sample91	sample92	sample93	sample94	sample95	sample96	sample97	sample98	sample99	sample100	sample101	sample102	sample103	sample104	sample105	sample106	sample107	sample108	sample109	sample110	sample111	sample112	sample113	sample114	sample115	sample116	sample117	sample118	sample119	sample120	sample121	sample122	sample123	sample124	sample125	sample126	sample127	sample128	sample129	sample130	sample131	sample132	sample133	sample134	sample135	sample1	sample2	sample3	sample4	sample5	sample6	sample7	sample8	sample9	sample10	sample11	sample12	sample13	sample14	sample15	sample16	sample17	sample18	sample19	sample20	sample21	sample22	sample23	sample24	sample25	sample26	sample27	sample28	sample29	sample30	sample31	sample32	sample33	sample34	sample35	sample36	sample37	sample38	sample39	sample40	sample41	sample42	sample43	sample44	sample45
Oxoadipic acid	2.59566309383295	1.98169148464295	2.30136688199298	0.0977171589519682	2.33136708756893	3.58768265728437	2.16158788306478	3.49234861343448	1.94581962413523	0.348840342476921	0.461434691827304	0.623448065320023	3.21430944565391	2.5274046346964	-0.289094423842401	-0.0846490152193745	-0.122073958406301	-0.287302133358291	-0.0466944642058324	-0.0816861061611275	0.0237896308255679	0.0910917093896289	-0.265125562605686	0.591526919707515	0.240479542185347	-0.324960063886052	-0.407298752374798	-0.399999195277096	-0.343483589635396	0.199782129157317	0.578332861696861	0.208195570773318	-0.366139363273638	0.0619172433155023	-0.326036627448463	0.357703027968856	-0.395601984332748	0.130413871232187	-0.327744899375196	0.132707731800023	-0.329399474277461	-0.481577169578297	-0.304285064072874	-0.512016506484885	-0.0982524159592884	-0.567893063404671	-0.56010861435517	-0.57039584652042	-0.631177221889395	-0.539916978009604	-0.483377272419786	-0.547028013366968	-0.497120151515055	-0.563633653806688	-0.630412915802348	-0.614751727270079	-0.600299593365856	-0.513056331098642	-0.523966625809578	-0.627955952528924	-0.571617265944377	-0.570869229392692	-0.631070879458579	-0.553522421761841	-0.55371915041174	-0.551023230020625	-0.556721612780778	-0.602032285630764	-0.449541049017504	-0.458671626476337	-0.583123603678795	-0.61415903453671	-0.627446150000931	-0.612274083628596	-0.534508819436197	-0.457508512179739	-0.51940069835863	-0.638178034268104	-0.560092441254757	-0.610682707238632	-0.46781734060616	-0.613249783833045	-0.298849056273365	-0.529396694917445	-0.274101093384284	-0.561051600267382	-0.4998616473727	-0.458708842556493	-0.580433980768762	-0.482474296540978
Adipic acid	-0.579963111117777	0.563434789378337	-0.618627154247829	-0.54734180693813	-0.543674992635799	-0.558437050707181	-0.629535818575	-0.394004978114142	-0.508847763397384	-0.520587350998735	-0.489846981739958	-0.255944464654329	0.649743341430543	0.164234117342232	-0.336719339291545	-0.306802457487196	2.22838579284664	-0.248846276270717	2.24073744263323	0.121178285471618	2.59727354194619	0.86425829037518	-0.223453377130668	4.1451514570529	0.107915377965203	-0.211014122626164	-0.151579734474502	-0.149251465871415	0.253429415152343	-0.377202550632041	4.29178072423015	-0.0815578464016869	1.42318098134025	-0.1003230474269	-0.0305220052997092	-0.177945244288169	2.74440127035254	-0.198001041000779	1.15633797663511	-0.0334531237068366	0.3903186553556	-0.301554142145332	0.858348971792791	0.0431225909992883	-0.670125060308398	-0.686082475705069	0.683277479281213	-0.679121037627456	-0.689122675926252	-0.674194672369716	-0.687790778687563	-0.704092042768562	-0.559957597659888	-0.617783446897507	-0.682235691740298	-0.687658416222397	-0.274575863607703	0.752420318706144	0.269855747892559	-0.700220440845776	-0.694400628974584	0.401167579728228	-0.647250639314182	0.397796473416177	-0.695906251951405	0.641078672799743	-0.148628847552541	-0.662724638033524	1.38694112918749	-0.667311824501293	-0.649856525234064	-0.694905260854817	-0.660987380764276	-0.35896520383952	-0.692497918635886	1.17476824340215	-0.660652338291836	0.011016823086817	-0.685565434845027	-0.641728642987212	-0.662703956397841	0.170267758882086	-0.695779232303897	-0.268431647716753	-0.690421897117812	-0.502520598965939	-0.700981663640881	-0.366427333314183	-0.694215580190493	-0.700962355708284
Isocitric acid	-0.284460575923955	1.59075899919407	-0.418537480758363	-0.656510162225132	-0.406196096047058	-0.504414860599937	-0.523699531659673	-0.409547896418777	3.93027416860449	0.165563333608658	1.03848223012797	-0.924950079359413	0.935150603241671	-0.244492523899595	0.681670824980608	0.219148370419164	-0.340883815109279	1.04622922263266	-0.0568888621389354	0.084452727724158	-0.725871254916445	-0.67254676992722	0.334410398982903	-0.579624728358179	-0.713430929176083	-0.567406743422045	-0.311154925153274	-0.557760743905057	-0.786304312718142	-0.579365813537791	-0.630783326713061	-0.00260426640828005	-0.345117192253661	0.207047064385143	0.789332647587173	0.623471001708346	-0.622200721283496	0.228354768998576	-0.643660710654596	-0.718027019665364	-0.791969325391293	-0.41804135767167	0.618476794614335	-0.857176237024575	-0.958837000515399	-0.583811948205581	1.517490102288	-0.565896674696445	-0.551566743208583	-0.765297729422523	-0.81616155271349	-0.764297035876353	-0.120502273657776	4.24218420265186	0.471262142435708	1.11066528941056	-0.814783454751248	1.40421731220744	-0.738576352688797	1.02438835124187	0.659180953507383	-0.0309945247808644	2.34007735000913	0.387701372215493	-0.766229803979796	-0.732800921390013	-0.692492985311865	0.721052405829087	-0.799121171232767	-0.806206081504895	-0.377646205048854	-0.630318466021671	-0.478819181581051	-0.840389772995419	-0.233426251524214	-0.649663301608956	0.44870365069307	-0.277027898795057	0.757283230320707	2.11993048826465	1.71896688082228	-0.439423798155697	0.314829579392865	-0.595427060172708	-0.674878116215222	-0.755683552571767	-0.0306741040937392	1.88737834046492	-0.90014487818504	-0.933407705338816
