCCN1CCOC(=O)[CH](C2CCCC2)C3=CC=CC=C3    7.635
*27353 O=C(OCCCN1CCCC1)[CH](C2CCCCC2)C3=CC=CC=C3    7.635
*27359 COC1=CC(=C2N=CC=CC2=C1)NCCCCCC[CH]3CCCCN3   13.395
*27362 COC1=CC(=C2N=CC=CC2=C1)NCCN(CC(C)C)C3CCCC3   13.177
*27394 CC(=O)[CH]1[CH](S)C[CH]2[CH]3CC=C4C[CH](O)CC[C]4(C)[CH]3CC[C]12C    9.383
*27399 CC(=O)[C]12O[CH]1C[CH]3[CH]4CC[CH]5C[CH](O)CC[C]5(C)[CH]4CC[C]23C   10.010
*27401 CC1=C2CC[CH]3[CH]4CC[C](C)(O)[C]4(C)C[CH](O)[CH]3[C]2(C)CCC1=O    9.572
*27411 CCCCCCCCCCCC[N+]1=CC2=CC=CC=C2C=C1    9.480
*27445 CCOC(=O)N1CCN(CCCOC2=CC=C(C=C2)C(C)(C)CC)CC1   11.717
*27448 CCCCCOC1=CC=C(OCCCN2CCN(CC2)C(=O)OCC)C=C1   12.987
*27469 CCCCCCCCCC[CH](CN(C)C)C(=O)C1=CC=CC=C1    6.959
*27474 CCCN1CCN(CCCCOC(=O)NC2=CC=C(OCC)C=C2)C[CH]1C   14.870
*27481 CCCCCCCCCCCCCCCC1=CC(=CC=C1)O    4.485
*27489 C[CH](O)[CH]1CC[CH]2[CH]3CC[CH]4C[CH](O)CC[C]4(C)[CH]3CC[C]12C    5.967
*27512 CCCCCCCCOC(=O)C(=CC)C(=O)OCCCCCCCC    4.939
*27519 CCCCCCCCC=CCCCCCCCC1=NC[CH](C)O1    2.442
*27535 C[CH](CCN(CC[CH](C)CC(C)(C)C)CC#C)CC(C)(C)C    3.130
*27564 CCCCCCCCN(CCCCCCCC)C(=N)OCCCC    5.801
*27606 CN(C(=O)C1=CC=CC=C1)C2=CC=CC3=C2C(=O)C4=CC=CC(=C4C3=O)N   17.282
*27624 NC1=C2C(=C(C=CC2=C(C=C1N=NC3=CC=C(C=C3)S(O)(=O)=O)S(O)(=O)=O)N=NC4=CC=C(C=C4)[N+]([O-])=O)O   30.907
*27629 O=C(C=C(C1=CC=CC=C1)C(=O)C2=CC=CC=C2)C3=CC=CC=C3   10.712
*27646 CC1=C(NC(=O)C2=CC3=C(C=C2O)C=C4C=CC=CC4=C3)C=CC=C1   11.775
*27661 CC(=O)NC1=CC=C(C=C1)C=NC2=CC3=C(C=C2)C4=CC=CC=C4C3   11.456
*27703 CC1=CC2=CC=CC=C2C=[N+]1CC(=O)C3=CC4=C(C=CC=C4)C=C3   15.676
*27743 CC1=CC=C(C=C1)[CH](CC(=O)C2=CC=CC=C2)C3=CC=CC=C3    7.028
*27745 O=C(C[CH](SCC1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3    9.043
*27751 C[CH](C1=CC=CC=C1)C(C(O)=O)(C2=CC=CC=C2)C3=CC=CC=C3    9.294
*27760 COC1=CC=C(C=C1OC(C)=O)[CH]2CC(=O)C3=C(OC(C)=O)C=C(OC(C)=O)C=C3O2   14.672
*27763 O=C(C[CH](NCC1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3   10.717
*27769 COC1=CC=C(C=C1)C(=NCC2=CC=CC=C2)C3=CC=C(OC)C=C3    8.049
*27774 CCN(C1=CC=CC=C1)S(=O)(=O)[CH](C2=CC=CC=C2)C(=O)C3=CC=CC=C3    9.467
*27808 COC1=CC=C(C=C1)C(O)(C2=CC=C(OC)C=C2)C3=C(OC)C=CC=C3   12.533
*27824 COC1=CC=C(C=C1OC)C2=C(C=C(O)C3=C(OC)C(=C(OC)C=C23)OC)C(O)=O   19.213
*27861 OC1=C(CNCC2=CC=CC=C2)C=C(O)C(=C1)CNCC3=CC=CC=C3   19.627
*27868 OC(=O)[CH](CSSC[CH](NC(=O)CC1=CC=CC=C1)C(O)=O)NC(=O)CC2=CC=CC=C2   22.267
