| # | name | Query compound | nnm1 | nnm2 | nnm3 | nnm4 | nnm5 | nnm6 | nnm7 | nnm8 | nnm9 |
| 1 | Borax |  |  |  |  | OC(CC)O.CC(COC.smi.png) |  |  |  |  |  |
| 2 | Naled |  |  |  |  |  |  |  |  |  |  |
| 3 | Baking_Soda |  |  |  |  | _sulfate.smi.png) |  |  |  |  |  |
| 4 | Oxybis(tributyltin) | .smi.png) |  |  |  |  |  |  | -7,11-Hexadecad.smi.png) |  |  |
| 5 | bromadiolone |  |  |  |  |  |  |  |  |  |  |
| 6 | tris |  |  |  |  |  | _gl.smi.png) |  |  |  |  |
| 7 | silica |  |  |  | _sulfate.smi.png) |  |  | _su.smi.png) |  |  |  |
| 8 | glycerol |  |  | _gl.smi.png) |  |  |  |  |  |  |  |
| 9 | NAA |  |  |  |  |  |  |  |  |  |  |
| 10 | xylene |  |  |  |  |  |  |  |  |  |  |
| 11 | cyfluthrin |  |  |  |  |  |  |  |  |  |  |
| 12 | Propoxur |  |  |  |  |  |  |  |  |  |  |
| 13 | 4-hydroxy-3-(3-oxo-1 |  |  |  |  |  |  |  |  |  |  |
| 14 | trifluralin |  |  |  |  |  |  |  |  |  |  |
| 15 | Endosulfan |  |  |  |  |  |  | _su.smi.png) |  |  |  |
| 16 | Metalaxyl |  |  |  |  |  |  |  |  |  |  |
| 17 | TBT |  |  |  |  |  |  | .smi.png) | -7,11-Hexadecad.smi.png) |  |  |
| 18 | Dimethyl_tetrachloro |  |  |  |  |  |  |  |  |  |  |
| 19 | Gencor |  |  |  | -7,11-Hexadecad.smi.png) |  |  |  |  |  |  |
| 20 | Esfenvalerate |  |  |  |  |  |  |  |  |  |  |
| 21 | Chlorpyrifos |  |  |  |  |  |  |  |  |  |  |
| 22 | 1-Naphthaleneacetami |  |  |  |  |  |  |  |  |  |  |
| 23 | Dimethoate |  |  |  |  |  |  |  |  |  |  |
| 24 | Polypropylene_glycol |  | OC(CC)O.CC(COC.smi.png) |  |  |  |  |  |  |  |  |
| 25 | Calcium_hypochlorite |  |  |  |  | .smi.png) |  |  |  |  |  |
| 26 | DBH |  |  | _su.smi.png) |  |  |  |  |  |  |  |
| 27 | Diethoxy-[(2-isoprop |  |  |  |  |  |  |  |  |  |  |
| 28 | sulfo |  |  | _sulfate.smi.png) |  |  |  |  |  |  |  |
| 29 | Mecoprop |  |  |  |  |  |  |  |  |  |  |
| 30 | Copper_triethanolami |  |  |  | OC(CC)O.CC(COC.smi.png) |  |  |  |  |  |  |
| 31 | Derris |  |  |  |  |  |  |  |  |  |  |
| 32 | OLEIC_ACID_oleic_aci |  | -7,11-Hexadecad.smi.png) |  | .smi.png) |  |  |  |  |  |  |
| 33 | Sevin |  |  |  |  |  |  |  |  |  |  |
| 34 | triadimefon |  |  |  |  |  |  |  |  |  |  |
| 35 | N,N'-Diethyl-3-methy |  |  |  |  |  |  |  |  |  |  |
| 36 | Methiocarb |  |  |  |  |  |  |  |  |  |  |
| 37 | 5-chloro-2-methyl-4- |  |  |  |  |  |  |  |  |  |  |
| 38 | 1,2-dichloroethane |  | _gl.smi.png) |  |  |  |  |  |  |  |  |
| 39 | (Z,E)-7,11-Hexadecad | -7,11-Hexadecad.smi.png) |  |  |  |  |  |  |  |  |  |
| 40 | Diethanolamin |  |  |  |  | OC(CC)O.CC(COC.smi.png) |  |  |  |  |  |