L-Phenylalanine	0.115595951507016	-0.171166254177241	-0.278947610639464	-0.282856189072924	-0.282871643391117	0.0272889147533248	-0.0419200297103093	-0.257220297591273	-0.139196415986192	-0.216495226471642	-0.225475102547515	-0.282879370550177	-0.254912137028395	-0.260941523508341	-0.270275143052372	-0.2580445539604	-0.262369754336669	-0.267865437081452	-0.26869273039867	-0.271856744783872	-0.282825280436537	-0.282883234129744	-0.277477345476557	-0.193163290659477	-0.259360347095385	-0.254313839039205	-0.282885165919564	-0.281302609231095	-0.282886131814401	-0.262826824281708	-0.278850561804447	-0.282886614761856	-0.282434760116004	-0.273761402360261	-0.258831010829949	-0.280890856729496	-0.279267266331887	-0.227987151778235	-0.278100497509488	-0.168202670980634	-0.281182349332767	-0.282886856235583	-0.262748989068867	-0.272271241422762	-0.253050799057918	0.381536662631333	0.00211992350686115	-0.252739656817472	-0.257387968487674	-0.260754640904719	0.424400375595193	0.123229244267986	-0.11669100058353	0.0123735236125465	-0.194613403944435	-0.179074803714696	-0.25524412670827	-0.233042654818064	-0.263955579908962	-0.197813856875556	-0.144232393051599	-0.23472234586495	-0.142778702142933	-0.224192199409365	-0.249244188655219	-0.222003157609615	-0.242805859008475	-0.246710071434696	0.363189828919468	-0.0838500274032442	-0.0755968926341246	-0.232275226530853	-0.263149269887899	-0.275600174153385	-0.203991192892214	-0.239211728438182	-0.268612153953811	-0.270303995537052	-0.20570684951883	-0.176615047844099	-0.249002149840829	0.770639119650755	3.80156553364289	0.449746690228562	8.14272117898474	0.0295943047322423	0.12256375240018	0.756090611365509	0.53804880998462	1.31848015348337
Fumaric acid	-0.174532426476563	1.95716038262401	-0.0856585543973196	-0.217257624191356	-0.0628790228685365	-0.412063853658727	-0.132595477313822	4.17906539953052	3.96428816277647	-0.283784919046122	0.870052224889373	-0.246401852241133	-0.209841173595912	-0.529198208751371	-0.291148652750135	0.00600862382514457	-0.240192377327902	2.75584586194393	-0.338939717125575	-0.495042401799237	-0.199723820316901	-0.259073655094738	1.54266452282528	-0.210055156801219	-0.00706785598968024	2.32218703559367	-0.293827088384428	-0.0111557680053274	-0.484885368040634	-0.180722360797635	-0.423754007155426	-0.530496142713122	-0.312713875057829	0.88860605737285	2.76883731793761	-0.207160294898335	-0.0801948150383147	0.0208586777774901	-0.25004385204049	-0.0325894584821567	-0.152964654337086	-0.409721105574884	-0.0226215741416426	0.404320730437521	-0.626919675897797	-0.571504291838117	0.577698215136239	-0.569818849115632	-0.638749309846463	-0.580062748723777	-0.696206326796717	-0.576222149733196	1.87813466347411	1.78400545305358	-0.662718515037555	-0.0277694342246812	-0.771781852448315	-0.69681419136341	-0.757220732991033	-0.568692918116594	-0.527289051886151	-0.71183120926202	1.05606690901075	-0.664645722041497	-0.736629320688327	-0.725204229794484	-0.702139913912162	0.548168430601845	-0.537332632482198	-0.583820456914702	0.827509830716759	-0.6652052337432	-0.513833140749736	-0.775581006017323	-0.478466474873367	-0.769923720987532	-0.778309489032693	-0.70957243977704	0.140477808280392	1.16963397028719	-0.577845424486409	-0.387657869111224	-0.319911426313143	-0.473009668508284	-0.441296249002975	-0.440790974154256	-0.715531630086984	-0.374352301284242	0.206594746568246	-0.725217329006204
Hydrocinnamic acid	0.00484076231092081	-0.667941364250892	0.0480983482892081	0.576135998450019	0.224794192385	-0.637134981531328	-0.624567426263388	-0.0770377190170296	-0.306687048843625	-0.659473391502618	-0.289749697718676	-0.659031169147533	-0.667986075373284	-0.676978053458415	-0.677342413275594	-0.677524593184276	-0.677615683138525	-0.650584936581607	-0.550702229206405	-0.67572330473133	-0.677661228115649	-0.676249333824056	-0.592946080971973	-0.677684000604211	-0.592411364160133	-0.497716833872824	-0.564717785405619	-0.636757145183392	-0.677695386848492	-0.67770107997054	-0.629990371137723	-0.53441043413934	-0.677703926531657	-0.558859431532021	-0.555614753265674	-0.207448908815087	-0.422880309466539	-0.677705349812308	-0.611570239916257	-0.47760016375221	-0.639021697326119	-0.583573316163668	-0.539598404696363	-0.677706061452541	-0.671532965065997	2.24626380619813	0.104173993574235	1.85662352367496	3.93479170380315	2.84353022631647	-0.316842060628404	-0.224924916819416	1.46316961242912	1.22256424658712	0.00813986324857462	1.18486131679118	-0.351814778611522	-0.232898870024016	-0.371446304291981	-0.132357722790438	-0.240049425777138	-0.141068399738182	-0.518401058750707	0.392016364166932	-0.444555319501628	-0.387090853462731	-0.279702507529302	-0.298770656142567	-0.173744272598354	0.322720978605865	0.935545273075541	0.940615667235833	-0.559180894766887	-0.587219740582554	-0.213267344158377	-0.0831272299700642	-0.00633459511879786	-0.409365917988394	0.661223953206597	0.758601521381942	4.00495382366987	2.73740708945742	-0.187599155576539	0.54740213992355	2.11860752340145	1.44808564429794	-0.239268091884512	0.689224829915229	-0.330062369591167	-0.632463256837663
3-Methylindole	-0.0133708409769321	0.0871483135690347	0.419337026280863	-0.184699974308031	0.611493834952085	0.159898094494623	0.115583509211537	0.237552271507654	0.65705555349526	0.710779898160248	0.0411630232507159	-0.231970181284221	0.32030247415305	0.109091893724403	-0.320528821443131	0.454826061675932	-0.185248321835963	1.35002163061717	0.113022522931405	-0.355252714083972	0.0317094262283786	-0.268642414614367	-0.33827489806256	-0.0488042618315391	0.733038151984435	8.47851289852848	-0.085210611789484	-0.0398316924716514	0.136450118468297	-0.129261373419368	-0.103502335841879	-0.380900395705858	-0.349623524854834	0.158275815954379	0.333870028746108	0.141940428932865	0.164120539565153	0.371375572502687	0.000802703187168473	0.501105319514949	0.190678904940945	-0.154615652963113	-0.0562883755760667	-0.446733014658787	-0.22921271872184	-0.379618139358798	-0.257452911220352	-0.32732858359667	-0.453865000733711	-0.349805363820153	-0.330077997997778	-0.366669284021754	-0.381822738998054	-0.239359990017853	-0.311262880413083	-0.379339396875499	-0.415145135827868	-0.288431337070483	-0.371255864875023	-0.48790959399131	-0.270933911266464	-0.455879548684644	0.0944721436707595	-0.328709625945186	-0.425344576687821	-0.317141812774303	-0.461758481045863	-0.431160158481201	-0.461796491386567	-0.256375951567074	2.30862504639958	-0.3684811101556	-0.442259177358891	-0.380796459859834	-0.483855157877503	-0.456639755453133	-0.468524321311252	-0.474821367405019	-0.377033436342895	-0.341709161736502	-0.398686659214852	-0.298531266893911	-0.112006932607892	-0.357339121290684	-0.0938935307717334	-0.180721312496526	-0.378244803556658	-0.226101940040806	-0.406604660668601	-0.115586130504767
