0 B3R0.2 CC(C)S HMDB0031634 [0,0,0,0,0,0|3,1,0]=4 1 B3R0.2 CC(N)=O HMDB0031645 [0,0,0,0,0,0|3,0,0]=3 2 B3R0.2 CC(S)=O HMDB0031188 [0,0,0,0,0,0|2,1,0]=3 3 B3R0.2 CC(S)S HMDB0032253 [0,0,0,0,0,0|2,2,0]=4 4 B3R0.2 CN(C)C HMDB0000906 [0,0,0,0,0,0|3,0,1]=4 5 B3R0.2 ClC(Cl)=C HMDB0032554 [0,0,0,0,0,0|4,0,0]=4 6 B3R0.2 ClC(Cl)Cl HMDB0029596 [0,0,0,0,0,0|4,0,0]=4 7 B3R0.2 ClN(Cl)Cl HMDB0034827 [0,0,0,0,0,0|3,0,1]=4 8 B3R0.2 NC(N)=S HMDB0034155 [0,0,0,0,0,0|3,1,0]=4 9 B3R0.2 OB(O)O HMDB0035731 [0,0,0,0,0,0|1,0,2]=3 10 B3R0.2 OS(O)=O HMDB0034829 [0,0,0,0,0,0|1,0,1]=2 11 B3R0.2 [O-]C([O-])=O HMDB0031453 [0,0,0,0,0,0|1,0,1]=2 12 B2R0.1 CCC HMDB0031630 [1,0,0,0,0,0|3,0,0]=4 13 B2R0.1 CCO HMDB0000108 [1,0,0,0,0,0|2,0,0]=3 14 B2R0.1 C[Se]C HMDB0033212 [1,0,0,0,0,0|3,0,0]=4 15 B2R0.1 ClCCl HMDB0031548 [1,0,0,0,0,0|3,0,0]=4 16 B2R0.1 ClN=O HMDB0034825 [1,0,0,0,0,0|1,0,1]=3 17 B2R0.1 O=S=O HMDB0034834 [1,0,0,0,0,0|1,0,1]=3 18 B2R0.1 O=[Cl]=O HMDB0034826 [1,0,0,0,0,0|1,0,1]=3 19 B2R0.1 O=[Si]=O HMDB0035659 [1,0,0,0,0,0|1,0,1]=3 20 B2R0.1 OB=O HMDB0034769 [1,0,0,0,0,0|1,0,0]=2 21 B2R0.1 S=C=S HMDB0036574 [1,0,0,0,0,0|1,2,0]=4 22 B2R0.1 SCS HMDB0040184 [1,0,0,0,0,0|1,2,0]=4 23 B2R0.1 [O-][N+]#N HMDB0035807 [1,0,0,0,0,0|1,0,1]=3 24 B4R0.1 CC(=O)CS HMDB0030025 [0,1,0,0,0,0|2,1,0]=4 25 B4R0.1 CC(=O)OO HMDB0031608 [0,1,0,0,0,0|2,0,0]=3 26 B4R0.1 CC(C)C=O HMDB0031243 [0,1,0,0,0,0|3,0,0]=4 27 B4R0.1 CC(Cl)CO HMDB0031335 [0,1,0,0,0,0|3,0,0]=4 28 B4R0.1 CC(O)CO HMDB0001881 [0,1,0,0,0,0|2,0,1]=4 29 B4R0.1 CCC(O)=O HMDB0000237 [0,1,0,0,0,0|2,0,0]=3 30 B4R0.1 CN(C)N=O HMDB0031419 [0,1,0,0,0,0|2,0,1]=4 31 B4R0.1 COC(C)=O HMDB0031523 [0,1,0,0,0,0|2,0,0]=3 32 B4R0.1 CSC(C)=O HMDB0031189 [0,1,0,0,0,0|2,1,0]=4 33 B4R0.1 CSS(C)=O HMDB0032739 [0,1,0,0,0,0|2,1,0]=4 34 B4R0.1 NC(=O)C=C HMDB0032161 [0,1,0,0,0,0|3,0,0]=4 