*27870 OC(=O)CC[CH](NC(=O)OCC1=CC=CC=C1)C(=O)N[CH](CC2=CC=CC=C2)C(O)=O   19.812
*27881 CCC(=O)C(CC)(C1=CC=C(OC(C)=O)C=C1)C2=CC=C(OC(C)=O)C=C2    9.963
*27902 CCN(CC)C(=CC(=O)C1=CC=C(OC)C=C1)C(=O)C2=CC=C(OC)C=C2   13.257
*27903 CC1(C)O[CH]2O[CH]3[CH](CNC4=CC=CC=C4)O[CH](O[CH]3[CH]2O1)C5=CC=CC=C5   16.903
*27904 CO[CH]1O[CH]2CO[CH](O[CH]2[CH](NC(=S)SCC3=CC=CC=C3)[CH]1O)C4=CC=CC=C4   19.166
*27908 N#CC(CCCN1CCCCC1)(C2=CC=CC=C2)C3=CC=CC=C3    9.623
*27909 C[CH](CC(C#N)(C1=CC=CC=C1)C2=CC=CC=C2)N3CCCCC3    9.623
*27919 O=C(CCCSCCCC(=O)NN=CC1=CC=CC=C1)NN=CC2=CC=CC=C2   14.381
*27931 CCC(CC)(CC)[CH](OC(=O)C1=C(C=CC=C1)C(O)=O)C2=CC=CC=C2    9.387
*27935 COC1=CC=C(C=C1OC)[CH]2[CH]3COC[CH]3CC4=C2C=C(OC)C(=C4)OC   11.362
*27955 CCN(CCNC1=C2N=CC=CC2=CC(=C1)OC)CCC3=CC=CC=C3   14.529
*27969 CC[CH]1CN2CC[C]3([CH]2C[CH]1C(=COC)C(=O)OC)C(=O)NC4=CC=CC=C34   15.538
*27972 O=S(=O)(N1CCOCC1)C2=CC=C(OCCOC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C=C2   16.910
*27982 CC(=O)O[C]1(CC[CH]2[CH]3CCC4=CC(=O)CC[CH]4[CH]3CC[C]12C)C#C    7.424
*27983 COC(=O)C=C1CC[CH]2[CH]3CCC4=CC(=O)CC[C]4(C)[CH]3C(=O)C[C]12C   10.191
*27987 COC1=CC=C(C=C1OC)[CH]2[CH](CO)[CH](CO)CC3=C2C=C(OC)C(=C3)OC   13.924
*28027 CCCCN(CCCC)C(=N)C1=CC=C(OCC2=CC=CC=C2)C=C1    8.636
*28036 CSCC[CH](N)C(=O)NC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(NC(=O)[CH](N)CCSC)C=C2   24.112
*28043 C[CH]1C[C]2(C)[CH]3[CH](CCC2=CC1=O)[CH]4CC[CH](C(C)=O)[C]4(C)CC3=O   10.483
*28108 CCN(CC)S(=O)(=O)C1=CC=C(OCCOC2=CC=C(C=C2)S(=O)(=O)N(CC)CC)C=C1   12.090
*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
*28140 CCCCCCCCCCCC(=O)NC1=CC2=C(N)C=C(C)N=C2C=C1   14.281
*28148 CCOC(=O)N1CCN(CCCOC2=C(C=CC=C2)C3CCCCC3)CC1   11.951
*28159 CCCCCC(=CC1=CC=CC=C1)[CH]2OCC(C)(C)[CH](O2)C(C)C    4.457
*28163 C[CH](CO)[CH]1CC[CH]2[CH]3CCC4=CC(=O)CC[C]4(C)[CH]3[CH](O)C[C]12C    9.520
*28182 CC1(C)CCC[N+]1(C)CCOC(=O)[C](O)(C2CCCC2)C3=CC=CC=C3   16.583
*28190 CCCCN(CCCC)C[C](C)(O)CNC1=C2N=CC=CC2=CC(=C1)OC   17.134
*28206 CC(C)(C)CC(C)(C)C1=CC(=O)C(=CC1=O)C(C)(C)CC(C)(C)C    6.801
*28219 CC[N+](C)(CC)CCOC(=O)[CH](C1=CC=CC=C1)C2(O)CCC(C)CC2   19.857
*28283 CCCCCCCCCCCCCCCCCC(=O)OCCCC    1.418
*28284 CCCCCCCCCCCC(=O)OC[CH](C)CCC[CH](C)CC    1.418
*28343 OC1=C(C=NNC(=S)NN=CC2=C3C=CC=CC3=CC=C2O)C4=C(C=CC=C4)C=C1   18.119