Erucic acid	0.0358956161644872	-0.452954415372649	-0.586617159779526	-0.439923641855503	0.379787428188384	-0.593076980131162	-0.59630689030698	-0.597921845394889	1.68744926668861	0.288584427429685	-0.598729322938843	-0.599133061710821	1.75359439702199	-0.599334931096809	-0.427754455179581	-0.599435865789893	-0.599486333136256	-0.474345130362603	-0.213091891036621	-0.294851700423422	0.124063159007524	-0.0445624654121367	-0.0048804059122446	0.0921994987955791	-0.00727098664301666	-0.599511566809616	-0.460248495175678	-0.599524183646118	-0.270290883456337	-0.569413655809325	-0.568918761179962	-0.599530492064458	-0.599533646273628	-0.599535223378213	-0.527389529166724	-0.599536011930595	-0.599536406206696	-0.599536603344747	0.130977406968511	-0.550407077524842	-0.573697519072673	-0.201534796846653	-0.377370984706671	-0.599536701913772	-0.599536751198196	1.04419838522201	-0.459606812340607	-0.505699429125752	-0.515688274399864	1.22012065086177	-0.469514571087142	-0.514705100389521	-0.468075285415133	3.94049219610495	1.26553416833431	-0.518637796430894	-0.496232578315843	4.21556806917812	-0.542674880705282	1.3747526372678	-0.48772862988886	-0.495355830344968	-0.367994252347827	1.03839563144838	-0.534485142530134	1.94146630335481	1.81519939241462	1.84536357608952	1.53680910925233	1.71008085951318	-0.465759251790153	-0.398057078333256	-0.540282828473008	0.853315657187023	-0.519372642991938	-0.505385218873916	-0.525768341988405	-0.548751301547534	-0.534378716472761	-0.340576873803111	-0.495700448046883	-0.471475026459163	-0.469240763770653	2.64982590720302	-0.517731968539383	-0.444617648029729	1.40412430140622	-0.49041232886652	-0.52070071297975	-0.35892153862697
Caproic acid	-0.250614785799272	1.336063310107	0.298662400569674	-0.0208530109740777	-0.673740327939892	-0.727825792725845	-0.730212390366015	0.615500714337343	1.15529098300864	-0.0496074229513921	0.213362833858027	2.50472149746765	-0.576511513420825	-0.731405689185975	-0.665268426398901	-0.360512857198681	-0.723052597445506	-0.73200233859608	-0.732300663301132	-0.605759996077612	-0.732449825653783	-0.732524406829984	-0.389575596797682	-0.73256169741796	-0.24583842803308	0.934202138945951	0.0394286322871218	-0.732580342712072	-0.732589665359253	-0.499427386963717	-0.732594326682594	-0.732596657344389	-0.732597822675412	-0.336614204541446	-0.565013278842376	-0.661433777990787	-0.208421863336999	0.891571953868633	-0.732598405340798	-0.408982127916384	-0.563848209077353	-0.732598696673491	-0.339507652796287	-0.732598842339713	-0.732598915172949	-0.0997565107198832	1.84182143023201	1.16076238265189	0.334192616441091	-0.429523407112072	-0.624972716370384	-0.649081001218199	1.18487066767418	1.6532602017606	0.044893198416856	0.713037092621042	3.04981870309856	-0.463102803795844	-0.613779584125844	-0.129030856693751	0.573553444685129	-0.601725441689474	-0.689548479361834	-0.598281400996929	-0.605169482382019	-0.650803021552009	-0.666301204680924	0.570109403967659	-0.623250696011649	0.76125366241637	3.26334922658468	1.37170987516374	-0.665440194514019	-0.697297570913829	0.0259509745953962	-0.696436560746924	-0.517346444734583	-0.713656764197187	0.49778454939929	0.0621134017549593	-0.0524009511662338	1.05399550506216	4.59129558827277	-0.300810613982739	0.485380685252687	-0.318755065819642	-0.58231420328017	1.17848513997665	-0.245855730029714	0.417418434497809
Nonadecanoic acid	-0.677743149764955	-0.292923042571701	-0.691875119048771	-0.637097049818172	-0.276759622071306	-0.597190029817172	-0.568589766587516	-0.69894110369312	0.250155906495218	-0.319412995559557	-0.588780413528237	-0.702474096015295	-0.305923683298413	-0.450758279933144	-0.0525665547890151	3.19214016730658	-0.250576935547584	1.58288463475026	0.950350942982508	0.0961806966447084	-0.315442811655305	0.215600263744122	3.10805920561579	-0.704240592176382	-0.705123840256926	1.00516685824984	-0.705565464297319	0.990471263989389	-0.705786276317272	-0.0200693728335497	3.63315783714479	1.54972110808346	-0.705896682327371	-0.70595188533242	0.123273829198451	1.16653199078658	2.26157715712578	1.61243729911783	1.07503459627301	-0.705979486835067	3.22836686155747	0.795630686208679	2.92829143794509	1.19163062147111	-0.649479211192441	-0.649169037883829	-0.434970721802756	-0.590871900957977	-0.515308907391408	-0.310351472170824	-0.466562154680587	-0.390999161016382	-0.601306580000952	0.228758873231089	-0.203241260449516	-0.563171365274285	-0.556384402424042	-0.18816403352932	-0.444631642825512	-0.26547350943905	-0.141628017827337	-0.67145326769449	-0.497202970670246	-0.252761771302601	-0.498087265498191	-0.439149014721392	-0.333763177932882	-0.162033121198792	-0.612758198089961	-0.497225078031791	-0.257050601151008	-0.593812181288353	-0.391618167383739	-0.57110791141306	-0.233793647041812	-0.0890124753815584	-0.377071517384719	-0.604622685624051	-0.629626122052	-0.422015802323173	-0.192828688890131	-0.274733415584329	-0.444056514581011	-0.382669812460043	-0.673709226298043	-0.186390929183116	-0.309277592935692	-0.161190668660303	-0.477335959900309	-0.591682820303167
Pipecolic acid	-0.408980583935414	-0.483295040969962	-0.431633355616326	-0.0515329160459754	-0.50371600538144	-0.590416034785776	-0.629995826132364	-0.53154769987174	-0.670362909387812	-0.65365807390286	-0.244964418307639	-0.428981264198541	-0.315432609926174	-0.26157228094329	-0.096991318089158	2.4999165714585	2.30203952664681	-0.0405601549370739	-0.165884282271437	0.697209308724321	1.31779789627518	3.03999569744636	-0.255938663614377	2.25306021952545	-0.678715327135094	0.243138994224879	-0.557590674666044	1.16534014392054	1.78401320897158	1.13871217623706	2.08738482067163	2.45778533681806	1.02123575830115	-0.682891536008735	2.70336569429242	1.5588444503248	-0.116513841084558	1.18736710383578	3.56466532981219	1.38036697652169	-0.252695588261272	0.253005607218275	-0.181698712013743	-0.684979640445555	0.0201875918256686	-0.675241608485735	-0.492414355522849	-0.646681314068919	-0.163445375437281	-0.624252068925597	-0.668806128216791	-0.622034071688139	-0.637094389616016	-0.67863383955592	-0.6563679476149	-0.338581237759819	-0.606500665879933	-0.363038608515803	-0.379971123870286	-0.510177426665376	-0.308273912402314	-0.245550520512757	-0.679541828859692	-0.664558944598919	-0.646759808455719	-0.339982468769516	-0.318895053660145	-0.536647012058376	-0.462204617915142	-0.650379036871069	-0.6841698164012	-0.681385386582997	-0.312164689096473	-0.270851175621052	-0.49023560547879	-0.300631315444641	-0.372744335136448	-0.522197677589624	-0.684283315064172	-0.26783338405541	-0.457124757177959	-0.670509291276815	-0.500511546683939	-0.176428497293474	-0.457741031753115	-0.643859843720947	-0.575372300804454	-0.660091630231401	-0.679717277495865	-0.430997412284201
