# List species below. For each species, the following entries must be given: # ID : species ID # NAME : species name # MW : molecular weight (g/mol) # K0 : Henry constant at 298 K (M/atm, liquid over gas) # CR : Henry temperature dependency (-d ln(KH)/d(1/T) # pKA : acid dissociation constant # ID NAME MW K0 CR PKA 1 CO 28.0 12.0 1.0 0.0 0.0 0.0 2 SO2 64.0 64.0 1.0 0.0 0.0 0.0 3 NOT 30.0 30.0 1.0 0.0 0.0 0.0 4 NO2 46.0 46.0 1.0 0.0 0.0 0.0 5 BUTADIENE13 54.1 12.0 4.0 0.0 0.0 0.0 6 HCL 36.5 36.5 1.0 0.0 0.0 0.0 7 CL2 70.9 70.9 1.0 0.0 0.0 0.0 8 CH4 16.0 12.0 1.0 0.0 0.0 0.0 9 ETHY 28.1 12.0 2.0 0.0 0.0 0.0 10 TERP 120.0 12.0 10.0 0.0 0.0 0.0 11 HONO 47.0 47.0 1.0 0.0 0.0 0.0 12 FORM 30.0 12.0 1.0 0.0 0.0 0.0 13 PAR 58.1 12.0 4.0 0.0 0.0 0.0 14 IOLE 56.1 12.0 4.0 0.0 0.0 0.0 15 OLE 42.1 12.0 2.0 0.0 0.0 0.0 16 ETH 28.1 12.0 2.0 0.0 0.0 0.0 17 ETHA 30.1 12.0 2.0 0.0 0.0 0.0 18 ETOH 46.1 12.0 2.0 0.0 0.0 0.0 19 MEOH 32.0 12.0 1.0 0.0 0.0 0.0 20 BENZ 78.1 12.0 6.0 0.0 0.0 0.0 21 TOL 92.1 12.0 7.0 0.0 0.0 0.0 22 XYLMN 106.2 12.0 8.0 0.0 0.0 0.0 23 NAPH 128.2 12.0 10.0 0.0 0.0 0.0 24 SULF 98.1 98.1 1.0 0.0 0.0 0.0 25 NH3 17.0 17.0 1.0 0.0 0.0 0.0 26 ACROLEIN 56.1 12.0 3.0 0.0 0.0 0.0 27 ALD2 44.1 24.0 2.0 0.0 0.0 0.0 28 ALDX 58.1 12.0 3.0 0.0 0.0 0.0 29 ISOP 68.1 12.0 5.0 0.0 0.0 0.0 30 PRPA 44.1 12.0 3.0 0.0 0.0 0.0 31 ACET 58.0 12.0 3.0 0.0 0.0 0.0 32 KET 72.1 12.0 4.0 0.0 0.0 0.0 33 NH3_FERT 17.0 17.0 1.0 0.0 0.0 0.0 34 ALD2_PRIMARY 44.1 12.0 2.0 0.0 0.0 0.0 35 FORM_PRIMARY 30.0 12.0 1.0 0.0 0.0 0.0 36 SOAALK 58.0 12.0 4.0 0.0 0.0 0.0 37 PAL 27.0 27.0 1.0 0.0 0.0 0.0 38 PCA 40.0 40.0 1.0 0.0 0.0 0.0 39 PCL 35.5 35.5 1.0 0.0 0.0 0.0 40 PFE 55.8 55.8 1.0 0.0 0.0 0.0 41 PH2O 18.0 18.0 1.0 0.0 0.0 0.0 42 PK 39.1 39.1 1.0 0.0 0.0 0.0 43 PMG 24.3 24.3 1.0 0.0 0.0 0.0 44 PMN 54.9 54.9 1.0 0.0 0.0 0.0 45 PMOTHR 12.0 12.0 1.0 0.0 0.0 0.0 46 PNA 23.0 23.0 1.0 0.0 0.0 0.0 47 PNCOM 28.0 28.0 1.0 0.0 0.0 0.0 48 PNH4 18.0 18.0 1.0 0.0 0.0 0.0 49 PNO3 30.0 30.0 1.0 0.0 0.0 0.0 50 PTI 47.9 47.9 1.0 0.0 0.0 0.0 51 PSI 28.1 28.1 1.0 0.0 0.0 0.0 52 PMC 12.0 12.0 1.0 0.0 0.0 0.0 53 PEC 12.0 12.0 1.0 0.0 0.0 0.0 54 POC 12.0 12.0 1.0 0.0 0.0 0.0 55 PSO4 96.1 96.1 1.0 0.0 0.0 0.0 56 VOC_INV 12.0 12.0 1.0 0.0 0.0 0.0 57 UNR 12.0 12.0 1.0 0.0 0.0 0.0 58 UNK 12.0 12.0 1.0 0.0 0.0 0.0 59 CH4_INV 16.0 12.0 1.0 0.0 0.0 0.0 60 CO2_INV 44.0 12.0 1.0 0.0 0.0 0.0 61 C2H4 28.1 12.0 2.0 0.000000E+00 0.00 0.00 62 EOH 46.1 12.0 2.0 1.900000E+02 6600.00 0.00 63 MOH 32.0 12.0 1.0 2.000000E+02 5600.00 0.00 64 PRPE 42.1 12.0 3.0 0.000000E+00 0.00 0.00 65 MTPA 136.2 12.0 10.0 4.900000E-02 0.00 0.00 66 MTPO 136.2 12.0 10.0 4.900000E-02 0.00 0.00 67 LIMO 136.2 12.0 10.0 7.000000E-02 0.00 0.00 68 SESQ 204.0 12.0 15.0 0.000000E+00 0.00 0.00