*28365 OC(=O)CCC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2C3=C(OC4=C2C=CC=C4)C=CC=C3   20.169
*28392 OC1=C(CC2CCC(CC2)C3=CC=CC=C3)C(=O)C4=C(C=CC=C4)C1=O    9.128
*28409 O[C]1(CN(C[CH](O1)C2=CC=CC=C2)CC3=CC=CC=C3)C4=CC=CC=C4   14.318
*28450 CCC1=C(NC2=C3C=NN(C4=CC=CC=C4)C3=NC(=N2)CC)C(=CC=C1)CC   15.362
*28454 C(CC[N+]1=CC2=C(C=CC=C2)C=C1)CC[N+]3=CC4=CC=CC=C4C=C3   14.041
*28480 CCOC(=O)[CH](CC(=O)C1=CC2=C(OCO2)C=C1)CC3=CC(=C(OC)C(=C3)OC)OC   14.975
*28481 CC1=CC=C(C=C1)S(=O)(=O)OC[CH]2O[CH](O[CH]3[CH]2O[CH]4OC(C)(C)O[CH]34)C5=CC=CC=C5   17.577
*28483 CC1=CC=C(C=C1)S(=O)(=O)O[CH](COC(=O)C2=CC=CC=C2)[CH]3O[CH]4OC(C)(C)O[CH]4[CH]3O   19.907
*28493 CCC(=O)OCC(CC(=O)NCCC1=CC=CC=C1)=NCCC2=CC=CC=C2   12.987
*28495 CCOC(=O)CC[CH](NC(=O)C1=CC=C(NS(=O)(=O)C2=CC=C(C)C=C2)C=C1)C(=O)OCC   16.089
*28557 CCCOC(C(=O)OCCN(CC)CC)(C1=CC=CC=C1)C2=CC=CC=C2    9.712
*28590 CC(=O)O[CH]1CC[C]2(C)[CH](CC[CH]3[CH]4CC=C(C(C)=O)[C]4(C)CC(=O)[CH]23)C1    9.810
*28592 CC(=O)O[CH]1C[C]2(C)[CH]3CC[C]4(C)[CH](CC[CH]4[CH]3CCC2=CC1=O)OC(C)=O    8.412
*28613 C[CH](CN1[CH](C)CC[CH]1C)OC(=O)[CH]([CH]2CCCC=C2)C3=CC=CC=C3    7.444
*28631 CC[N+](C)(CC)CCCN(C)C(=O)C(O)(C1=CC=CC=C1)C2=CC=CC=C2   21.215
*28635 CC(=O)O[CH]1CC[C]2(C)[CH](CC=C3[CH]4CC[CH](C(C)=O)[C]4(C)CC[CH]23)C1    6.120
*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
*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
*28682 C[N+](C)(C)CCOC(OCC[N+](C)(C)C)(C1=CC=CC=C1)C2=CC=CC=C2   23.129
*28787 C1=CC=C(C=C1)N(N(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4    6.936
*28822 N=C(NC1=C2C=CC=CC2=CC=C1)SCCSC(=N)NC3=C4C=CC=CC4=CC=C3   18.511
*28848 CN(C)C[CH](OC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3   10.217
*28880 CCOCC1=C(C=CC=C1)C(O)(C2=C(OC)C=CC=C2)C3=C(OC)C=CC=C3   13.071
*28893 CCCCCC1=CC=[N+](CC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C=C1   14.278
*28903 CCN(CC)CCNC1=NC(=C2N=C(C3=CC=CC=C3)C(=NC2=N1)C4=CC=CC=C4)N   17.873
*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
*28931 C[CH](CN1CCCCCCC1)C(C#N)(C2=CC=CC=C2)C3=CC=CC=C3    9.377
*28933 CN(CCCC[CH]1CCCN(C1)C(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3   11.105
*28938 CC1=CC=C(C=C1)C(=O)[CH]([CH](N2CCOCC2)C3=CC=CC=C3)N4CCOCC4   15.573
*28976 CCN(CC)CCC(C(=O)N1CCCC1)(C2=CC=CC=C2)C3=CC=CC=C3   12.376
*28985 CCCCN(C(=O)OCCOC(=O)N(CCCC)C1=CC=CC=C1)C2=CC=CC=C2    7.504