Pentadecanoic acid	-0.185433402195366	1.16463141914822	-0.336759135807871	3.1454270205279	1.11566897634152	0.953657343591271	0.357491201210454	2.63864146503863	3.68084718321888	0.773461029612877	-0.155371180653819	1.58752617940081	1.55258602329792	-0.134134369022214	0.339568246775523	0.476468471781818	-0.277014532647025	1.30463084264388	-0.309049682876923	-0.339030735030445	-0.17846844080582	-0.405422687713524	0.731172246586962	0.0956645550875142	0.387731144502874	-0.319226305519896	0.1158910637639	0.317570539681878	0.232085737697573	0.925005580282732	0.226769483485219	0.134108666369352	0.31570363638277	-0.219398013863274	-0.151237243261255	0.98679142358424	0.272854222109321	-0.0850704874890131	-0.132481901129648	2.73215195810959	-0.435800715542434	0.340933182329159	0.182531821293558	1.27451802504123	3.81890314782842	-0.732637212844653	-0.656796652590974	-0.738764377735613	-0.519444162461241	-0.678061518970479	-0.684331350692001	-0.721062427714458	-0.554352483012629	-0.504205092448775	-0.681451733349804	-0.737409042852639	-0.613200672983394	-0.621067997776385	-0.73484479431118	-0.694312397168253	-0.655460089656983	-0.742541294326533	-0.632066484012612	-0.744240155916022	-0.733634003457206	-0.715245000023023	-0.728124435763907	-0.636042383278095	-0.69735157606796	-0.656608933071641	-0.740953187250206	-0.741373678956992	-0.701976984860306	-0.729421577595593	-0.651611839643407	-0.713947858170688	-0.73439426748248	-0.724572782599136	-0.73170800125788	-0.739661677004985	-0.625423090453812	-0.592008097588631	-0.658028941498128	-0.711215121645496	-0.0873397091630806	-0.689407464629184	-0.511167848086868	-0.511358971364819	-0.405221839731215	0.296956208301893
Malonic acid	-0.526678139065203	0.575614899274914	-0.520908935060059	-0.350513496522723	-0.243712646170371	-0.172235891502029	-0.460223231941786	0.00923433308684748	3.37374208109617	-0.364544008012052	-0.513404867952689	-0.560033203083052	-0.149233004917756	0.218322990941245	-0.304337791061005	-0.315965464504232	-0.40255256098111	6.6183756573687	-0.25965804744664	-0.120474098171918	1.32421077064076	-0.0934440196820037	0.795418237435392	-0.576710735089608	-0.208321977515154	0.214593826488182	0.386585523096563	-0.499496779051928	-0.585049501094071	0.184300104679815	-0.398060857079299	-0.58921888409867	-0.437601614525451	0.270144569905124	0.202400300548299	-0.27371770546539	0.490682206815667	1.20144006447094	-0.404498381302884	0.425162357844229	0.00464539257893422	-0.357311301970426	0.662738890907326	-0.0198523297205846	-0.185924197039977	-0.439207560600202	0.610603508696549	-0.301885322767551	-0.33049950496289	-0.421251030893253	-0.37532623730207	-0.502959700255055	-0.311767873135812	2.2467146512921	-0.400194093203028	-0.372419604807389	-0.424674398079439	-0.30440440404826	-0.491720721229843	-0.416600418906499	-0.307827771305479	-0.394057869010757	3.52543917703869	-0.458326743309758	-0.493529292567233	0.23248291568073	-0.422865826742048	0.344291379301319	-0.490299700893322	-0.311832464957451	-0.121415739958338	-0.302014506410829	-0.460781232981931	-0.517105311774949	-0.384756644989892	-0.450252764136818	-0.478737762688879	-0.501538679918534	-0.112695842379582	-0.235807876918056	-0.300141343109731	-0.368468200361314	0.529586921461574	-0.371328455558206	-0.375163797741661	-0.326864488563658	-0.49236925445948	-0.207383828964012	-0.470592311585928	-0.103978509142861
Putrescine	-0.465859587371216	-0.437630416820952	-0.46600808716946	4.43301689080209	0.286962814563506	-0.466082337068684	0.945306267189384	3.65188852797036	0.67406605203591	3.00033145774085	1.03093571569303	-0.439176427422126	0.867910435335926	-0.394036433970902	-0.466119462018295	-0.466138024493202	0.0682544766682881	-0.466147305730554	-0.46615194634913	-0.466154266658619	-0.466155426813263	0.857694627825665	-0.466156006890484	0.760373696323167	-0.207953296907177	-0.466156296929296	-0.466156441948602	-0.466156514458254	-0.465562587774323	0.172049243875373	-0.37104108029915	-0.466156550712979	0.185749099210805	-0.466156568845393	-0.466156577896548	3.90182896534157	-0.466156582442329	-0.466156584705118	3.58705161030981	-0.466156585834492	1.71228767247057	-0.46615658640221	-0.466156586685058	0.543879708993711	-0.46615658682628	-0.444460750313596	-0.407166280343982	-0.416170016350092	-0.171695508571223	-0.3853980518233	-0.373089627986057	-0.299678865338675	-0.147869541865122	-0.339706127556711	-0.199810692248674	-0.321595497145013	-0.427164528176345	-0.388147132231553	-0.430556086226921	-0.216303364952045	-0.225102593945755	-0.418133645210244	-0.340927739988585	-0.277132424476732	-0.311133065395169	-0.120181469876011	-0.419547096027393	-0.309837251330569	-0.418079351330668	-0.426131134556632	-0.263327299115402	-0.351172996179719	-0.43345356992083	-0.423725915432831	-0.395549198628557	-0.427160908583026	-0.385312991410618	-0.383029028632685	-0.42136413140865	-0.211073053919893	-0.445941163597038	-0.140623738591051	0.043998365732797	-0.360029026869498	-0.0123592584393737	-0.285428940816544	-0.408888508127596	-0.419461223212924	-0.387094796099737	0.236679121614325
Arachidonic acid	-0.842494358830205	-0.420247241677278	-0.757683207742212	-0.0366643669368277	0.0685844610511491	0.0630450078396165	-0.0864865388952904	0.118923678417509	-0.741048114682901	0.359624254711738	-0.765842307121442	-0.347130412242285	-0.0860943550450347	-0.404368279454367	-0.589453119175124	-0.417108280906874	1.26964202707093	0.0798796712374184	-0.385080366585053	0.35226879455869	-0.331246007461971	0.0510278435491548	2.29364971580217	1.27806309504345	2.29325879118383	1.67173301568464	-0.301788600912316	1.74182962218601	0.591929953461608	1.67793048752533	2.71942746412579	-0.111350498181738	0.360527656647182	2.60786902147268	2.9938808729464	-0.0541424512012974	1.92269846143033	1.41660362262399	2.39157862502814	-0.0319955320612223	-0.299609566371229	1.64652473379266	-0.309077733540629	0.946806219040285	-0.0554993551988361	-1.04270062354971	-0.639492700099843	-1.02590342954237	-0.243699878923187	-0.155650719147597	-0.0646924710181752	-0.340306951796531	-0.121829273823762	-0.961914776195817	0.171419124235958	-1.04902434682833	-0.483405496321844	-0.380788314515264	-0.68402470871755	-1.19428557729669	-1.14481602199867	-0.343130737007182	-0.809323747088355	-1.1345194299058	-0.778332359631502	-1.1867676098908	-0.976866662309756	0.272928619503805	-0.335186253946759	0.232600300100089	-0.0873843632679624	-1.13177718450227	-0.113296450246744	-0.712346608969587	-0.0443326161228796	0.438581066062669	-0.964483906422278	-0.687241139251358	0.393366632913174	0.533365411795365	-0.991910123916377	-0.112884718232539	-0.505081281084812	-0.0455466414824585	-1.0610992533452	-1.16211295863474	-0.284673822849409	-1.06347901669359	-0.61141726068105	-0.909428121558881