| 41 | 1,3,5-triazin-2,4,6- |  |  |  |  |  |  |  |  |  |  |
| 42 | 1-Bromo-3-chloro-5,5 |  |  |  |  |  |  |  |  |  |  |
| 43 | tetramethrin |  |  |  |  |  |  |  |  |  |  |
| 44 | Ethanol |  |  |  |  | _gl.smi.png) |  |  |  |  |  |
| 45 | 3_Iodo-2Propynyl_But |  |  |  |  |  | -7,11-Hexadecad.smi.png) |  |  |  |  |
| 46 | Oryzalin |  |  |  |  |  |  |  |  |  |  |
| 47 | Bortrioxid |  |  |  |  |  |  | _sulfate.smi.png) |  |  |  |
| 48 | copper(II)_sulfate | _sulfate.smi.png) |  |  |  |  |  |  |  |  |  |
| 49 | pyrethrin_I |  |  |  |  |  |  |  |  |  |  |
| 50 | 3-(2,2-Dichloroethen |  |  |  |  |  |  |  |  |  |  |
| 51 | metaborate |  |  |  |  |  |  | OC(CC)O.CC(COC.smi.png) |  |  |  |
| 52 | dibromsalan |  |  |  |  |  |  |  |  |  |  |
| 53 | Ethylone |  |  |  |  |  |  |  |  |  | -7,11-Hexadecad.smi.png) |
| 54 | Ziram |  |  |  |  |  |  |  |  |  |  |
| 55 | 2-Undecanone |  |  |  |  | -7,11-Hexadecad.smi.png) |  |  |  |  |  |
| 56 | hydramethylnon |  |  |  |  |  |  |  |  |  |  |
| 57 | 1-Methyl-4-prop-1-en |  |  |  |  |  |  |  |  |  |  |
| 58 | Didion |  |  |  |  |  |  |  |  |  |  |
| 59 | princep |  |  |  |  |  |  |  |  |  |  |
| 60 | folpet |  |  |  |  |  |  |  |  |  |  |
| 61 | 1,3-dichloro-5,5-dim |  |  |  |  |  |  |  |  |  |  |
| 62 | Streptomycin |  |  |  |  |  |  |  |  |  |  |
| 63 | Bendiocarb |  |  |  |  |  |  |  |  |  |  |
| 64 | tau-fluvalinate |  |  |  |  |  |  |  |  |  |  |
| 65 | Betula |  |  |  |  |  |  |  |  |  |  |
| 66 | Chlorite |  |  |  |  |  |  | _sulfate.smi.png) |  |  |  |
| 67 | butanol |  |  |  | _gl.smi.png) |  |  |  |  |  |  |
| 68 | Cypermethrin |  |  |  |  |  |  |  |  |  |  |
| 69 | poly(oxyethylene)_gl | _gl.smi.png) |  |  |  |  |  |  |  |  |  |
| 70 | siloxane |  |  |  |  |  |  |  |  |  |  |
| 71 | Mancozeb |  |  |  |  |  |  |  |  |  |  |
| 72 | EDTA |  |  |  |  |  |  |  |  |  |  |
| 73 | Ethylene_glycol | _gl.smi.png) |  |  |  |  |  |  |  |  |  |
| 74 | methoprene |  |  |  |  |  |  |  |  | -7,11-Hexadecad.smi.png) |  |
| 75 | 1-[2-(2,4-dichlorphe |  |  |  |  |  |  |  |  |  |  |
| 76 | resmethrin |  |  |  |  |  |  |  |  |  |  |
| 77 | isopropylamine |  |  |  |  |  |  |  |  |  |  |
| 78 | SDS |  |  |  |  | -7,11-Hexadecad.smi.png) |  | .smi.png) |  |  |  |
| 79 | (trichloromethyl)_su | _su.smi.png) |  |  |  |  | _sulfate.smi.png) |  |  |  |  |
| 80 | Benomyl |  |  |  |  |  |  |  |  |  |  |
| 81 | triclosan |  |  |  |  |  |  |  |  |  |  |
| 82 | triforine |  |  |  |  |  |  |  |  |  |  |
