[H]C#C[C@@](c1c([H])c([H])c(c(c1[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])(C([H])([H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])[C@]([H])(C([H])([H])[H])C([H])([H])C([H])([H])c1c([H])c([H])c(c(c1[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H]	Molecule 61
[H]O[C@]1([H])C([H])([H])C([H])([H])[C@@]([H])(C(\[H])=C(/C([H])([H])[H])[C@@]2([H])OC(=O)[C@@]3([H])N(C(=O)C(=O)[C@@]4(O[H])O[C@]([H])([C@]([H])(OC([H])([H])[H])C([H])([H])[C@]4([H])C([H])([H])[H])[C@]([H])(OC([H])([H])[H])C([H])([H])[C@@]([H])(C([H])([H])[H])C([H])([H])\C(=C([H])\[C@@]([H])(C(=O)C([H])([H])[C@@]([H])(O[H])[C@]2([H])C([H])([H])[H])C([H])([H])C(\[H])=C(\[H])[H])C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])C3([H])[H])C([H])([H])[C@@]1([H])OC([H])([H])[H]	Molecule 82
[H]OC(=O)C1=C(SC([H])([H])C([H])([H])\N=C(\[H])N([H])[H])C([H])([H])[C@]2([H])N1C(=O)[C@@]2([H])[C@@]([H])(O[H])C([H])([H])[H]	Molecule 511
[H]OC([H])([H])C(=O)[C@]12O[C@]([H])(O[C@@]1([H])C([H])([H])[C@@]1([H])[C@]3([H])C([H])([H])C([H])([H])C4=C([H])C(=O)C([H])=C([H])[C@@]4(C([H])([H])[H])[C@@]3([H])[C@@]([H])(O[H])C([H])([H])[C@]21C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])[H]	Molecule 233
[H]O[C@](C(=O)OC([H])([H])C#CC([H])([H])N(C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])(c1c([H])c([H])c([H])c([H])c1[H])C1([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C1([H])[H]	Molecule 638
[H]O[C@]1([H])[C@]([H])(O[C@@]2([H])[C@@]([H])(O[H])[C@]([H])(O[C@]3([H])O[C@@]([H])(C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[C@@]3([H])N([H])[H])[C@@]([H])(N([H])[H])C([H])([H])[C@@]2([H])N([H])[H])OC([H])([H])[C@@](O[H])(C([H])([H])[H])[C@@]1([H])N([H])C([H])([H])[H]	Molecule 485
[H]OC(=O)C([H])([H])C([H])([H])C([H])([H])C([H])([H])[C@@]1([H])SSC([H])([H])C1([H])[H]	Molecule 268
[H]OC([H])([H])C1=C([H])[C@]([H])(N([H])[C@]2([H])[C@@]([H])(O[C@@]([H])(O[C@]3([H])[C@]([H])(O[H])[C@@]([H])(O[H])[C@]([H])(O[C@@]4([H])[C@@]([H])(O[H])[C@]([H])(O[H])[C@@]([H])(O[H])O[C@@]4([H])C([H])([H])O[H])O[C@]3([H])C([H])([H])O[H])[C@@]([H])(O[H])[C@]2([H])O[H])C([H])([H])[H])[C@@]([H])(O[H])[C@]([H])(O[H])[C@]1([H])O[H]	Molecule 251
[H]C1=C2[C@@]([H])(C([H])([H])[H])C([H])([H])[C@]3([H])[C@@]4([H])C([H])([H])C([H])([H])[C@](OC(=O)C([H])([H])[H])(C(=O)C([H])([H])[H])[C@]4(C([H])([H])[H])C([H])([H])C([H])([H])[C@@]3([H])[C@]2(C([H])([H])[H])C([H])([H])C([H])([H])C1=O	Molecule 557
[H]OS(=O)(=O)C([H])([H])C([H])([H])C([H])([H])N([H])C(=O)C([H])([H])[H]	Molecule 250
[H]O[C@@]([H])([C@@]([H])(C([H])([H])[H])C([H])([H])C(\[H])=C(\[H])C([H])([H])[H])[C@@]1([H])N(C(=O)[C@]([H])(N(C(=O)[C@]([H])(N(C(=O)[C@]([H])(N(C(=O)[C@@]([H])(N([H])C(=O)[C@]([H])(N([H])C(=O)[C@]([H])(N(C(=O)[C@@]([H])(N([H])C(=O)[C@]([H])(N(C(=O)C([H])([H])N(C(=O)[C@]([H])(N([H])C1=O)C([H])([H])C([H])([H])[H])C([H])([H])[H])C([H])([H])[H])C([H])([H])C([H])(C([H])([H])[H])C([H])([H])[H])C([H])(C([H])([H])[H])C([H])([H])[H])C([H])([H])[H])C([H])([H])C([H])(C([H])([H])[H])C([H])([H])[H])C([H])([H])[H])C([H])([H])[H])C([H])([H])[H])C([H])([H])C([H])(C([H])([H])[H])C([H])([H])[H])C([H])([H])[H])C([H])([H])C([H])(C([H])([H])[H])C([H])([H])[H])C([H])([H])[H])C([H])(C([H])([H])[H])C([H])([H])[H])C([H])([H])[H]	Molecule 394
[H]N([H])c1c([H])c([H])c([H])c2c1C([H])([H])N(C([H])([H])[H])C([H])([H])[C@]2([H])c1c([H])c([H])c([H])c([H])c1[H]	Molecule 13
[H]O\N=C(\C(=O)N([H])[C@@]1([H])C(=O)N2C(C(=O)O[H])=C(\C([H])=C(\[H])[H])C([H])([H])S[C@]12[H])c1sc(nc1[H])N([H])[H]	Molecule 346