Methylsuccinic acid	-0.274077820626055	0.206229353606982	0.955118016555538	0.397457517414665	0.819479455287485	0.033863989758509	-0.539582831511252	0.380010890778679	0.0210653108548435	-0.232827430219891	3.33987059287195	-0.395327289863036	1.74479504340475	-0.0805508645631952	-0.0251799292224394	0.507098898352075	1.05537774902792	0.546825210525904	0.0110396992770258	0.137525503923333	1.23021887256029	0.520356615937945	2.09363740180465	0.133010767661437	0.407950662237589	2.21235484320281	0.292858732965325	0.519550753582534	0.0401954598977415	1.71462764645623	-0.370582558102385	-0.0807681401449187	-0.0317960053218746	1.50187383734605	1.13890538676608	0.354205704183897	1.08864395881577	1.16318109892192	1.80385778320097	1.4545245594845	2.12435544456474	0.941698729266379	0.705685263587957	0.457151659382686	2.86879788453879	-1.05341170538766	-0.979148352259378	-0.559067179317676	-0.828760409074043	-0.597967030936685	-0.930011697532147	-1.12786118219509	-0.867846384440852	-0.94806569571373	-1.05322558170852	0.385138310005059	-1.0230735435586	-0.281556754281984	-1.01078937991112	-1.040010799528	-0.916424668061991	-0.764919982733127	-0.894648196091527	-1.03089073863196	-1.02102618295068	-0.704802030181091	-1.00799752451797	-0.628119069086603	-1.00427505066043	-0.915866296955899	-0.391369732530034	-0.984918186724826	-0.931686810781769	-1.10794594715339	-0.508813782446916	-1.11687988437029	-1.0740714352146	-1.04094141799238	-0.575446064249637	-0.756916663980619	-0.921822255100493	-0.437637467099638	-0.418126792807659	-0.0714371102948369	-0.303764221961086	0.0402239829002733	-0.56820890632653	-0.476358652720616	-0.651954725810939	0.209995771946775
4-Hydroxycinnamic acid	-0.681052399455168	-0.393224212232174	0.376360391836469	0.256619205097464	-0.262257212070031	-1.17657542466387	-0.547670157664877	0.089391351488792	1.98825136919631	0.0538681427022173	0.594992777898056	-0.70995121825137	2.17693212776552	-0.748176484534094	2.08214076422784	1.03350634782166	-1.16032335641392	0.60984190041457	1.44305691595318	0.268270472318358	0.206291379933572	1.78758813132425	0.391101678177015	0.66277068764825	2.68223723616498	1.948527243738	1.55525125919677	0.396329306926717	0.324981738148485	0.581293109848815	-0.125487305898939	0.138195047295335	0.50355511344139	0.685484121892296	-0.466184560755658	1.5823616421164	1.49728866712604	-0.0581454941603666	1.13526815996903	-0.176435862726199	1.41162850604305	0.991727884294128	3.17732250042333	1.00431209321359	1.02534814586622	-0.9589639362265	-0.662238820311576	-0.255745474434861	-0.346007851994089	-0.759780864248552	-1.26174581626005	-0.971816602301451	-0.451607278711211	0.844589720535262	-0.638172702928696	-0.234411539574691	-1.0914989346224	0.76990745871715	-1.1112890346688	-0.287693124499657	-0.584564979338834	-1.01846014773337	-0.65168167042786	-0.76830213104003	-1.05650929365836	-0.884677869080469	-0.269700338390282	-0.716021683879458	-0.784463048102989	0.00420049686278905	-0.190272021807841	-0.361538501379565	-0.879190546357478	-1.17505297981488	-0.754138755690663	-0.797703625392414	-0.896475435604565	-1.08827541354199	-0.635274137378934	-0.850261692967392	-0.569476912435404	-0.522179744367771	-1.05516773014405	-0.637143495963314	-1.03552625612503	-0.437002823723924	-0.971512329651093	0.408197861026431	-0.892299161038871	-0.669662562003711
Nervonic acid	-0.531842100512493	0.133765649246327	-0.521788273585833	-0.293133465879642	-0.521821239803648	-0.366193391216686	-0.378482908158653	-0.28876735504397	-0.536852530870011	-0.11023965219513	-0.452793306275909	-0.539357746046603	0.249356672838062	-0.38122306932489	2.63555897089402	1.87833079564213	-0.540610353635518	1.14616354026632	-0.507653814754944	-0.541236657430131	-0.541549809327127	1.91144539361282	1.71188804043838	2.30837953853357	1.45685196794456	-0.541706385275781	-0.541784673250107	-0.167310857415347	1.55746233336443	1.58337810067054	-0.54182381723727	-0.541843389230852	0.889177697603621	0.25412422693545	1.97598946678805	1.32654875335114	0.918586472191292	-0.541853175227798	3.40221392464644	-0.541858068226116	-0.54186051472512	-0.418554644203677	-0.541861737974777	-0.541862349599605	5.01771283040668	-0.531495245404143	-0.237573266027826	-0.511518484490408	-0.286918229697335	-0.517432979562246	-0.373925411995395	-0.40956607695765	-0.346732065300554	-0.532065326663977	-0.349971412882957	-0.516092857310339	-0.529292943857604	-0.0606485072831121	-0.518221840288288	-0.332049140160682	-0.296521393627008	-0.516551196371871	-0.295164412033181	-0.377681126158595	-0.534056298225433	-0.525175733865831	-0.298091665613442	-0.249622996023569	-0.323061538517701	-0.295532573153255	-0.536695766623503	-0.526658964548609	-0.332599225450078	-0.36971331914724	-0.29822967703303	-0.52711142244018	-0.538911790896133	-0.408095784838882	-0.344929683224679	-0.24863652803513	-0.310518574543211	-0.328640510746798	-0.536516646184534	-0.140577271801338	-0.527321262530276	-0.473077262639439	-0.509834221851227	-0.526349373863545	-0.5263646755462	-0.0653244055297627
Isobutyric acid	1.45105390479913	-0.178108938687645	0.149590383166244	1.72992034649159	2.37515212733992	0.784577510260656	0.831007627531959	0.636426274480509	1.47202374492776	0.241950685860513	-0.901904682523059	-0.0539420693201065	1.04716516611661	1.13156109003812	-0.709710328623357	-0.871393399742338	-0.315352325937243	-0.788611665260254	-0.484752946782502	-0.627171643288064	-0.968737997994052	-0.650742050972332	-0.435292197741204	-0.622037218097735	-0.461608772641703	-0.462154963756644	-0.833518304777408	-1.06837578315672	-1.30562385405919	0.197302274401812	-0.536451220817984	-1.10812480175189	-1.04949054381814	-0.104666911814923	-0.560077706168071	0.763901002322484	-0.242195649958861	-1.08750997578952	0.160660490377184	0.372799524598289	0.681004587360144	-0.654463320069697	-0.45303386862175	-1.2540511003622	-1.11759581501384	1.83533937719154	-0.712838240642224	-0.0344817886125491	1.75019865816254	3.44749465022392	-0.217518162501477	-0.857892798189643	-0.540555633081299	0.743488495032133	-0.38931563809798	-0.570957256860757	0.410505812994923	1.07675417141376	0.0987072415058152	-0.461539709443819	-0.518785321160054	0.60593327443996	-0.933977713843809	0.297348704160977	-0.83070517562031	-0.960376996462048	0.0740867766492591	-0.841580224600146	0.287726913214914	-0.0791746017187228	-0.185984562861106	-0.0684814778342406	-0.904505926628852	-1.11426500468512	0.119163653109424	0.291203695286855	-0.633519109656702	-0.876772530210378	0.295731596016326	0.301047837734668	2.95722803333884	-0.256481213661264	-0.925320170758995	2.208916866343	1.21941641088785	2.38614799205219	0.289015850228795	-0.946871292723313	-0.959235191983816	0.00628304932642077