*29032 CCN(CC)C1=CC=C(C=C1)C=NNC(=N)C(=N)NN=CC2=CC=C(C=C2)N(CC)CC   16.467
*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
*29050 CCCCN(CCCC)C[CH](O)C1=CC=C(CCC2=CC=CC=C2)C=C1   10.033
*29052 CCCCCN(CCCCC)C[CH](O)C1=C2C=CC=C3CCC(=C23)C=C1    7.810
*29067 CCCCCCCCCCCCNC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(N)C=C2   11.812
*29070 CC(=O)[CH]1CC[CH]2[CH]3CC[CH]4CC(=O)CC[C]4(C)[CH]3[C](O)(CC=C)C[C]12C   11.127
*29071 C[CH](CCC(O)=O)[CH]1CC[CH]2[CH]3CC(=O)[CH]4CC(=O)CC[C]4(C)[CH]3CC[C]12C   11.812
*29099 C[CH](CCC(O)=O)[CH]1CCC2=C3CC[CH]4C[CH](O)CC[C]4(C)[CH]3C[CH](O)[C]12C   10.762
*29103 CN(C)CCC(=O)[C]1(O)CC[CH]2[CH]3CC=C4C[CH](O)CC[C]4(C)[CH]3CC[C]12C    8.921
*29127 CCCCCCCCCCCCCCCCNC(=S)NN=CC1=C(O)C=CC=C1    9.263
*29140 CCCCCCOC(=O)CC(=CC(=O)OCCCCCC)C(=O)OCCCCCC    7.441
*29154 CCCCCCCCCCOC(=O)C=CC(=O)OCCCCCCCCCC    4.644
*29185 CCCCCCCCCCCCCCCCCCCCCCCC   -0.447
*29189 CCCCCCCCCCCCSCCCCCCCCCCCC    0.398
*29252 NC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(NCNC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(N)C=C4)C=C2   22.697
*29258 CN1CCC([CH](C1)C2=CC=CC=C2)=C(C3=CC=CC=C3)C4=CC=CC=C4    8.148
*29270 CC1=NC2=C(C=C(NC(=O)CCCC(=O)NC3=CC4=C(N)C=C(C)N=C4C=C3)C=C2)C(=C1)N   26.445
*29305 CN1C2=C(C=CC=C2)C(C)(C)C1=CC=CC3=[N+](C)C4=CC=CC=C4C3(C)C   13.511
*29320 CCCCN(CCCC)CCC(=O)C1=CC2=C(C=C1)C3=C(C=CC=C3)C=C2    9.472
*29332 COC1=CC=C(C=C1)[CH]([CH](N2CCOCC2)C(=O)C3=CC=C(OC)C=C3)N4CCOCC4   18.072
*29383 CCC(=O)O[CH]1C[C]2(C)[CH]3CC[C]4(C)[CH](CC[CH]4[CH]3CCC2=CC1=O)OC(=O)CC    8.166
*29399 CCC(C(C)C)C(=O)OCC(C(=O)OC1CC2C3OC3C(C1)[N+]2(C)C)C4=CC=CC=C4   21.187
*29432 CCCCN(CC)CCCCCCCCCCN1CCCC2=C1C=CC=C2    5.963
*29433 CCCCN(CCC)CCCCCCCCCN1CCCC2=C1C=CC=C2    5.963
*29442 CCCCCC[CH](C)C1=CC(=C(O)C(=C1)CN(C)C)[CH](C)CCCCCC    7.706
*29453 CCCCCCCCCCCCCCCCCC1=NC(C)(C)CN1C(C)C    3.390
*29473 C1=CC2=C(C=C1)C3=CC=CC=C3C2C4C5=CC=CC=C5C6=C4C=CC=C6    6.297
*29515 O=C(C=CC1=CC=CC=C1)[CH](C(=O)C=CC2=CC=CC=C2)C(=O)C3=CC=CC=C3   14.606
*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
*29530 N(N=C(C1=CC=CC=C1)C(=NNC2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4   11.516
*29533 S=C1N(CCSC2=C3N=CN(CC4=CC=CC=C4)C3=NC=N2)C=NC5=C1N=CN5CC6=CC=CC=C6   17.924
*29535 C(OC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4    7.437
