0 B3R0.1 C#[N+]CC DB03399 [0,0,0,0,0,0|2,0,2]=4 1 B3R0.1 C(N)=CS DB01968 [0,0,0,0,0,0|1,1,0]=2 2 B3R0.1 CCCO DB03175 [0,0,0,0,0,0|0,0,4]=4 3 B3R0.1 CCN=O DB02646 [0,0,0,0,0,0|1,0,2]=3 4 B3R0.1 CCNC DB02396 [0,0,0,0,0,0|2,0,2]=4 5 B3R0.1 ClCCCl DB03733 [0,0,0,0,0,0|2,0,2]=4 6 B3R0.1 N=CCN DB02108 [0,0,0,0,0,0|2,0,1]=3 7 B3R0.1 NCCN DB14189 [0,0,0,0,0,0|2,0,2]=4 8 B3R0.1 NCCO DB03994 [0,0,0,0,0,0|1,0,3]=4 9 B3R0.1 OCCS DB03345 [0,0,0,0,0,0|1,0,3]=4 10 B2R0.1 CCCl DB13259 [1,0,0,0,0,0|1,0,2]=4 11 B2R0.1 Cl[Hg]Cl DB13765 [1,0,0,0,0,0|3,0,0]=4 12 B2R0.1 I[Hg]I DB04445 [1,0,0,0,0,0|3,0,0]=4 13 B2R0.1 N#CN DB02679 [1,0,0,0,0,0|2,0,1]=4 14 B2R0.1 N=N/C DB04361 [1,0,0,0,0,0|2,0,1]=4 15 B2R0.1 O=CO DB01942 [1,0,0,0,0,0|1,0,0]=2 16 B2R0.1 O=P[O-] DB04053 [1,0,0,0,0,0|2,0,0]=3 17 B2R0.1 O=[Si]=O DB13654 [1,0,0,0,0,0|1,1,0]=3 18 B2R0.1 O=[Si]=O DB14138 [1,0,0,0,0,0|1,1,0]=3 19 B2R0.1 [C-]#[N+]C DB04337 [1,0,0,0,0,0|1,0,2]=4 20 B4R0.1 C=C(Br)CO DB04320 [0,1,0,0,0,0|0,0,2]=3 21 B4R0.1 C=CC(=O)O DB02579 [0,1,0,0,0,0|0,0,0]=1 22 B4R0.1 CC(=O)C=O DB03587 [0,1,0,0,0,0|0,0,1]=2 23 B4R0.1 CC(=O)O[Hg+] DB02176 [0,1,0,0,0,0|2,0,0]=3 24 B4R0.1 CCC(N)=O DB04161 [0,1,0,0,0,0|0,0,2]=3 25 B4R0.1 CN(C)C=O DB01844 [0,1,0,0,0,0|1,0,1]=3 26 B4R0.1 C[C@H](O)C=O DB03776 [0,1,0,0,0,0|0,0,2]=3 27 B4R0.1 N=C(N)NO DB03770 [0,1,0,0,0,0|2,0,1]=4 28 B4R0.1 NCC(N)=O DB03636 [0,1,0,0,0,0|1,0,1]=3 29 B4R0.1 O=C(O)CBr DB02198 [0,1,0,0,0,0|1,0,1]=3 30 B4R0.1 O=CC(=O)O DB04343 [0,1,0,0,0,0|1,0,0]=2 31 B4R0.2 C\C=C\C=O DB04381 [0,1,0,0,0,0|0,0,0]=1 32 B4R0.2 O=CCC=O DB03057 [0,1,0,0,0,0|0,0,1]=2 33 B1R0.1 CN DB01828 [2,0,0,0,0,0|1,0,1]=4 34 B1R0.1 OCl DB14135 [2,0,0,0,0,0|1,0,1]=4 35 B3R0.2 CC(N)=O DB02736 [1,1,0,0,0,0|0,0,1]=3 36 B3R0.2 C[P@@H](=O)[O-] DB02825 [1,1,0,0,0,0|1,0,1]=4 37 B3R0.2 C[P@H](=O)O DB02845 [1,1,0,0,0,0|1,0,1]=4 38 B3R0.2 NC(=O)O DB04261 [1,1,0,0,0,0|1,0,0]=3 39 B3R0.2 