[H]OC([H])([H])[C@@]1([H])O[C@@]([H])(O[H])[C@@]([H])(N([H])C(=O)N(N=O)C([H])([H])[H])[C@]([H])(O[H])[C@]1([H])O[H]	Molecule 724
[H]O[C@@]([H])(C([H])([H])Oc1c([H])c([H])c([H])c([H])c1C(=O)C([H])([H])C([H])([H])c1c([H])c([H])c([H])c([H])c1[H])C([H])([H])N([H])C([H])([H])C([H])([H])C([H])([H])[H]	Molecule 686
[H]OC(=O)[C@]1([H])N2C(=O)[C@]([H])(N([H])C(=O)[C@]([H])(N([H])C(=O)N3C(=O)N([H])C([H])([H])C3([H])[H])c3c([H])c([H])c([H])c([H])c3[H])[C@@]2([H])SC1(C([H])([H])[H])C([H])([H])[H]	Molecule 309
[H]c1c([H])c([H])c(c(F)c1[H])C1=NC([H])([H])C(=O)N(c2c([H])c([H])c(Cl)c([H])c12)C([H])([H])C([H])([H])N(C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H]	Molecule 469
[H]OC(=O)C([H])([H])C([H])([H])C([H])([H])C(\[H])=C1\C([H])([H])[C@]2([H])C([H])([H])[C@]([H])(O[H])[C@@]([H])(C(\[H])=C(\[H])[C@@]([H])(O[H])[C@]([H])(C([H])([H])[H])C([H])([H])C#CC([H])([H])[H])[C@]2([H])C1([H])[H]	Molecule 509
[H]OC1=C(C(=O)c2c([H])c([H])c([H])c([H])c2C1=O)[C@]1([H])C([H])([H])C([H])([H])[C@]([H])(c2c([H])c([H])c(Cl)c([H])c2[H])C([H])([H])C1([H])[H]	Molecule 236
[H]OC([H])([H])[C@]([H])(N([H])C(=O)[C@]1([H])N([H])C(=O)[C@@]([H])(N([H])C(=O)[C@]([H])(N([H])C(=O)[C@@]([H])(N([H])C(=O)[C@]([H])(N([H])C(=O)[C@]([H])(N([H])C(=O)[C@@]([H])(N([H])[H])C([H])([H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])SSC1([H])[H])C([H])([H])c1c([H])c([H])c([H])c([H])c1[H])C([H])([H])c1c([H])n([H])c2c([H])c([H])c([H])c([H])c12)C([H])([H])C([H])([H])C([H])([H])C([H])([H])N([H])[H])[C@]([H])(O[H])C([H])([H])[H])[C@@]([H])(O[H])C([H])([H])[H]	Molecule 623
[H]O[C@@]1([H])[C@]([H])(O[C@]2([H])C([H])=C3C([H])([H])C([H])([H])[C@]4([H])[C@]([H])(C([H])([H])C([H])([H])[C@]5(C([H])([H])[H])[C@@]([H])(c6c([H])oc(=O)c([H])c6[H])C([H])([H])C([H])([H])[C@@]45O[H])[C@@]3(C([H])([H])[H])C([H])([H])C2([H])[H])O[C@]([H])(C([H])([H])[H])[C@@]([H])(O[H])[C@]1([H])O[H]	Molecule 100
[H]OC(=O)[C@@]([H])(N(C(=O)C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])C([H])([H])c1c([H])c([H])c(c([H])c1[H])-c1c([H])c([H])c([H])c([H])c1-c1nnnn1[H])C([H])(C([H])([H])[H])C([H])([H])[H]	Molecule 788
[H]N(C(=O)c1c([H])c([H])c(OC([H])([H])[H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1C([H])([H])C([H])([H])[C@]1([H])N(C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])C1([H])[H]	Molecule 432
[H]OC(=O)[C@@](N([H])[H])(C([H])([H])[H])C([H])([H])c1c([H])c([H])c(O[H])c(O[H])c1[H]	Molecule 574
[H]N([H])N([H])c1nnc([H])c2c([H])c([H])c([H])c([H])c12	Molecule 501
[H]O[P@]1(=O)OC([H])([H])[C@]([H])(OC1([H])[H])C([H])([H])n1c([H])c([H])c(nc1=O)N([H])[H]	Molecule 390
[H]OC([H])([H])C([H])([H])OC([H])([H])C([H])([H])N1C([H])([H])C([H])([H])N(C([H])([H])[C@@]([H])(C([H])([H])[H])C([H])([H])N2c3c([H])c([H])c([H])c([H])c3Sc3c([H])c([H])c([H])c([H])c23)C([H])([H])C1([H])[H]	Molecule 40
[H]OC([H])([H])[C@@]([H])(O[H])[C@@]([H])(O[H])[C@]([H])(O[H])[C@]([H])(O[H])C([H])([H])O[H]	Molecule 551
[H]OS(=O)(=O)c1c([H])c2C(=O)N(N([H])N([H])C(=O)N([H])N([H])[H])C(=O)c3c([H])c(c(N([H])[H])c(c1[H])c23)S(=O)(=O)O[H]	Molecule 548
[H]Oc1c([H])c(O[H])c([H])c(c1[H])[C@]([H])(O[H])C([H])([H])N([H])C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H]	Molecule 748
[H]O[C@@]1([H])C([H])([H])C([H])([H])[C@@]2([H])[C@]3([H])C([H])([H])C([H])([H])C4=C([H])C(=O)C([H])([H])C([H])([H])[C@]4(C([H])([H])[H])[C@@]3([H])C([H])([H])C([H])([H])[C@]12C([H])([H])[H]	Molecule 79
[H]N1c2c([H])c([H])c([H])nc2N(C(=O)C([H])([H])N2C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])C2([H])[H])c2c([H])c([H])c([H])c([H])c2C1=O	Molecule 673