*29545 C(C1=CC=CC=C1)C2=CC=C(SSC3=CC=C(CC4=CC=CC=C4)C=C3)C=C2    6.415
*29547 C[C](O)([CH](C1=CC=CC=C1)C2=CC=CC=N2)C3=CC=C(C=C3)C4=CC=CC=C4   12.600
*29557 CC1=CC(=CC=C1NS(=O)(=O)C2=CC=CC=C2)C3=CC=C(NS(=O)(=O)C4=CC=CC=C4)C(=C3)C   12.026
*29569 CC(=O)OC1=CC=C(C=C1OC(C)=O)[CH]2[CH]3COC(=O)[CH]3CC4=C2C=C(OC(C)=O)C(=C4)OC(C)=O   14.043
*29572 NC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)C3=NCCN3)C(=O)NC4=CC=C(C=C4)C5=NCCN5   26.090
*29573 CN(C)CCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=C4C=CC=CC4=CC=N3   13.418
*29592 CN(C1=CC=C(C=C1)C2=NCCN2)S(=O)(=O)C3=CC(=CC=C3)S(=O)(=O)N(C)C4=CC=C(C=C4)C5=NCCN5   18.654
*29596 C1CN(CCC2=CC=CC=C2)C[CH]1COC(C3=CC=CC=C3)C4=CC=CC=C4    9.511
*29613 CC(C)C1=CC=C(C=C1)C=C2CCCC(=CC3=CC=C(C=C3)C(C)C)C2=O    6.824
*29616 COC1=CC=C(CC(=O)C2=C(OC)C(=C3OC(C)(C)C=CC3=C2O)CC=C(C)C)C=C1   10.444
*29685 CCN(CC)CC1=CC(=CC(=C1O)C2=CC=CC=C2)[CH]3C[CH](C)CC(C)(C)C3    9.710
*29701 CC(C)[CH](NC(=O)OCC1=CC=CC=C1)C(=O)N(C2CCCCC2)C(=O)NC3CCCCC3   14.117
*29704 CN(C)CCCNCC(=O)NC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(NC(=O)CNCCCN(C)C)C=C2   26.095
*29709 CCC(=O)O[CH]1CC[C]2(C)[CH]3CC[C]4(C)[CH](CC[C]4(C)OC(=O)CC)[CH]3CC=C2C1    5.201
*29710 C[CH](CCC(O)=O)[CH]1CC[CH]2[CH]3CC[CH]4C[CH](CC[C]4(C)[CH]3C[CH](OC=O)[C]12C)OC=O    9.951
*29716 CCCCCCCCCCCCCCCCC[C]1(NC(=O)NC1=O)C2=CC=CC=C2    7.804
*29723 CC1(C)[CH]2CC[C]1(C)[CH](C2)OC(=O)CCSCCC(=O)O[CH]3C[CH]4CC[C]3(C)C4(C)C    7.312
*29727 CCN(CC)CCOC1=CC=C(CN[CH](C)CCC2=C(C)CCCC2(C)C)C=C1    8.827
*29740 CCCCCCCCCCCCCCCCCC(=O)C1=CC=C(OC)C(=C1)OC    5.496
*29753 CC(C)CN(CC(C)C)CC(CN(CC(C)C)CC(C)C)OC(=O)NC1=CC=CC=C1   12.547
*29769 CCCCCCCCCCCCCCCCCCCCCCCCCCO    2.293
*29771 C[N+]1(CCCCCCCCCC[N+]2(C)CCCCCCC2)CCCCCCC1   16.399
*29776 OC1=C2C=CC=CC2=C(C=C1)C(C3=CC=CC=C3)=C4C=CC(=O)C5=C4C=CC=C5   13.569
*29787 O=C(C=CC1=CC=CC=C1)C2=CC=C(C=C2)C3=CC(=CC=C3)C4=CC=CC=C4    8.863
*29796 CN(C)C1=CC=C(C=C1)C(C2=C(O)C3=C(OC2=O)C=C(O)C=C3)C4=C(O)C5=C(OC4=O)C=C(O)C=C5   23.726
*29818 COC1=CC(=CC(=C1OC)OC)C(=O)OC2=C(OC)C=C(C=C2OC)C(=O)C3=CC4=C(OCO4)C=C3C   17.367
*29828 O=C(C[CH](N1CCN(CC1)CC2=CC=CC=C2)C(=O)C3=CC=CC=C3)C4=CC=CC=C4   15.396
*29839 CCCOC1=CC(=C(C(=O)OC2=C(C=CC=C2C(=O)N(C)C)C3=CC=CC=C3)C(=C1)C)C   12.606
*29860 COC1=CC=C(CN2CCN(CC3=CC=C(OC)C=C3)C2C4=CC=C(OC)C(=C4)OC)C=C1   13.788