Butyric acid	-0.447855666005997	0.0207877659229516	-0.452041082451014	-0.454133790675225	0.0401300187323753	0.600551975683891	-0.455180144787046	-0.455703321843099	-0.455964910370983	-0.456095704634926	-0.456161101766755	-0.41345659237309	2.75726333216361	0.578666331158114	-0.456193800332953	-0.456210149615769	-0.456218324257318	-0.456222411578093	1.67373968689522	-0.456224455238481	-0.456225477068674	-0.456225987983771	-0.168355371771827	-0.45622624344132	-0.18639641968396	1.53122177485038	-0.439484833110289	-0.0651277506929154	0.134340358855705	-0.456226371170094	3.71281888670066	0.205781491398794	-0.456226435034623	-0.456226466966604	2.55325620834334	0.121670913840331	-0.45622648292692	-0.456226490927079	-0.456226494898789	-0.456226496904502	6.2648312704693	-0.00255469586276747	-0.29431769495235	-0.301488634412426	0.918875411696227	-0.396990388572211	-0.244178781492383	-0.416131349020873	-0.306672759009613	-0.201225071151253	0.00187341975566811	-0.259556548672264	-0.363550680810541	-0.39201044927259	-0.433446199609299	-0.415116733438338	-0.44371620970649	0.546118559723348	0.134782113999434	-0.396330492109462	-0.422900737226729	-0.347353492670938	-0.425270815775492	0.22078960917698	-0.419561621559613	-0.257862219950294	-0.427371387078761	-0.448562386203013	-0.431034505968572	-0.399922270858236	0.0277461166847656	-0.393026055683286	-0.446857158283334	-0.336534559701863	-0.446408309796094	0.214969441270944	-0.31337080707727	-0.438549002502959	-0.407212838563084	0.219822553686579	-0.275155272148975	-0.267573920663209	-0.155257002789173	-0.397130044476575	-0.352735172476759	2.06196444619022	-0.00872278527860457	-0.163776996435898	-0.383374268328766	0.440097410903634
Indoleacetic acid	-0.487511397875611	1.95375726469301	3.41041870363533	0.781440195582317	0.530450579787202	-1.38322736003468	-1.38255716571181	0.723202776817904	2.21052048163756	-0.872415819507534	-0.861509400194535	-1.38356245719612	2.90804848429236	1.03399196311741	-0.132025168166267	-1.12085285673887	-0.553353165538915	1.03212641244987	0.104394235686875	-1.38373000577684	-0.181178757630342	-0.410257043763329	0.684669648777068	-0.460771717083089	-0.291534434161146	-0.948511190254658	0.0263551867656383	-0.932010542530171	-0.999055693803915	-0.35521241881912	-0.545888658100658	-0.775923412572901	0.0414654308493607	-0.246889632103342	-0.594038253039751	0.264783667216535	0.476944854064723	-1.38381378006763	-0.717870400859858	-0.628360622476622	1.42449921242639	-1.14940168795305	1.18927609205024	-1.37048601111228	-0.0339980991933159	0.0288049632468889	0.300528519742621	0.110558795946546	-0.0695456872145391	0.0239535861345356	-0.637528235486803	-0.890078406158028	-0.0442442454141263	0.225366989483819	-0.610137683812962	-0.207612636995468	-0.464248177738661	0.95186655187789	-0.241038394970326	-0.100046690672232	-0.451249271859549	-0.502084278779645	1.22328834901332	-0.335744709232422	-0.910412408926066	0.0793382099387292	-0.595978161424297	-0.0138825149064486	-0.542311250095904	-0.186628688759884	-0.252389225022235	0.00287678839765194	-0.539061523626127	-0.773900685210654	-0.0881155527561265	-0.201972040424007	-0.641451119495668	-0.618447698642822	-0.389109860072172	0.451269403450048	-0.0945453687866966	1.04253869136051	0.315644734489764	2.00256368425171	0.724400484609285	2.5070464239542	0.145229653799439	3.15384228712845	0.0961889826954533	-0.193940620620439
Succinic acid	0.311944094147726	1.97689248653381	-1.03404976842891	-1.13010111125868	-0.152679052052854	-0.792835515851005	-0.341910628403365	2.03356074137374	2.85921823675503	-0.21625823347957	0.428102158891679	-0.672341235680888	0.474346711233533	0.281700496983106	0.299570469525645	-0.464678105997775	-0.793923894786295	1.86990481767779	-0.169667697298904	-0.914075799808679	0.800943527444221	-0.157306813716349	0.622742266010972	-0.734583352220797	0.968371235226376	0.8532153615757	-0.440990738693085	-0.179785156803043	-0.264358967489854	0.293842065906944	-0.850828868803236	-0.449812122749894	-0.700785888871273	1.43250904031246	2.63633008826102	-0.175542193304276	0.353738902408945	1.47131069578062	-0.20520922774691	-0.496546366994886	0.778684211835476	-0.298978508090619	-1.11244317534782	0.565005525440131	0.0432311769929903	-0.871775756105539	1.66845996865987	-0.873407212485175	-1.1128064296605	-0.0445991400758429	-0.879748814749276	-0.319316151980759	1.18747408850096	3.12599947739074	-0.586247648322113	0.0982603451886046	-1.04676314875716	-0.20202057624441	-1.11264544157635	-0.653351458845801	-0.245450842885649	-1.10253306725749	1.89568716026778	-0.758073368099005	-0.801913572693426	-0.200661306348039	-1.05154797977079	1.19715494820539	-0.998586224244992	-0.0382874121521951	0.632116699022032	-0.604533901341483	-0.447650198006676	-1.02276596843257	0.365865667886114	-0.966821784470404	-1.16213848498871	-0.927446094353431	0.775769506720958	2.26036165003072	-0.777850005560618	-0.190328290402785	0.38679027798257	-0.413048715701654	-0.575572855896746	-0.302704466789684	-0.786598214994926	-0.558414555723692	0.19740936121485	-0.761211948591634