[H]Oc1c([H])c([H])c(c([H])c1C(=O)C([H])([H])[H])[C@@]([H])(O[H])C([H])([H])N([H])[C@]([H])(C([H])([H])[H])C([H])([H])C([H])([H])c1c([H])c([H])c([H])c([H])c1[H]	Molecule 415
[H]OC(=O)C([H])([H])C([H])([H])C([H])([H])O[H]	Molecule 720
[H]OC(=O)[C@@]([H])(N([H])[C@]1([H])C(=O)N2N(C([H])([H])C([H])([H])C([H])([H])[C@@]2([H])C(=O)O[H])C([H])([H])C([H])([H])C1([H])[H])C([H])([H])C([H])([H])c1c([H])c([H])c([H])c([H])c1[H]	Molecule 372
[H]OC([H])([H])[C@@]([H])(C(=O)O[C@@]1([H])C([H])([H])[C@]2([H])C([H])([H])C([H])([H])[C@]([H])(C1([H])[H])[N@@+]2(C([H])([H])[H])C([H])(C([H])([H])[H])C([H])([H])[H])c1c([H])c([H])c([H])c([H])c1[H]	Molecule 517
[H]OC([H])([H])[C@]1([H])O[C@@]([H])(O[C@]2([H])[C@@]([H])(O[H])[C@@]([H])(O[C@@]3([H])O[C@]([H])(C([H])([H])N([H])[H])C([H])([H])C([H])([H])[C@]3([H])N([H])[H])[C@]([H])(N([H])[H])C([H])([H])[C@]2([H])N([H])C(=O)[C@@]([H])(O[H])C([H])([H])C([H])([H])N([H])[H])[C@]([H])(O[H])[C@]([H])(N([H])[H])[C@@]1([H])O[H]	Molecule 298
[H]N1C(C#N)=C(C(=O)OC([H])([H])[H])[C@@]([H])(c2c([H])c([H])c([H])c(c2[H])[N+]([O-])=O)C(C(=O)OC([H])(C([H])([H])[H])C([H])([H])[H])=C1C([H])([H])[H]	Molecule 613
[H]c1c([H])c(c([H])c(OC([H])([H])[H])c1OC([H])([H])[H])C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])[C@@](C#N)(c1c([H])c(OC([H])([H])[H])c(OC([H])([H])[H])c(OC([H])([H])[H])c1[H])C([H])(C([H])([H])[H])C([H])([H])[H]	Molecule 480
[H]Oc1c([H])c(c([H])c([H])c1OC([H])([H])[H])[C@]1([H])Oc2c([H])c(O[C@@]3([H])O[C@]([H])(C([H])([H])O[C@]4([H])O[C@@]([H])(C([H])([H])[H])[C@]([H])(O[H])[C@@]([H])(O[H])[C@@]4([H])O[H])[C@@]([H])(O[H])[C@]([H])(O[H])[C@@]3([H])O[H])c([H])c(O[H])c2C(=O)C1([H])[H]	Molecule 497
[H]OC(=O)[C@@]1([H])N(C(=O)[C@@]([H])(N([H])[C@@]([H])(C(=O)OC([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])[C@]2([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[C@@]2([H])C1([H])[H]	Molecule 69
[H]OC([H])([H])C(\[H])=C1/C([H])([H])[N@+]2(C([H])([H])C(\[H])=C(\[H])[H])C([H])([H])C([H])([H])[C@]34c5c([H])c([H])c([H])c([H])c5N5\C([H])=C6/[C@@]7([H])N(\C([H])=C(/[C@@]35[H])[C@@]1([H])C([H])([H])[C@]24[H])c1c([H])c([H])c([H])c([H])c1[C@]71C([H])([H])C([H])([H])[N@+]2(C([H])([H])C(\[H])=C(\[H])[H])C([H])([H])\C(=C(/[H])C([H])([H])O[H])[C@@]6([H])C([H])([H])[C@]12[H]	Molecule 261
[H]c1c([H])c([H])c2c(OC([H])([H])c3c([H])c([H])c([H])c([H])c3[C@@]2([H])C([H])([H])C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])[H])c1[H]	Molecule 425
[H]O[C@]1([H])C([H])([H])C(=O)O[C@]([H])(C([H])([H])C([H])([H])[C@]2([H])[C@]([H])(C([H])=C([H])C3=C([H])[C@]([H])(C([H])([H])[H])C([H])([H])[C@@]([H])(OC(=O)C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])C([H])([H])[H])[C@@]23[H])C([H])([H])[H])C1([H])[H]	Molecule 5
[H]OC(=O)C([H])([H])[C@@]([H])(O[H])C([H])([H])[C@]([H])(O[H])C(\[H])=C(/[H])c1c(nc(nc1C([H])(C([H])([H])[H])C([H])([H])[H])N(C([H])([H])[H])S(=O)(=O)C([H])([H])[H])-c1c([H])c([H])c(F)c([H])c1[H]	Molecule 714
[H]N([H])S(=O)(=O)c1c([H])c([H])c(OC([H])([H])[H])c(c1[H])C(=O)N([H])C([H])([H])[C@@]1([H])C([H])([H])N(C([H])([H])C([H])([H])[H])C([H])([H])C1([H])[H]	Molecule 732
[H]O[C@]1(C#C[H])C([H])([H])C([H])([H])[C@@]2([H])[C@]3([H])C([H])([H])C([H])([H])C4=C([H])C([H])([H])C([H])([H])C([H])([H])[C@]4([H])[C@@]3([H])C([H])([H])C([H])([H])[C@]12C([H])([H])[H]	Molecule 550
[H]N(n1c2c([H])c([H])c(Cl)c([H])c2n([H])c1=O)C1([H])C([H])([H])C([H])([H])N(C([H])([H])C([H])([H])C([H])([H])n2c3c([H])c([H])c([H])c([H])c3n([H])c2=O)C([H])([H])C1([H])[H]	Molecule 199