O=C([O-])[O-] DB13322 [1,1,0,0,0,0|1,0,0]=3 40 B3R0.2 O=[Mo+6](O)O DB04494 [1,1,0,0,0,0|2,0,0]=4 41 B3R0.2 O=[Mo](=O)S DB03328 [1,1,0,0,0,0|2,0,0]=4 42 B3R0.2 O=[Si]([O-])[O-] DB14116 [1,1,0,0,0,0|1,1,0]=4 43 B3R0.2 OCl(=O)=O DB14150 [1,1,0,0,0,0|2,0,0]=4 44 B5R0.1 C=C(Br)CCO DB04592 [0,2,0,0,0,0|0,0,2]=4 45 B5R0.1 CC(=O)CCO DB04094 [0,2,0,0,0,0|0,0,2]=4 46 B5R0.1 CCCC(=O)O DB03568 [0,2,0,0,0,0|0,0,2]=4 47 B5R0.1 CCCC(N)=O DB02121 [0,2,0,0,0,0|0,0,2]=4 48 B5R0.1 CSCC(=O)[O-] DB03517 [0,2,0,0,0,0|0,0,2]=4 49 B5R0.1 C[Se]CC(=O)[O-] DB03098 [0,2,0,0,0,0|0,0,2]=4 50 B5R0.1 C[Te]CC(=O)[O-] DB01918 [0,2,0,0,0,0|0,0,2]=4 51 B5R0.1 C\C=C\C(=O)O DB02074 [0,2,0,0,0,0|0,0,0]=2 52 B5R0.1 NCCC(=O)O DB03107 [0,2,0,0,0,0|0,0,2]=4 53 B5R0.1 NOCC(=O)O DB02079 [0,2,0,0,0,0|1,0,1]=4 54 B5R0.1 O=C(O)CCO DB03688 [0,2,0,0,0,0|0,0,2]=4 55 B5R0.3 O=C(CO)CO DB01775 [0,2,0,0,0,0|1,0,1]=4 56 B5R0.3 O=C[C@H](O)CO DB02536 [0,2,0,0,0,0|0,0,2]=4 57 B5R0.4 C=CS(=O)(=O)O DB04359 [0,2,0,0,0,0|1,0,0]=3 58 B5R0.4 O=CC(Cl)(Cl)Cl DB02650 [0,2,0,0,0,0|1,0,1]=4 59 B5R0.5 C=C(N)C(=O)O DB02688 [0,2,0,0,0,0|0,0,0]=2 60 B5R0.5 C=C(N)C(N)=O DB02002 [0,2,0,0,0,0|0,0,0]=2 61 B5R0.5 CC(=O)C(N)=O DB03578 [0,2,0,0,0,0|0,0,1]=3 62 B5R0.5 CC(=O)[C@@H](C)O DB04364 [0,2,0,0,0,0|0,0,2]=4 63 B5R0.5 CC(=O)[C@H](C)O DB02788 [0,2,0,0,0,0|0,0,2]=4 64 B5R0.5 CC(=[NH2+])C(=O)[O-] DB04212 [0,2,0,0,0,0|0,0,1]=3 65 B5R0.5 CC(C)C(=O)O DB02531 [0,2,0,0,0,0|0,0,2]=4 66 B5R0.5 C[C@@H](N)C(=O)O DB01786 [0,2,0,0,0,0|0,0,2]=4 67 B5R0.5 C[C@@H](O)C(=O)O DB03066 [0,2,0,0,0,0|0,0,2]=4 68 B5R0.5 NC(=O)C(=O)O DB03940 [0,2,0,0,0,0|1,0,0]=3 69 B5R0.5 O=C(O)C(=O)O DB03902 [0,2,0,0,0,0|1,0,0]=3 70 B5R0.2 CCCCC=O DB01919 [0,2,0,0,0,0|0,0,2]=4 71 B5R1.1 C1=CNC=N1 DB03366 [0,1,0,1,0,0|1,0,0]=3 72 B5R1.1 C1=CNN=C1 DB02757 [0,1,0,1,0,0|1,0,0]=3 73 B5R1.1 C1=C[N-]C=N1 DB03840 [0,1,0,1,0,0|1,0,0]=3 74 B5R1.1 C1=NC=NN1 DB03594 [0,1,0,1,0,0|2,0,0]=4