Glutathione	-1.04785663504252	0.0245409217040668	-1.07414845031781	-0.382487733106544	-1.0872943579591	-1.09386731178048	-0.0558306024316494	-1.09715378869008	-0.994840978761218	-0.315954800857128	-0.161405162205356	0.815094623075921	-1.09879702714524	-0.231143317010684	0.213023913824887	-0.0181303289692964	0.252773704361928	0.176033415107146	0.874939623626119	0.0936253778667769	0.293505036165865	-0.151226486539872	-0.277261113287539	-1.09961864637318	-1.10002945598679	1.02595851295231	0.891654150932207	-1.10023486079323	-0.545703125262013	0.788763296899283	-0.980876973326846	1.19830768820045	-0.346532529030022	-0.732754964564843	-0.872931202534816	-1.10033756319681	-0.713080668092079	1.15742675992435	0.36929776630227	-1.10038891439897	0.25295344430717	1.28226613574136	-0.633923360429691	-1.10041458999969	-0.860195004312768	-0.727949506359249	1.45186777867821	-0.774088956933287	-0.709938656968067	-0.966047060325395	-0.91074038360644	1.38455886857144	-0.959870750871493	-1.05845473117182	1.1556743921563	1.82265096266793	2.29681996388877	-1.04808436772401	1.37502740162796	0.895665898720327	0.678639745140023	1.19925515811532	1.27672731460584	1.94863670516343	0.893232770013402	0.992320974393207	0.801357033905957	0.557918710181911	-1.03676640690998	-1.04379475408736	2.24746448104878	2.03719327973552	-0.998203664514828	-0.268070885580037	1.18285103926643	-1.0751456005457	1.8528437382313	0.548227906035948	-0.922984087373857	-0.975280492580878	-0.811061395523938	-0.99456714081655	0.511572623124033	0.294296882522546	-0.960368842699857	0.84945938443907	1.06216518851063	0.294282299211758	-0.617244300876075	-1.08779293307305
Pimelic acid	1.02538115086235	0.266079070206067	-0.103256434509523	0.872285417123146	-0.952951246854436	2.85739197283614	1.21052540547262	0.753566246803566	-0.118470455895581	0.543273433035413	-0.964710526358221	-0.202524183743348	1.07435076345857	0.702186700621623	-0.594630736819386	-0.447741141750771	0.032352177172241	-0.897188953715212	-0.470960614736858	-0.277515058052	-1.04722086029404	-0.00972587189706902	-0.779445852667465	0.6797261058568	0.255400007058436	-0.64498098021337	-1.07554078690084	-0.972817635423819	-0.85326531663391	-0.394244804107537	0.396230656236818	-0.111895568192751	-1.01510626054139	-1.07014644097462	-0.940813406060161	0.128366338415678	0.708013530737565	-0.567901119082817	-0.907833222097209	-0.830117513984676	-1.0782379598647	-0.924166122595149	-0.757425522519473	-0.861493356167568	-0.424493379383318	0.877440453199457	0.0735899949420651	-0.202136456220355	0.427438257030942	-0.973237810673594	1.78410864713449	0.547718208187452	0.436862191757638	-0.164429543235424	0.182192461440619	-0.888657065130401	-0.510530064706148	0.789246578356073	0.34029479748882	-0.0789362029735822	0.148977747568098	0.626227407443698	-0.772884213094195	0.070394051241248	0.275012631014162	-0.969982269538958	0.700721190026953	-0.449162742634505	2.11651652746236	1.49455545846925	-0.523097794293576	-0.81849158743623	-1.01595095675906	-0.903336799101615	0.455389721803441	1.5594427877235	0.493275429687587	-1.03805436732482	-0.988926985777908	-0.813958414081438	1.05382820214401	5.19897526410541	0.922088385119813	-0.2775280245844	0.735886831144863	-0.866940702046079	-0.215201761384495	-0.0360087295040247	-0.700987478210253	0.689949100359299
Propionic acid	-0.0475442088715436	0.856568324744082	-1.16679294384833	-0.439851524940826	0.50482750379679	-0.418813751677318	0.641923355320777	0.629674913691168	2.06693128281865	0.45106537845349	0.244020500691382	2.15501268156964	2.21969710798589	0.358198615774906	-1.30775615148339	0.0265451294096428	0.90864022979708	0.838825854353298	-0.845969800501671	-0.309675981401984	0.0125163967785805	2.95577794397902	1.16127120572819	-0.142208825082499	-1.46495480137957	-0.743101862503438	-0.189479354319383	0.146135370283344	-0.907876563789192	0.833156558123497	1.10439537155453	0.814525623964488	-0.933778758705544	-0.194027740407287	1.86642808348753	1.42891546119962	-0.201527414687077	-1.11572184052316	1.64893561144271	-0.111559564389494	1.07380227765649	0.645264461784324	-0.579742377972193	-0.47875709073424	0.91902935553156	-1.07204160043246	-0.429177840382986	-1.39789849676278	-0.886603763094159	-0.78148381816628	-1.02831409255715	-0.804739860136415	-0.933730737684282	0.561845777406529	-0.575855607889162	-0.93760454862482	-0.165262390947243	0.34869833290706	-0.793197484567656	-1.3301814703882	-0.453791033631947	-0.516206824870345	0.142973497059309	-0.969675487042958	-0.856513651058836	-0.656555610709346	1.76493638915598	-0.132752244820841	-0.7957097520023	-1.4103588161383	-0.919162221828729	-0.80007108337737	-0.737756310290971	-0.936497745549566	0.0121115952623669	0.151994821565981	-0.710586928635771	-1.06630554922459	-0.872254851033689	0.460757757924897	0.45643595576675	-0.329392766776603	-0.676309782745338	2.0114329033008	0.609093760326571	1.86320292208722	1.53781914116052	-0.552299187472631	-0.815710696906909	0.509755359124114
Linoleic acid	-0.184133003133396	-0.252274468434275	0.0385406076320817	-0.240751186136422	-0.112590872334008	-0.522110296579929	-1.13872594495639	0.245727862059508	0.360137177950147	0.154113147085677	-0.000254733727614986	0.732038818936004	0.812618934337931	-0.50475446545251	0.891646817153821	0.753292799624575	0.539000777450696	3.8397756797586	-0.246174754474262	-1.11943087528954	-0.445790908536976	-0.128051473524592	1.07922424871631	1.11146978847324	0.0579837098626469	1.17585719390225	1.7924703241888	1.34260297956208	1.37178497285979	0.696984267363845	-1.02536439703839	0.0928920737784434	0.314636925056694	-0.675291208800296	1.3915490056525	3.01751993302623	0.952483281361835	-0.141150936931825	4.28494413732157	1.21784642667369	1.38870099424895	-0.379249214273786	-1.14837347978982	-0.226310982629189	1.68693695095957	-0.662303239414037	-0.590083536967144	-0.391036905855811	-0.253023137937734	-0.66864316084353	-0.812314581072712	-0.887502586227501	-0.263295606836605	-0.0798545876194706	-0.649829588617677	-0.381751999743182	0.23742302852245	-0.157675805999778	-0.567122588652594	-0.740667466551421	-0.621031352642237	-0.765736540235046	0.249127831048168	-0.691803392206968	-0.910850225725939	-0.780390213671066	-0.736886918128722	-0.617639870320027	-0.731050709975377	-0.490811862148042	-0.644543513971212	-0.467655732995999	-0.608356691502193	-0.594519581976603	-0.491737891349747	-0.715368019091654	-0.790627705698238	-0.63165488806605	-0.513195688439854	-0.468030549265999	0.0386521120758868	-0.626041873516052	-0.847492852316285	0.798546928106383	-0.56282792769772	-0.31080690370335	-0.674223130716256	-0.989513784837014	-0.634829168837642	-0.153014751332669