[H]c1c([H])c([H])c2N(c3c([H])c(Cl)c([H])c([H])c3Sc2c1[H])C([H])([H])C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])[H]	Molecule 218
[H]Oc1c([H])c([H])c(OC([H])([H])[C@]([H])(O[H])C([H])([H])N([H])C([H])([H])C([H])([H])N([H])C(=O)N2C([H])([H])C([H])([H])OC([H])([H])C2([H])[H])c([H])c1[H]	Molecule 796
[H]OC([H])([H])[C@@]1([H])O[C@@]([H])(n2c([H])c([H])c(nc2=O)N([H])[H])[C@]([H])(O[H])[C@]1([H])O[H]	Molecule 395
[H]Oc1c([H])c([H])c(c([H])c1[H])C([H])([H])C(=O)N([H])C([H])([H])C([H])([H])N([H])C([H])([H])[C@]([H])(O[H])C([H])([H])Oc1c([H])c([H])c([H])c([H])c1C#N	Molecule 436
[H]Oc1c([H])c([H])c(c([H])c1[H])C([H])([H])[C@]([H])(N([H])[C@]([H])(O[H])C([H])([H])c1c([H])c(O[H])c([H])c(O[H])c1[H])C([H])([H])[H]	Molecule 454
[H]N([H])C(=O)[C@]1([H])N(C(=O)[C@@]([H])(N([H])C(=O)[C@]2([H])N([H])C(=O)C([H])([H])C2([H])[H])C([H])([H])c2nc([H])n([H])c2[H])C([H])([H])C([H])([H])C1([H])[H]	Molecule 775
[H]Oc1c([H])c([H])c(c([H])c1C(=O)N([H])[H])[C@]([H])(O[H])C([H])([H])N([H])[C@@]([H])(C([H])([H])[H])C([H])([H])C([H])([H])c1c([H])c([H])c2OC([H])([H])Oc2c1[H]	Molecule 555
[H]N([H])S(=O)(=O)OC([H])([H])[C@@]12OC(O[C@@]1([H])[C@]1([H])OC(O[C@@]1([H])C([H])([H])O2)(C([H])([H])[H])C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H]	Molecule 73
[H]Oc1c([H])c([H])c(Cl)c2c1C(=O)C1=C(O[H])[C@@]3(O[H])C(=O)C(C(=O)N([H])[H])=C(O[H])[C@]([H])(N(C([H])([H])[H])C([H])([H])[H])[C@@]3([H])C([H])([H])[C@@]1([H])[C@]2([H])O[H]	Molecule 397
[H]Oc1c([H])c(c([H])c(c1O[H])[N+]([O-])=O)C(=O)c1c([H])c([H])c(c([H])c1[H])C([H])([H])[H]	Molecule 765
[H]N1c2sc(c([H])c2C(=Nc2c([H])c([H])c([H])c([H])c12)N1C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])C1([H])[H])C([H])([H])[H]	Molecule 624
[H]c1nc2nc([H])nc(Sc3c(nc([H])n3C([H])([H])[H])[N+]([O-])=O)c2n1[H]	Molecule 305
[H]N([H])c1c([H])c(OC([H])([H])[H])c(c([H])c1Br)C(=O)N([H])C([H])([H])C([H])([H])N(C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H]	Molecule 331
[H]C([H])([H])O[C@]1([H])O[C@]2([H])O[C@]3(OO[C@@]22[C@]([H])(C([H])([H])C([H])([H])[C@@]([H])(C([H])([H])[H])[C@]2([H])C([H])([H])C3([H])[H])[C@@]1([H])C([H])([H])[H])C([H])([H])[H]	Molecule 299
[H]N1C([H])([H])C([H])([H])N(C2=Nc3c([H])c([H])c([H])c([H])c3Oc3c([H])c([H])c(Cl)c([H])c23)C([H])([H])C1([H])[H]	Molecule 287
[H]O[C@@]1([H])OC([H])([H])[C@]2([H])C([H])([H])[N@@]3C([H])([H])C([H])([H])c4c(n([H])c5c([H])c([H])c([H])c([H])c45)[C@@]3([H])C([H])([H])[C@@]2([H])[C@]1([H])C(=O)OC([H])([H])[H]	Molecule 800
[H]N(C(=O)OC([H])([H])C([H])([H])[H])c1on[n+](c1[H])N1C([H])([H])C([H])([H])OC([H])([H])C1([H])[H]	Molecule 591
[H]N([H])c1nc2c([H])c([H])c(OC(F)(F)F)c([H])c2s1	Molecule 706
[H]c1c([H])c([H])c(c([H])c1[H])[C@](OC([H])([H])C([H])([H])[C@@]1([H])N(C([H])([H])[H])C([H])([H])C([H])([H])C1([H])[H])(c1c([H])c([H])c(Cl)c([H])c1[H])C([H])([H])[H]	Molecule 377
[H]O[C@]([H])(C(=O)N1C([H])([H])SC([H])([H])[C@@]1([H])C(=O)N([H])C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H])[C@]([H])(N([H])C(=O)[C@]([H])(N([H])C(=O)C([H])([H])Oc1nc([H])c([H])c2c([H])c([H])c([H])c([H])c12)C([H])([H])SC([H])([H])[H])C([H])([H])c1c([H])c([H])c([H])c([H])c1[H]	Molecule 529
[H]c1c([H])c2c(N=C3[C@]2([H])C([H])([H])C([H])([H])[N@@]2C([H])([H])[C@]4([H])C([H])([H])[C@]([H])(OC(=O)c5c([H])c(OC([H])([H])[H])c(OC([H])([H])[H])c(OC([H])([H])[H])c5[H])[C@@]([H])(OC([H])([H])[H])[C@]([H])(C(=O)OC([H])([H])[H])[C@@]4([H])C([H])([H])[C@@]32[H])c(OC([H])([H])[H])c1[H]	Molecule 704
[H]\N=C(\N([H])[H])N([H])C(\N(C([H])([H])[H])C([H])([H])[H])=N\[H]	Molecule 570