*29861 CCN(CC)C1=C2C=CC=NC2=C(CC3=C4N=CC=CC4=C(C=C3)N(CC)CC)C=C1   14.211
*29891 CCCCOC1=CC=C(C=C1)C(=O)[CH]([CH](N2CCOCC2)C3=CC=CC=C3)N4CCOCC4   16.475
*29900 CCCCCCCCCCCCOC(=O)N[CH]1C2=C(OC3=C1C=CC=C3C)C=CC=C2    8.854
*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
*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
*29952 CCCCCCCCCCCCCCCCCC[N+]1=CC2=CC=CC=C2C=C1    8.742
*29957 CCCCCCCCCCCCCCCCCCNC(=S)NN=CC1=CC2=C(OCO2)C=C1    7.971
*29978 CC(C)CCC[CH](C)[CH]1CC[CH]2[CH]3CC[CH]4C[CH](O)CC[C]4(C)[CH]3CC[C]12C    3.793
*29983 CCN(CC)CC1=CC(=CC(=C1O)C(C)(C)CC(C)(C)C)C(C)(C)CC(C)(C)C    7.458
*30017 OS(=O)(=O)C1=C2C=CC(=C1)N=NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)N=NC5=CC(=C(C=C5)C=C2)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O   35.339
*30036 COC1=C2C(=C(OC)C=C1)C(=C3C=CC=CC3=C2C4=CC=CC=C4)C5=CC=CC=C5    8.975
*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
*30082 CCN(CC)C1=CC2=C(C=C1)C3(OC(=O)C4=C3C=CC=C4)C5=C(O2)C=C(C=C5)N(CC)CC   11.190
*30083 CCNC1=CC2=C(C=C1C)C(=C3C=C(C)C(C=C3O2)=NCC)C4=C(C=CC=C4)C(=O)OCC   10.476
*30109 CC(C)(C)C1=CC=C(O)C(=C1)CN(CC2=C(O)C=CC(=C2)C(C)(C)C)C3=CC=CC=C3   13.395
*30114 C(CCCCC[N+]1=CC2=CC=CC=C2C=C1)CCCC[N+]3=CC4=C(C=CC=C4)C=C3   13.426
*30162 CC[CH](C(C)C)C(=O)OCC(=O)[C]1(O)CC[CH]2[CH]3CCC4=CC(=O)CC[C]4(C)[CH]3[CH](O)C[C]12C   10.590
*30208 CCCCCCCCCCCCCCCCNC(=S)NN=CC1=CC=C(C=C1)N(CC)CC    6.833
*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
*30260 C[CH](CC1=C2C=CC=CC2=CC=C1)C(C)(C(=O)OC3=CC=CC=C3)C(=O)OC4=CC=CC=C4    8.854
*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
*30325 CC[CH](CC[CH](C)[CH]1CC[CH]2[CH]3CCC4=CC(=O)CC[C]4(C)[CH]3CC[C]12C)C(C)C    2.785
*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
*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
*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
*30405 COC(=O)C[CH]1[C]2(C)[CH](O[CH]3C[CH](C(=C23)C)C4=COC=C4)[CH](OC(C)=O)[CH]5[C](C)(C=CC(=O)[C]15C)C(=O)OC   14.896
*30417 CCN(CC)CCNC1=NC(=C2N=C(C3=CC=CC=C3)C(=NC2=N1)C4=CC=CC=C4)NCCN(CC)CC   20.467
*30435 CC1(C)[CH]2CC[C]3(C)[CH](C(=O)C=C4[CH]5C[C](C)(CC[C]5(C)CC[C]34C)C(O)=O)[C]2(C)CCC1=O   11.688
*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
*30490 CN1C(=O)N(C)C2=C(N(C[CH](COC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)OC(C)=O)C=N2)C1=O   18.034
