annotate test-data/variableMetadata.tabular @ 0:0b8ddf650752 draft

planemo upload for repository https://github.com/HegemanLab/VKMZ commit 7c299d22bdce251ce599cd34df76919d297a7007-dirty

variableMetadata	mz	mzmin	mzmax	rt	rtmin	rtmax	npeaks	control	treatment	isotopes	adduct	pcgroup	PCA_XLOAD-p1	PCA_XLOAD-p2
PM58.065T66	58.0649616577015	58.0648970777637	58.0653140830574	66.4569085127684	65.6302531891097	69.8827733003833	13	3	10		[M-H-C6H8O6]- 235.105	7	0.0444580102916217	-0.0343976736297
PM59.0362T637	59.0361991847715	59.0360998567896	59.0365812350582	637.341103007695	628.128559167436	645.065692191741	29	3	26			1	0.0325577281914756	0.0720926219693828
PM59.0606T284	59.0605836804757	59.0605613369902	59.060597610396	283.728855016502	268.145711881462	285.739062189393	7	3	4			25	-0.0273714520866311	-0.00792884533525291
PM59.0606T68	59.0605872209504	59.0605776285004	59.0726336046207	68.4751863106318	64.9737065076563	70.8135094183931	6	3	3			21	-0.0330578833811803	-0.0171094411006246
PM60.0558T363	60.0558291245611	60.0557983617521	60.0558620903094	362.99493553802	350.087756916266	370.612380934883	42	6	36			50	0.00926897282727714	0.0248533883518272
PM60.0558T745	60.0558083902276	60.044573312429	60.0558521389992	744.988599401189	696.665913738628	749.002171164123	22	3	16		[M-H-CH3]- 76.0822	95	0.05984942299677	0.00273082046493986
PM60.081T66	60.080983523099	60.0809475241736	60.0810151676251	66.0563353227881	64.4593925428515	159.233710935131	41	6	32		[M-H-C4H8]- 117.149	7	0.0522933576900129	-0.0294973234327019
PM61.0398T165	61.0398212739586	61.0397978604016	61.0398488364881	165.421497310763	163.29628760783	186.970106464683	14	6	8			48	0.0213225436654477	-0.0279948758517441
PM62.0602T352	62.0601947061464	62.0601500557991	62.0602302402622	351.869377161561	345.840496889973	361.660675587353	42	6	36			163	0.0472174273434776	-0.040704317979659
PM64.0159T321	64.0158714803237	64.0158365383995	64.0294789851016	321.149360432711	300.94439521352	347.757001353444	40	6	34	[1][M]-		8	-0.0123281791033326	-0.00692100123800598
PM64.0159T71	64.0158774629102	64.0020784991177	64.0295742358744	71.4949153081796	67.6380432508812	73.9728449717285	30	3	27	[2][M]-		166	0.0320117461832363	0.0232582638833211
PM65.0192T322	65.0191993163889	65.019171911959	65.0192242518461	322.011837879375	303.73883871476	347.757001353444	39	6	33	[1][M+1]-		8	-0.0162508934874903	-0.00822179212683447
PM65.0192T71	65.0192097770756	65.0191745064462	65.0192347559098	71.1825750294259	67.6380432508812	73.9728449717285	22	3	19	[2][M+1]-		166	0.0209375803320092	0.0257653092537973
PM65.0605T854	65.0605021066923	65.0604584712513	65.0605302448169	853.622756000014	851.239954528327	855.30642070025	42	6	36			4	0.0543609882416988	-0.00695481256186887
PM66.0683T748	66.068312412181	66.0681984785475	66.068335613669	747.877219728808	724.237829196182	752.818350290053	43	6	36			6	0.0584867620237074	-0.0123740335155075
PM69.0336T402	69.0335874731286	69.0335355795789	69.0338091318184	401.949760673994	391.643883587359	419.787616067709	42	6	36		[M-H-H20]- 88.0523	12	0.000316381716064739	0.0545658381605183
PM69.0448T284	69.0448255436776	69.0447869818636	69.0448505657494	283.728855016502	248.530240117923	333.064086502469	33	3	30			25	-0.030898891317677	0.0417375048496894