Glycolic acid	-0.838547709961113	0.818472114150859	-0.542415800254561	-0.746755814360115	-0.501474565880112	-0.7973942878713	-0.647730057613405	0.976233924351697	1.83160843008089	-0.637083787510571	-0.244157758882375	-0.617932728445746	-0.646235561464342	5.35689446859981	-0.610015984369527	0.0594664409409421	-0.844984040245819	1.9848882577172	-0.848202205392509	-0.745252932312276	-0.651502276077007	-0.849811287964615	1.71126706409924	-0.850615829250978	-0.407602912822087	0.580998876554596	-0.825675049385504	0.620973895606093	-0.85101809989385	-0.338960462096224	-0.812533393217242	-0.851219235214976	-0.851319802876158	0.579242773973737	1.92901091391646	-0.087702106883506	-0.389572499137734	0.0144976468047472	0.0811046301076242	-0.0129263254696636	0.341149231323543	-0.669961730491173	-0.124320714750777	-0.159508634327368	0.18485972288383	-0.437814346026729	0.741499259107844	-0.243202016514155	-0.432033893119004	-0.167999899035395	-0.525252130604032	-0.312173840684206	0.982490163494399	1.58713228414797	-0.284553622193074	0.0735870447623704	-0.581234804768426	-0.218010937576352	4.28135189602984	-0.388950400867677	0.0649613498808348	-0.554885386166047	1.04328613324586	-0.442931283934034	-0.520315129005837	-0.443662275019388	-0.560924497502626	0.878250829245181	-0.584721070106793	-0.286341738939535	0.247203059877138	-0.389883820269797	0.263149912948297	-0.582820493198121	-0.207540895836267	-0.43932131233668	-0.607505501189096	-0.690242450527436	0.355727127254664	1.09680592981446	-0.107316389632038	-0.145117886855908	-0.19031740412648	-0.0207050155749999	-0.0373839772151718	0.207564844352623	-0.362998534419861	-0.0316915784133855	-0.166891896699221	0.0734997975076414
Tartaric acid	0.298627975101928	-0.764783812168459	2.49458748215151	-0.282740800181792	-0.782240527436699	-0.790968885067895	-0.795333063882909	0.447640202166192	2.51812162009154	1.3310558463925	0.206496209621824	-0.0812086886849491	-0.3659609230414	-0.729870381614433	2.10282371143659	-0.716608412627437	-0.556672310041923	-0.515704868869092	2.95242680972345	0.568873133836047	-0.653036662600605	-0.797515153291293	-0.7986061979949	0.236869029549797	-0.133026044096795	-0.0164746499028556	1.03968870417645	-0.162361040750613	-0.172876207943001	0.717096370808123	-0.436086996240577	-0.283841878503009	-0.799151720346996	2.55546596512694	0.105527811718826	3.92830215460863	1.15142176445882	-0.799424481523044	2.77993091792309	0.800663752843071	0.216303577660444	-0.318487460149433	-0.79956086211136	-0.57422284839787	1.44810608943637	-0.678696095710667	-0.784557929426907	0.264870496634434	-0.674849701597266	-0.725853512495918	-0.64684998537554	-0.630514537400142	-0.300682336361049	0.813102830004893	0.0335005116374325	-0.0480829138830671	-0.56948039394561	-0.480770976085081	-0.746148713779616	0.0977204386112147	-0.774680045450334	-0.780258098650874	-0.669220832254308	0.227989675580632	-0.323365898151332	-0.760025440378719	-0.757066375015342	-0.731337751228851	-0.779175323084077	-0.235860432904817	-0.435075501759704	-0.212621801898052	-0.577911971231276	-0.775715913774555	-0.59927822123019	-0.739569972663395	-0.772193961476882	-0.670796133891537	0.259327623965244	-0.600513445393837	0.618496397604369	0.746199168618009	-0.621346378596717	1.31783623373788	0.137958945009024	-0.216064655298419	-0.236013594314983	-0.42474687529962	-0.776036293797692	0.465095441040439
Oxoglutaric acid	-0.961376712018181	-0.421136900326537	-0.242755495249046	-0.0585230821297713	-0.0754065216909702	0.214920024669838	-0.254298096916158	-0.921910907703448	-0.665854067302347	-0.264489999207086	-0.981109614183094	-0.762276545744912	-0.581078983511028	-0.684360580949545	0.421773082835775	1.9747381847924	0.372488558450447	0.0277740398147123	0.36780878317028	0.651488343443207	0.822696930420436	1.83375144873468	0.320372154289412	2.99573487624069	3.02499988322799	0.334904520943299	-0.990976065265551	3.02024819333237	-0.99590929080678	0.789693046447303	3.34794317825942	0.690355127818694	0.0244598875123016	1.22797915751258	-0.998375903577394	-0.793821368532577	2.08217324595221	-0.999609209962324	-0.780270322606528	-1.00022586315517	-1.00053418975159	-1.00068835305017	0.533072784577455	-1.00076543469909	-1.00080397552317	-0.927721216247972	0.245090902076403	-0.13302419053848	0.510388464903704	0.731267199118089	0.849722890757373	0.301896987163997	-0.990779952115997	-0.131773824756502	-0.0481659058080154	-0.992596684026715	-0.98438416736405	0.328195384754478	-0.229439720085195	0.0654038998986796	0.343690458728518	0.083865301760508	-0.626448084216369	0.00655198675586607	-0.0349293048720133	-0.267150171904444	0.407795141814277	-0.436529472030189	0.967271245564372	1.1944194939467	-0.495624877885858	-0.749833260217256	0.846144130526633	-0.646190288194566	0.122317335778119	0.740431474482402	0.0991839261723286	0.0803198569544336	0.284871037615306	-0.448653082990274	-0.968935570894207	0.280392004693253	-0.964214099846489	-0.640005467793849	-0.960136582244393	-0.972561087413656	-0.990960444457415	-0.7147145087392	-0.90149058664484	-0.875774540760532
Norvaline	1.03279341321875	0.576890435875466	1.97570033818021	1.03064485898827	-0.909863029462767	-0.628313217475539	-0.970687986418576	1.92463238058859	-0.223191192066588	-0.963675913478649	-1.16667723654463	-1.19225481536735	0.112081965717553	0.343655667007367	-0.21948924787771	-0.452302434685806	-0.754717774795615	-1.20504360477871	-0.750026647663409	-1.21143799948439	-1.21463519683723	-0.196972789436953	-0.623712515173271	-0.61275749337576	0.198637291670934	0.758329685941108	-0.82920342829536	-1.21623379551365	-1.21703309485233	-0.0268224439032041	0.289758109811815	-0.970506767721092	-0.553478620035034	1.42860960389664	0.886769579516207	2.00293894564812	-0.049821826759348	-0.980152829006875	-0.554277044358116	-0.650089177908027	-0.225300740863512	-1.10555803605935	-1.21743274452073	-1.01747111281409	-0.66246414714994	0.36488911660413	0.929999579519781	2.28038124515708	2.05628571703486	-0.0926704816397638	0.0472955377488659	-0.12658460454218	2.98433350249658	1.19737777254388	0.486680165415718	-0.790626872062029	-0.617121471394592	0.261647782529855	-0.0881735817806613	0.470753642889218	-0.0565079088077968	-0.241817672826735	-0.112719161744105	0.279073270423383	-0.697878304764096	-0.530930883590237	-0.601194949713646	0.115873266237211	-0.434622270257346	0.770921733850955	1.7731683735644	-0.407828239706697	-0.352553840970336	-0.830536861599833	-0.262053724071707	0.243285439872678	-0.546482663553623	-0.706497363516347	1.35926618062464	1.50822600161049	3.26482765469573	1.06315122274	-0.664611548137895	0.357453207073793	0.413579773019706	0.370923583276614	-0.774806704801972	-0.826630233539954	-0.580234611527086	-0.246147185758349