1 PNH Pentan-2-one 1.000 2 2RP (2r)-pentan-2-ol 1.000 3 1SP (2s)-pentane-1,2-diol 0.857 4 P2D Pentane-2,4-dione 0.857 5 SY8 5-azanylpentan-2-one 0.857 6 1BO 1-butanol 0.833 7 9A4 (2z)-but-2-en-1-ol 0.833 8 9A7 (2e)-but-2-en-1-ol 0.833 9 CRD (2e)-but-2-enal 0.833 10 LNK Pentane 0.833 11 SBT 2-butanol 0.833 12 0RE (2s)-hexane-1,2-diol 0.750 13 217 (2s)-hex-5-ene-1,2-diol 0.750 14 69O 2-oxopentanoic acid 0.750 15 7FB (2r)-hexane-1,2-diol 0.750 16 DYD (2s,5s)-hexane-2,5-diol 0.750 17 H95 (2~{S},5~{R})-hexane-2,5-diol 0.750 18 HTX Heptan-2-one 0.750 19 HX2 (2r,5r)-hexane-2,5-diol 0.750 20 MPD (4s)-2-methyl-2,4-pentanediol 0.750 21 MRD (4r)-2-methylpentane-2,4-diol 0.750 22 OXP 2-oxo-3-pentenoic acid 0.750 23 SHF Laevulinic acid 0.750 24 SJ3 (4r)-4-hydroxypentanoic acid 0.750 25 U9O 5-azanyl-1-oxidanyl-pentan-2-one 0.750 26 UE3 (2r)-2-oxidanylpentanoic acid 0.750 27 XXD (2s)-pentane-1,2,5-triol 0.750 28 2FU But-2-enedial 0.714 29 3BB 3-bromobut-3-en-1-ol 0.714 30 4HA 4-hydroxybutan-1-aminium 0.714 31 5BR 1-bromopentane 0.714 32 5KO (3r)-3-hydroxybutanal 0.714 33 7CL 1-chloropentane 0.714 34 89N (2e)-but-2-ene-1,4-diol 0.714 35 A1BNQ Acetoacetyl group 0.714 36 AML Amylamine 0.714 37 BEO Butenoic acid 0.714 38 BMD Butyramide 0.714 39 BU1 1,4-butanediol 0.714 40 BU2 1,3-butanediol 0.714 41 BU3 (R,R)-2,3-butanediol 0.714 42 BU4 (3r)-butane-1,3-diol 0.714 43 BU9 Meso-2,3-butanediol 0.714 44 BUA Butanoic acid 0.714 45 BUD (2s,3s)-butane-2,3-diol 0.714 46 BUO Butane-2,3-dione 0.714 47 BUQ 4-hydroxy-2-butanone 0.714 48 HBR R,3-hydroxybutan-2-one 0.714 49 HBS S,3-hydroxybutan-2-one 0.714 50 HEX Hexane 0.714 51 I5Q (2s)-butane-1,2-diol 0.714 52 NZ5 (2~{R})-butane-1,2-diol 0.714 53 P1W 3-methylbut-2-en-1-ol 0.714 54 PE9 Pentan-1-ol 0.714 55 PTL Pentanal 0.714