[H]OC(=O)c1c([H])c([H])c([H])c([H])c1-c1c([H])c([H])c(c([H])c1[H])C([H])([H])n1c(nc2=C(C([H])([H])[H])C([H])([H])[C@@]([H])(C([H])=c12)c1nc2c([H])c([H])c([H])c([H])c2n1C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])[H]	Molecule 740
[H]N(c1c([H])c([H])c(F)c(Cl)c1[H])c1nc([H])nc2c([H])c(OC([H])([H])[H])c(OC([H])([H])C([H])([H])C([H])([H])N3C([H])([H])C([H])([H])OC([H])([H])C3([H])[H])c([H])c12	Molecule 176
[H]OC(=O)[C@]1([H])N2C(=O)[C@]([H])(N([H])C(=O)[C@]([H])(N=[N+]=[N-])[C-]3[C++]C([H])=C([H])C([H])=C3[H])[C@@]2([H])SC1(C([H])([H])[H])C([H])([H])[H]	Molecule 307
[H]OC(=O)[C@@]([H])(N([H])[H])C([H])([H])c1c([H])c(I)c(Oc2c([H])c(I)c(O[H])c(I)c2[H])c(I)c1[H]	Molecule 757
[H]N(C(=O)C([H])([H])N(C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])c1c(c([H])c([H])c([H])c1C([H])([H])[H])C([H])([H])[H]	Molecule 540
[H]c1c([H])c([H])c2N(c3c([H])c(c([H])c([H])c3Sc2c1[H])C(=O)C([H])([H])C([H])([H])[H])C([H])([H])[C@@]([H])(N(C([H])([H])[H])C([H])([H])[H])C([H])([H])[H]	Molecule 687
[H]Oc1c([H])c([H])c([H])c2\C(=C(\[H])[H])[C@@]3([H])[C@]([H])(C(=O)c12)[C@@]([H])(O[H])[C@]1(O[H])C(=O)[C@]([H])(C(=O)N([H])[H])[C@@]([H])(O[H])[C@]([H])(N(C([H])([H])[H])C([H])([H])[H])[C@@]1([H])[C@@]3([H])C([H])([H])[H]	Molecule 154
[H]OC(=O)C(\[H])=C(/C([H])=C([H])/C([H])=C(\C([H])=C([H])\C1=C(C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])C1(C([H])([H])[H])C([H])([H])[H])C([H])([H])[H])C([H])([H])[H]	Molecule 523
[H]N([H])c1c([H])c(OC([H])([H])[H])c(c([H])c1S(=O)(=O)C([H])([H])C([H])([H])[H])C(=O)N([H])C([H])([H])[C@]1([H])N(C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])C1([H])[H]	Molecule 282
[H]O[C@@]([H])(C([H])([H])Oc1c([H])c([H])c([H])c(c1[H])C([H])([H])[H])C([H])([H])N([H])C([H])([H])C([H])([H])c1c([H])c([H])c(OC([H])([H])[H])c(OC([H])([H])[H])c1[H]	Molecule 323
[H]OC1(C([H])([H])C([H])([H])C([H])([H])C([H])([H])C1([H])[H])[C@]([H])(c1c([H])c([H])c(OC([H])([H])[H])c([H])c1[H])C([H])([H])N(C([H])([H])[H])C([H])([H])[H]	Molecule 62
[H]Oc1c([H])c([H])c(OC([H])([H])[C@]([H])(O[H])C([H])([H])N([H])C([H])(C([H])([H])[H])C([H])([H])[H])c([H])c1[H]	Molecule 680
[H]c1nc(N(C([H])([H])[H])C2([H])C([H])([H])C([H])([H])N(c3nc4c([H])c([H])c([H])c([H])c4n3C([H])([H])c3c([H])c([H])c(F)c([H])c3[H])C([H])([H])C2([H])[H])n([H])c(=O)c1[H]	Molecule 589
[H]OC(=O)c1c([H])c(c([H])c([H])c1O[H])[C@]([H])(O[H])C([H])([H])N([H])C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H]	Molecule 243
[H]OC(=O)C([H])([H])c1c([H])c([H])c([H])c(C(=O)c2c([H])c([H])c(Br)c([H])c2[H])c1N([H])[H]	Molecule 330
[H]OC(=O)[C@@]1([H])N(C(=O)[C@@]([H])(C([H])([H])[H])C([H])([H])S[H])C([H])([H])C([H])([H])C1([H])[H]	Molecule 338
[H]N([H])C(=O)N1c2c([H])c([H])c([H])c([H])c2C([H])=C([H])c2c([H])c([H])c([H])c([H])c12	Molecule 226
[H]N1c2c([H])c([H])c(Cl)c([H])c2N=C(N2C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])C2([H])[H])c2c([H])c([H])c([H])c([H])c12	Molecule 210
[H]c1c([H])c(c([H])c([H])c1SC([H])([H])[H])C(=O)c1n([H])c(=O)n([H])c1C([H])([H])[H]	Molecule 35
[H]N([H])c1nc(nc2c([H])c(OC([H])([H])[H])c(OC([H])([H])[H])c([H])c12)N1C([H])([H])C([H])([H])N(C(=O)c2oc([H])c([H])c2[H])C([H])([H])C1([H])[H]	Molecule 9
[H]N1C([H])([H])C([H])([H])C([H])([H])O[P@@]1(=O)N(C([H])([H])C([H])([H])Cl)C([H])([H])C([H])([H])Cl	Molecule 209
[H]c1nc(c([H])c([H])c1[H])N(c1c([H])c([H])c(Cl)c([H])c1[H])C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])[H]	Molecule 366
[H]OC(=O)C([H])([H])C([H])([H])C([H])([H])c1nc2c([H])c(c([H])c([H])c2n1C([H])([H])[H])N(C([H])([H])C([H])([H])Cl)C([H])([H])C([H])([H])Cl	Molecule 316