35 B4R0.1 OC(=O)C=C HMDB0031647 [0,1,0,0,0,0|2,0,0]=3 36 B4R0.1 OC(=O)CCl HMDB0031331 [0,1,0,0,0,0|2,0,0]=3 37 B4R0.3 CC(C)(C)O HMDB0031456 [0,1,0,0,0,0|3,0,0]=4 38 B4R0.3 ClP(Cl)(Cl)=O HMDB0034789 [0,1,0,0,0,0|2,1,0]=4 39 B4R0.3 NS(O)(=O)=O HMDB0034830 [0,1,0,0,0,0|1,0,1]=3 40 B4R0.3 O[Si](O)(O)O HMDB0031436 [0,1,0,0,0,0|1,0,2]=4 41 B4R1.2 CC1CO1 HMDB0031558 [0,0,0,1,0,0|3,0,0]=4 42 B4R1.2 CC1CO1 HMDB0032263 [0,0,0,1,0,0|3,0,0]=4 43 B1R0.1 BrBr HMDB0031434 [2,0,0,0,0,0|2,0,0]=4 44 B1R0.1 C=C HMDB0029594 [2,0,0,0,0,0|2,0,0]=4 45 B1R0.1 CBr HMDB0031524 [2,0,0,0,0,0|2,0,0]=4 46 B1R0.1 II HMDB0000675 [2,0,0,0,0,0|2,0,0]=4 47 B1R0.1 [NH3+][O-] HMDB0032439 [2,0,0,0,0,0|0,0,1]=3 48 B3R0.1 COCCl HMDB0031332 [1,1,0,0,0,0|2,0,0]=4 49 B3R0.1 COOC HMDB0031430 [1,1,0,0,0,0|2,0,0]=4 50 B3R0.1 OCC=C HMDB0031652 [1,1,0,0,0,0|2,0,0]=4 51 B3R0.1 OCCO HMDB0032262 [1,1,0,0,0,0|1,0,1]=4 52 B5R0.1 C/C=C/C(O)=O HMDB0010720 [0,2,0,0,0,0|2,0,0]=4 53 B5R0.1 C/C=C\C(O)=O HMDB0034439 [0,2,0,0,0,0|2,0,0]=4 54 B5R0.1 CC(=O)OC=C HMDB0031209 [0,2,0,0,0,0|2,0,0]=4 55 B5R0.1 CCCC(O)=O HMDB0000039 [0,2,0,0,0,0|2,0,0]=4 56 B5R0.1 CCOC(C)=O HMDB0031217 [0,2,0,0,0,0|2,0,0]=4 57 B5R0.1 CCOC(N)=O HMDB0031219 [0,2,0,0,0,0|2,0,0]=4 58 B5R0.1 CCOC(O)=O HMDB0031232 [0,2,0,0,0,0|1,0,1]=4 59 B5R0.1 OC(=O)CCI HMDB0031252 [0,2,0,0,0,0|2,0,0]=4 60 B5R0.1 OC(=O)CCS HMDB0041604 [0,2,0,0,0,0|1,1,0]=4 61 B5R0.3 CCC(=O)CO HMDB0031507 [0,2,0,0,0,0|2,0,0]=4 62 B5R0.3 CCC(=O)OC HMDB0030062 [0,2,0,0,0,0|2,0,0]=4 63 B5R0.3 COC(=O)C=C HMDB0033977 [0,2,0,0,0,0|2,0,0]=4 64 B5R0.3 COC(=O)OC HMDB0029580 [0,2,0,0,0,0|1,0,1]=4 65 B5R0.3 OC(C=O)C=O HMDB0040261 [0,2,0,0,0,0|1,0,1]=4 66 B5R0.5 CC(S)C(O)=O HMDB0031520 [0,2,0,0,0,0|1,1,0]=4 67 B5R0.5 [O-]S(=O)S([O-])=O HMDB0034906 [0,2,0,0,0,0|1,0,1]=4 68 B3R1.1 O1OO1 HMDB0035409 [1,0,0,1,0,0|1,0,1]=4