*30502 CC1=C2C=C(CC3=CC4=C(C=C3)N=C(C=C4C)N5CCCCC5)C=CC2=NC(=C1)N6CCCCC6   14.590
*30503 CN(C)[CH]1[CH]2C[CH]3C(=C(O)[C]2(O)C(=O)C(=C1O)C(=O)NCN[CH]4[CH]5SC(C)(C)[CH](N5C4=O)C(O)=O)C(=O)C6=C(O)C=CC=C6[C]3(C)O   29.368
*30523 CC[CH](C=C[CH](C)[CH]1CC[CH]2[CH]3CC=C4C[CH](CC[C]4(C)[CH]3CC[C]12C)OC(C)=O)C(C)C    1.772
*30572 O=C(CCCCCCCCC(=O)NN=CC1=C2C=CC=CC2=CC=C1)NN=CC3=C4C=CC=CC4=CC=C3   14.061
*30576 O=S(=O)(N(CCCOC1=CC=CC=C1)CCN(CCCOC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4   14.363
*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
*30613 CC(C)CCC[CH](C)[CH]1CC[C]2(C)[CH]3CC[CH]4C(C)(C)[CH](CC[C]4(C)[CH]3CC[C]12C)OC(C)=O    1.611
*30638 CN(C1=CC=C(C=C1)C2=NCCN2)S(=O)(=O)C3=CC=C(CC4=CC=C(C=C4)S(=O)(=O)N(C)C5=CC=C(C=C5)C6=NCCN6)C=C3   19.706
*30677 CC1=C(C=CC(=C1)NC(=O)C2=CC=C(N)C=C2)N=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   36.115
*30783 CCCCC[CH](O)[CH]1[CH](O)C[CH](O)C[CH](O)C[CH](O)C[CH](O)C[CH](O)C[CH](O)C(=CC=CC=CC=CC=C[CH](O)[CH](C)OC1=O)C   16.670
*30800 C1CCC2=C(C1)C=CC(=C2)[CH](C3=CC=CC=C3)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6    6.499
*30835 OC(C1=CC=C(C=C1)C2=CC=CC=C2)(C3=CC=C(C=C3)C4=CC=CC=C4)C5=CC=C(C=C5)C6=CC=CC=C6   12.193
*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
*30861 [O-][N+](=O)C1=CC2=C(C=C1)C3=CC=CC=C3C2=NC4=CC=C(C=C4)C5=CC=C(C=C5)N=C6C7=CC=CC=C7C8=CC=C(C=C68)[N+]([O-])=O   14.770
*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
*30903 CCCCCC[CH](O)CC=CCCCCCCCC(=O)OCCCOC(=O)CCCCCCCC=CC[CH](O)CCCCCC    8.181
*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
*30927 CC(=O)OC[CH]1O[CH](O[CH]2[CH](COC(C)=O)O[CH](OC(C)=O)[CH](OC(C)=O)[CH]2OC(C)=O)[CH](OC(C)=O)[CH](OC(C)=O)[CH]1O[CH]3O[CH](COC(C)=O)[CH](OC(C)=O)[CH](OC(C)=O)[CH]3OC(C)=O   39.438
*30941 C[CH](OC(=O)C1=CC=CC=C1)[CH](OC(=O)C2=CC=CC=C2)[CH](OC(=O)C3=CC=CC=C3)[CH](COC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5   17.151
*30953 O=C(NC1=C2C(=O)C3=CC=CC(=C3C(=O)C2=CC=C1)NC4=C5C(=O)C6=CC=CC(=C6C(=O)C5=CC=C4)NC(=O)C7=CC=CC=C7)C8=CC=CC=C8   28.526
*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
*31009 C[CH]1CC[CH]2[CH](C)[CH]3[CH](C[CH]4[CH]5CC=C6C[CH](CC[C]6(C)[CH]5CC[C]34C)O[CH]7O[CH](CO)[CH](O)[CH](O[CH]8O[CH](CO)[CH](O)[CH](O)[CH]8O)[CH]7O[CH]9O[CH](C)[CH](O)[CH](O)[CH]9O)N2C1   30.914