[H]OC(=O)C([H])([H])[C@@]([H])(O[H])C([H])([H])[C@]([H])(O[H])C(\[H])=C(/[H])c1c(nc(c(c1-c1c([H])c([H])c(F)c([H])c1[H])C([H])([H])OC([H])([H])[H])C([H])(C([H])([H])[H])C([H])([H])[H])C([H])(C([H])([H])[H])C([H])([H])[H]	Molecule 360
[H]O[C@@]([H])(C([H])([H])N([H])C([H])([H])[C@@]([H])(O[H])[C@]1([H])Oc2c([H])c([H])c(F)c([H])c2C([H])([H])C1([H])[H])[C@@]1([H])Oc2c([H])c([H])c(F)c([H])c2C([H])([H])C1([H])[H]	Molecule 602
[H]OC(=O)c1c([H])c([H])c([H])c([H])c1OC(=O)C([H])([H])[H]	Molecule 244
[H]O[C@]([H])(c1c([H])c([H])c([H])c([H])c1Cl)C([H])([H])N([H])C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H]	Molecule 784
[H]OC(=O)[C@@]1(N2C(=O)[C@]([H])(N([H])C(=O)c3c(noc3C([H])([H])[H])-c3c(F)c([H])c([H])c([H])c3Cl)[C@@]2([H])SC1(C([H])([H])[H])C([H])([H])[H])C([H])([H])[H]	Molecule 181
[H]c1c([H])c(c([H])c(c1OC([H])([H])C([H])([H])[H])-c1nc2c(nn(c2c(=O)n1[H])C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])[H])S(=O)(=O)N1C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])C1([H])[H]	Molecule 88
[H]c1c([H])c([H])c(c(Cl)c1[H])[C@@]([H])(c1c([H])c([H])c(Cl)c([H])c1[H])C([H])(Cl)Cl	Molecule 587
[H]OC(=O)C([H])([H])C([H])([H])[C@]([H])(C([H])([H])[H])[C@]1([H])C([H])([H])C([H])([H])[C@]2([H])[C@@]3([H])[C@@]([H])(O[H])C([H])([H])[C@]4([H])C([H])([H])[C@]([H])(O[H])C([H])([H])C([H])([H])[C@@]4(C([H])([H])[H])[C@]3([H])C([H])([H])C([H])([H])[C@@]12C([H])([H])[H]	Molecule 362
[H]O[C@]([H])(C([H])([H])Oc1c([H])c([H])c(N([H])C(=O)C([H])([H])C([H])([H])C([H])([H])[H])c([H])c1C(=O)C([H])([H])[H])C([H])([H])N([H])C([H])(C([H])([H])[H])C([H])([H])[H]	Molecule 252
[H]N(c1c([H])c([H])c(N([H])S(=O)(=O)C([H])([H])[H])c([H])c1OC([H])([H])[H])c1c2c([H])c([H])c([H])c(C(=O)N([H])C([H])([H])[H])c2nc2c(c([H])c([H])c([H])c12)C([H])([H])[H]	Molecule 293
[H]OC([H])([H])C([H])([H])N(c1nc(N2C([H])([H])C([H])([H])C([H])([H])C([H])([H])C2([H])[H])c2nc(nc(N3C([H])([H])C([H])([H])C([H])([H])C([H])([H])C3([H])[H])c2n1)N(C([H])([H])C([H])([H])O[H])C([H])([H])C([H])([H])O[H])C([H])([H])C([H])([H])O[H]	Molecule 418
[H]OC(=O)c1c([H])c([H])c(c([H])c1OC([H])([H])C([H])([H])[H])C([H])([H])C(=O)N([H])[C@@]([H])(c1c([H])c([H])c([H])c([H])c1N1C([H])([H])C([H])([H])C([H])([H])C([H])([H])C1([H])[H])C([H])([H])C([H])(C([H])([H])[H])C([H])([H])[H]	Molecule 95
[H]c1c([H])c([H])c(c([H])c1[H])C1=NC([H])([H])c2nnc(n2-c2c([H])c([H])c(Cl)c([H])c12)C([H])([H])N(C([H])([H])[H])C([H])([H])[H]	Molecule 259
[H]Oc1c([H])c([H])c([H])c2c1C(O[H])=C1C(=O)[C@]3(O[H])C(=O)C(C(=O)N([H])[H])=C(O[H])[C@]([H])(N(C([H])([H])[H])C([H])([H])[H])[C@@]3([H])[C@]([H])(O[H])[C@@]1([H])[C@@]2(O[H])C([H])([H])[H]	Molecule 121
[H]OC([H])([H])[C@@]1([H])O[C@@]([H])(n2c([H])nc3c(N([H])[H])c([H])c(Cl)c([H])c23)C([H])([H])[C@]1([H])OC([H])([H])[H]	Molecule 376
[H]c1c([H])c([H])c2n([H])c(nc2c1[H])C([H])([H])C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])C([H])([H])[C@@]1(OC(=O)C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])c2c([H])c(F)c([H])c([H])c2[C@@]1([H])C([H])(C([H])([H])[H])C([H])([H])[H]	Molecule 580
[H]OC([H])([H])[C@]1([H])OC([H])([H])[C@@]([H])(S1)n1c([H])c([H])c(nc1=O)N([H])[H]	Molecule 424
[H]OC(=O)C(=C1/[C@]([H])(OC(=O)C([H])([H])[H])C([H])([H])[C@@]2(C([H])([H])[H])[C@@]1([H])C([H])([H])[C@@]([H])(O[H])[C@@]1([H])[C@]3(C([H])([H])[H])C([H])([H])C([H])([H])[C@@]([H])(O[H])[C@]([H])(C([H])([H])[H])[C@@]3([H])C([H])([H])C([H])([H])[C@]21C([H])([H])[H])\C([H])([H])C([H])([H])C(\[H])=C(\C([H])([H])[H])C([H])([H])[H]	Molecule 478