| 83 | Fenoxycarb |  |  |  |  |  |  |  |  |  |  |
| 84 | nabam |  |  |  |  |  |  |  |  |  |  |
| 85 | Dicamba |  |  |  |  |  |  |  |  |  |  |
| 86 | ethyl_bromide |  |  |  |  |  |  |  |  |  |  |
| 87 | 2,5-Pyridinedicarbox |  |  |  |  |  |  |  |  |  |  |
| 88 | anti-K |  |  |  |  |  |  |  |  |  |  |
| 89 | pendimethalin |  |  |  |  |  |  |  |  |  |  |
| 90 | 2-tetrahydrofuraldeh |  |  |  |  |  |  |  |  |  |  |
| 91 | Methomyl |  |  |  |  |  |  |  |  |  |  |
| 92 | Ansar |  |  |  |  |  |  |  |  |  |  |
| 93 | Zyban |  |  |  |  |  |  |  |  |  |  |
| 94 | Phenothrin |  |  |  |  |  |  |  |  |  |  |
| 95 | carbonate |  |  |  |  | _sulfate.smi.png) |  |  |  |  |  |
| 96 | 1-methylpropylene |  |  |  |  |  |  |  |  |  |  |
| 97 | fenvalerate |  |  |  |  |  |  |  |  |  |  |
| 98 | Melamine |  |  |  |  |  |  |  |  |  |  |
| 99 | 2-Methyl-4-chlorophe |  |  |  |  |  |  |  |  |  |  |
| 100 | ETHYL_ALCOHOL_ETHYLE |  |  |  |  |  |  | OC(CC)O.CC(COC.smi.png) |  |  |  |
| 101 | cacodylate_ion |  |  |  |  |  |  |  |  |  |  |
| 102 | N-hydroxyethylethyle |  |  |  |  |  | _gl.smi.png) |  |  |  |  |
| 103 | Kaptan |  |  |  |  |  |  |  |  |  |  |
| 104 | Para-tert-amylphenol |  |  |  |  |  |  |  |  |  |  |
| 105 | Methyl_Parathion |  |  |  |  |  |  |  |  |  |  |
| 106 | sodium_metasilicate |  |  |  | _sulfate.smi.png) |  |  |  |  |  |  |
| 107 | Dichlorvos |  |  |  |  |  |  |  |  |  |  |
| 108 | Moxie |  |  |  |  |  |  |  |  |  |  |
| 109 | sulfonate |  |  | _sulfate.smi.png) |  |  |  |  |  |  |  |
| 110 | dodecylbenzene |  |  | -7,11-Hexadecad.smi.png) |  |  |  |  |  |  |  |
| 111 | Carbophos |  |  |  |  |  |  |  |  |  |  |
| 112 | Propan-1,2-diol |  |  |  | _gl.smi.png) |  |  |  |  |  |  |
| 113 | N-butyl-N-ethyl-2,6- |  |  |  |  |  |  |  |  |  |  |
| 114 | TEA |  |  |  |  |  |  |  |  |  | _gl.smi.png) |
| 115 | benzyl_methyl_ammoni |  |  |  |  |  |  |  |  |  |  |
| 116 | testo |  |  |  |  |  |  |  |  |  |  |
| 117 | n-dodecylguanidine_h |  |  |  |  |  | -7,11-Hexadecad.smi.png) | .smi.png) |  |  |  |
| 118 | phenol |  |  |  |  |  |  |  |  |  |  |
| 119 | 2,4,6,8-Tetramethyl- |  |  |  |  | OC(CC)O.CC(COC.smi.png) |  |  |  |  |  |
| 120 | acrylonitrile |  |  |  |  |  |  |  |  |  |  |
| 121 | 2-ethoxyethanol |  |  |  |  |  |  |  | _gl.smi.png) |  |  |
| 122 | Acephate |  |  |  |  |  |  |  |  |  |  |
| 123 | ZnSO4 | _sulfate.smi.png) |  |  |  |  |  |  |  |  |  |
| 124 | 3,4,5-tribromo_salic |  |  |  |  |  |  |  |  |  |  |
| 125 | ethanol-iodine |  |  |  |  |  |  |  |  |  |  |