[H]OC(=O)c1c([H])n2c3c(OC([H])([H])[C@]2([H])C([H])([H])[H])c(N2C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])C2([H])[H])c(F)c([H])c3c1=O	Molecule 23
[H]O[C@@]1([H])C([H])([H])[C@]2(O[H])[C@@]3([H])C([H])([H])C([H])([H])[C@]4([H])C([H])([H])[C@]([H])(O[C@]5([H])O[C@]([H])(C([H])([H])[H])[C@@]([H])(O[C@@]6([H])O[C@]([H])(C([H])([H])[H])[C@@]([H])(O[C@@]7([H])O[C@]([H])(C([H])([H])[H])[C@@]([H])(O[H])[C@]([H])(O[H])C7([H])[H])[C@]([H])(O[H])C6([H])[H])[C@]([H])(O[H])C5([H])[H])C([H])([H])C([H])([H])[C@@]4(C([H])([H])[H])[C@]3([H])C([H])([H])C([H])([H])[C@@]2(C([H])([H])[H])[C@]1([H])C1=C([H])C(=O)OC1([H])[H]	Molecule 488
[H]\C([H])=C(/[H])C([H])([H])N1C([H])([H])C([H])([H])C([H])([H])[C@]1([H])C([H])([H])N([H])C(=O)c1c([H])c2nnn([H])c2c([H])c1OC([H])([H])[H]	Molecule 265
[H]OC(=O)c1c([H])n(c2nc(N3C([H])([H])C([H])([H])N([H])C([H])([H])C3([H])[H])c(F)c([H])c2c1=O)C([H])([H])C([H])([H])[H]	Molecule 433
[H]OC(=O)c1c([H])c(c([H])c([H])c1O[H])-c1c([H])c([H])c(F)c([H])c1F	Molecule 205
[H]N([H])c1c([H])c([H])c(c([H])c1[H])S(=O)(=O)N([H])c1snc(c1C([H])([H])[H])C([H])([H])[H]	Molecule 730
[H]OC([H])([H])C(=O)[C@@]1(O[H])C([H])([H])C([H])([H])[C@@]2([H])[C@]3([H])C([H])([H])[C@@]([H])(C4=C([H])C(=O)C([H])=C([H])[C@@]4(C([H])([H])[H])[C@@]3([H])[C@@]([H])(O[H])C([H])([H])[C@]12C([H])([H])[H])C([H])([H])[H]	Molecule 150
[H]N([H])S(=O)(=O)c1c([H])c2c(N([H])[C@@]([H])(N([H])S2(=O)=O)C([H])([H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1C(F)(F)F	Molecule 317
[H]N([C@@]([H])(C([H])([H])[H])C([H])([H])C([H])(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H]	Molecule 751
[H]N([H])[C@@]([H])(C(=O)N([H])c1c(c([H])c([H])c([H])c1C([H])([H])[H])C([H])([H])[H])C([H])([H])[H]	Molecule 75
[H]N([H])[C@@]([H])(C([H])([H])[H])C([H])([H])Oc1c(c([H])c([H])c([H])c1C([H])([H])[H])C([H])([H])[H]	Molecule 19
[H]N([H])[C@]12C([H])([H])[C@@]3([H])C([H])([H])[C@]([H])(C([H])([H])[C@]([H])(C3([H])[H])C1([H])[H])C2([H])[H]	Molecule 272
[H]OC(=O)C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])Oc1c([H])c(c([H])c([H])c1C([H])([H])[H])C([H])([H])[H]	Molecule 482
[H]N1C(=O)N([H])C(=O)C(C1=O)(c1c([H])c([H])c([H])c([H])c1[H])C([H])([H])C([H])([H])[H]	Molecule 116
[H]OC(=O)c1c([H])n2c3c(OC([H])([H])[C@]2([H])C([H])([H])[H])c(N2C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])C2([H])[H])c(F)c([H])c3c1=O	Molecule 125
[H]N([H])S(=O)(=O)c1c([H])c([H])c(c([H])c1[H])-c1c(noc1C([H])([H])[H])-c1c([H])c([H])c([H])c([H])c1[H]	Molecule 787
[H]N1C(=NC([H])([H])C1([H])[H])[C@@]1([H])C([H])([H])C1(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H]	Molecule 369
[H]N(C(=O)c1c([H])c(Cl)c([H])c([H])c1OC([H])([H])[H])C([H])([H])C([H])([H])c1c([H])c([H])c(c([H])c1[H])S(=O)(=O)N([H])C(=O)N([H])C1([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C1([H])[H]	Molecule 174
[H]OC(=O)c1c([H])c(N([H])[H])c([H])c([H])c1O[H]	Molecule 567
[H]c1c([H])c([H])c(c([H])c1[H])[C@]([H])(OC([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])[H])c1c([H])c([H])c([H])c([H])c1C([H])([H])[H]	Molecule 628
[H]c1c(n([H])c(=S)n([H])c1=O)C([H])([H])C([H])([H])C([H])([H])[H]	Molecule 101
[H]OC(=O)c1c([H])n(c2c(Cl)c(N3C([H])([H])[C@]([H])(N([H])[H])[C@@]4(C([H])([H])C4([H])[H])C3([H])[H])c(F)c([H])c2c1=O)[C@@]1([H])C([H])([H])[C@@]1([H])F	Molecule 719
[H]O[C@@]([H])(C([H])([H])Oc1c([H])c([H])c([H])c(c1[H])C([H])([H])[H])C([H])([H])N([H])C([H])(C([H])([H])[H])C([H])([H])[H]	Molecule 2
[H]c1c([H])c([H])c(c([H])c1[H])N(C([H])([H])C([H])([H])C([H])([H])N(C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])C1([H])C([H])([H])c2c([H])c([H])c([H])c([H])c2C1([H])[H]	Molecule 297