| 126 | 2,6-Dichlorobenzonit |  |  |  |  |  |  |  |  |  |  |
| 127 | Dimethazan |  |  |  |  |  |  |  |  |  |  |
| 128 | Isobutylamin |  |  |  |  |  |  |  |  |  |  |
| 129 | Diquat_dibromide |  |  |  |  |  |  |  |  |  |  |
| 130 | Pindone |  |  |  |  |  |  |  |  |  |  |
| 131 | DISODIUM_CYANODITHIO |  |  |  |  |  |  |  |  |  |  |
| 132 | Bensulide |  |  |  |  |  |  |  |  |  |  |
| 133 | hexane |  |  |  |  |  |  |  |  |  |  |
| 134 | Borea |  |  |  |  |  |  |  |  |  |  |
| 135 | CCC(O)OC(CC)O.CC(COC | OC(CC)O.CC(COC.smi.png) |  |  |  |  |  |  |  |  |  |
| 136 | Gibberellins |  |  |  |  |  |  |  |  |  |  |
| 137 | Phosmet |  |  |  |  |  |  |  |  |  |  |
| 138 | ZINC_NAPHTHENATE_ZIN |  |  |  |  |  |  |  |  |  |  |
| 139 | prometon |  |  |  |  |  |  |  |  |  |  |
| 140 | iodine,_isopropyl_al |  |  |  |  |  |  |  |  |  |  |
| 141 | 2,6-dichloro-4-nitro |  |  |  |  |  |  |  |  |  |  |
| 142 | S-ethyl_di-propylthi |  |  |  |  |  |  |  |  |  |  |
| 143 | Disulfoton |  |  |  |  |  |  |  |  |  |  |
| 144 | Sodium_xylene |  |  |  |  |  |  |  |  |  |  |
| 145 | Copper_ethanolamine |  |  |  |  |  |  |  |  |  |  |
| 146 | 1,2-dicarboxylic_aci |  |  |  |  |  |  |  |  | _sulfate.smi.png) |  |
| 147 | Phorate |  |  |  |  |  |  |  |  |  |  |
| 148 | disodium_phosphate_s |  | _sulfate.smi.png) |  |  |  |  |  |  |  |  |
| 149 | marmer |  |  |  |  |  |  |  |  |  |  |
| 150 | 1,3-dichloro-5-ethyl |  |  |  |  |  |  |  |  |  |  |
| 151 | Citronellal |  |  |  |  |  |  |  |  |  |  |
| 152 | dibrom_nitrilopropio |  |  |  |  |  |  |  |  |  |  |
| 153 | Dichlorpropene |  |  |  |  |  |  |  |  |  |  |
| 154 | Coumaphos |  |  |  |  |  |  |  |  |  |  |
| 155 | triethylenglykol |  |  |  |  |  |  |  |  |  | OC(CC)O.CC(COC.smi.png) |
| 156 | brodifacoum |  |  |  |  |  |  |  |  |  |  |
| 157 | Thiram |  |  |  |  |  |  |  |  |  |  |
| 158 | p-Chloro-o-benzylphe |  |  |  |  |  |  |  |  |  |  |
| 159 | polyvinyl_alcohol |  |  |  |  |  |  |  |  |  | .smi.png) |
| 160 | oxyfluorfen |  |  |  |  |  |  |  |  |  |  |
| 161 | MSMA |  |  |  |  |  |  | _sulfate.smi.png) |  |  |  |
| 162 | benzylalkohol |  |  |  |  |  |  |  |  |  |  |
| 163 | Stirofos |  |  |  |  |  |  |  |  |  |  |
| 164 | prometryn |  |  |  |  |  |  |  |  |  |  |
| 165 | Strychnine |  |  |  |  |  |  |  |  |  |  |
| 166 | peroxymonosulfate |  | _sulfate.smi.png) |  |  |  |  |  |  |  |  |
| 167 | dicofol |  |  |  |  |  |  |  |  |  |  |
| 168 | Pyrethrin |  |  |  |  |  |  |  |  |  |  |
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