[H]N([H])c1nc(=O)n([H])c([H])c1F	Molecule 180
[H]OC(=O)c1nc([H])c([n+]([O-])c1[H])C([H])([H])[H]	Molecule 255
[H]c1c([H])c([H])c(c([H])c1[H])C(\c1c([H])c([H])c(OC([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])[H])c([H])c1[H])=C(/c1c([H])c([H])c([H])c([H])c1[H])C([H])([H])C([H])([H])[H]	Molecule 736
[H]N(C([H])([H])C([H])([H])Cl)[P@]1(=O)OC([H])([H])C([H])([H])C([H])([H])N1C([H])([H])C([H])([H])Cl	Molecule 508
[H]Oc1c([H])c([H])c(N([H])C(=O)C([H])([H])[H])c([H])c1[H]	Molecule 245
[H]c1c([H])c([H])c(c([H])c1[H])C(\c1c([H])c([H])c(OC([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])[H])c([H])c1[H])=C(/c1c([H])c([H])c([H])c([H])c1[H])C([H])([H])C([H])([H])Cl	Molecule 769
[H]OC([H])([H])C([H])([H])[H]	Molecule 444
[H]N([H])c1nnc(c(n1)N([H])[H])-c1c([H])c([H])c([H])c(Cl)c1Cl	Molecule 535
[H]c1c([H])c([H])c(c([H])c1[H])N1N(c2c([H])c([H])c([H])c([H])c2[H])[C@]([H])(C(=O)C1=O)C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H]	Molecule 665
[H]Oc1c([H])c([H])c2c(Oc3c([H])c(O[H])c([H])c([H])c3C22OC(=O)c3c([H])c([H])c([H])c([H])c23)c1[H]	Molecule 464
[H]c1n([H])c2c([H])c([H])c([H])c([H])c2c1C(=O)O[C@]1([H])C([H])([H])[C@]2([H])[N@]3C([H])([H])C(=O)[C@@]([H])(C2([H])[H])C([H])([H])[C@@]3([H])C1([H])[H]	Molecule 422
[H]N(C1=Nc2c([H])c([H])c(Cl)c([H])c2C(c2c([H])c([H])c([H])c([H])c2[H])=[N+]([O-])C1([H])[H])C([H])([H])[H]	Molecule 363
[H]Oc1c(Cl)c([H])c(Cl)c2c([H])c([H])c([H])nc12	Molecule 365
[H]OC(=O)[C@]([H])(c1c([H])c([H])c(c([H])c1[H])-c1c([H])c([H])c([H])c(F)c1[H])C([H])([H])[H]	Molecule 32
[H]c1c(n(n(-c2c([H])c([H])c([H])c([H])c2[H])c1=O)C([H])([H])[H])C([H])([H])[H]	Molecule 295
[H]OC(=O)c1c([H])n(c2c(F)c(N3C([H])([H])[C@@]([H])(N([H])[C@]([H])(C([H])([H])[H])C3([H])[H])C([H])([H])[H])c(F)c(N([H])[H])c2c1=O)C1([H])C([H])([H])C1([H])[H]	Molecule 721
[H]N1C(=O)N([H])C(=O)C(C1=O)(C([H])([H])C([H])([H])[H])[C@]([H])(C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])[H]	Molecule 654
[H]OC(=O)C([H])([H])c1c([H])c([H])c(C(=O)c2c([H])c([H])c(c([H])c2[H])C([H])([H])[H])n1C([H])([H])[H]	Molecule 768
[H]N(C(=O)C([H])([H])[H])C([H])([H])[C@@]1([H])OC(=O)N(c2c([H])c([H])c(N3C([H])([H])C([H])([H])OC([H])([H])C3([H])[H])c(F)c2[H])C1([H])[H]	Molecule 160
[H]OC([H])([H])[C@@]([H])(N([H])C([H])([H])C([H])([H])N([H])[C@]([H])(C([H])([H])O[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H]	Molecule 187
[H]c1c([H])c(C#N)c([H])c2c1[C@@](OC2([H])[H])(c1c([H])c([H])c(F)c([H])c1[H])C([H])([H])C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])[H]	Molecule 213
[H]O[C@]([H])(c1c([H])c(nc2c(c([H])c([H])c([H])c12)C(F)(F)F)C(F)(F)F)[C@]1([H])N([H])C([H])([H])C([H])([H])C([H])([H])C1([H])[H]	Molecule 558
[H]c1nc(c(c(OC([H])([H])[H])c1C([H])([H])[H])C([H])([H])[H])C([H])([H])[S@](=O)c1nc2c([H])c(OC([H])([H])[H])c([H])c([H])c2n1[H]	Molecule 185
[H]c1nc2C(=O)N(c3nc([H])c(Cl)c([H])c3[H])[C@]([H])(OC(=O)N3C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])C3([H])[H])c2nc1[H]	Molecule 53
[H]OC(=O)C([H])([H])C([H])([H])[C@@]([H])(N([H])[H])C(\[H])=C(\[H])[H]	Molecule 791
[H]O[C@]1(C([H])([H])C#N)C([H])([H])C([H])([H])[C@@]2([H])[C@@]3([H])C(=C4C(=C([H])C(=O)C([H])([H])C4([H])[H])C([H])([H])C3([H])[H])C([H])([H])C([H])([H])[C@]12C([H])([H])[H]	Molecule 411
[H]OC(=O)C([H])([H])OC([H])([H])C(\[H])=C1\C([H])([H])[C@]2([H])C([H])([H])[C@]([H])(O[H])[C@@]([H])(C#C[C@@]([H])(O[H])[C@@]([H])(C([H])([H])[H])C([H])([H])C#CC([H])([H])C([H])([H])[H])[C@]2([H])C1([H])[H]	Molecule 370