PM70.0288T674	70.0288111270199	70.0287774969301	70.0288522591239	673.855295476991	666.262372849839	677.080183372129	15	3	12		[M+Cl]- 35.0594 [M-H]- 71.0361	43	0.0565138005713393	0.0083799625799253
PM70.0652T454	70.0652118282021	70.065171790553	70.0652400650796	454.323944169882	452.153480408326	458.734298585503	42	6	36	[3][M]-	[M+Cl]- 35.0958 [M-H]- 71.0725	124	0.0142074180271394	0.0323456116545667
PM70.0652T854	70.0652030887819	70.0651541621238	70.0652306557687	853.864129819307	851.383117313941	855.30642070025	40	6	34			4	0.0547017018575661	-0.00169650755033441
PM71.0685T457	71.0685458735414	71.0684911836948	71.0686742429538	456.571742494902	452.898241495009	458.734298585503	19	0	19	[3][M+1]-		124	0.0113122923537708	0.0336450105757788
PM72.0808T748	72.0808318911997	72.0557091944054	72.0808828494203	747.783822162075	724.525338792825	751.830689808761	37	6	31		[M-H-COCH2]- 115.108	6	0.0578699720547366	-0.0156924609262165
PM72.0808T421	72.0808452166067	72.0808127132098	72.0808822199762	420.846942569535	349.128537804296	437.4886769661	44	6	36	[4][M]-		24	-0.018979783688937	0.0604657572722217
PM73.0842T421	73.084172515719	73.0839048768387	73.0842274988564	420.920939266513	418.452954390657	437.4886769661	42	6	36	[4][M+1]-		24	-0.0194759830382718	0.0587206652904023
PM73.0649T322	73.0648648596205	73.0648288502539	73.0649566929148	322.26478417714	303.958424541074	335.830404532344	21	2	19			140	0.00470171886534609	0.0739438125044838
PM73.063T852	73.0629741614692	73.0628746810074	73.0631217751704	852.231414887092	851.692004352229	854.374444618064	16	3	13		[M-H-C4H8]- 130.123	4	0.0573074811427187	-0.00195528483483961
PM73.0842T746	73.0841594839699	73.0837943150657	73.0842116945268	745.585636081108	744.562467257894	749.002171164123	14	3	11		[M+Cl]- 38.1181	95	0.0599301504359552	-0.00353686029523022
PM74.0237T733	74.0236754562122	74.0235529709959	74.023729393091	733.012181322528	662.911365946474	737.203145489946	55	6	32			157	0.0577978362480689	-0.00521355962949166
PM74.0601T598	74.0601190348419	74.0600695648705	74.0601915787361	597.857293445208	594.69373885293	601.156242003001	42	6	36	[5][M]-	[M+Cl]- 39.0907	16	0.0279980108517734	0.085321008192344
PM74.0965T66	74.0964655253602	74.0964165711514	74.0965059990541	65.7870543990021	64.1286950696732	158.320407179716	24	3	17	[6][M]-	[M+Cl]- 39.1282	7	0.0411400185438336	-0.00798726998101483
PM75.0635T596	75.0634756168358	75.0633774605355	75.0635448241631	596.394195961009	594.094656679159	601.156242003001	25	3	22	[5][M+1]-		161	0.0239248771412616	0.0886426925468786
PM75.0735T745	75.073498441381	75.0732216301712	75.0735250970577	745.426854443224	744.888788182172	748.718259910391	10	3	7		[M-2H+K]- 38.1181 [M-H]- 76.0822	95	0.0585980946289094	-0.0108758894396442
PM75.0998T65	75.0998395207858	75.09977437091	75.0998701600803	64.5126177550257	63.1719551083711	66.8005886313842	10	3	7	[6][M+1]-		7	0.0369773408858971	-0.015305608464864
PM76.0393T595	76.0393057276606	76.0392545828932	76.0393673110884	594.932599331212	590.062324374407	599.812477629257	42	6	36		[M-2H+K]- 39.0907	16	0.000996989757739439	-0.0564832091849796
PM76.0757T288	76.0757435090328	76.0756900150818	76.0757737336612	288.449006076519	269.578459792829	339.469835587258	36	6	30			220	0.00888767776990459	0.0586455712814875
PM77.0427T595	77.0426575258346	77.0426196738897	77.0426788835354	594.805498202783	591.264469714518	599.812477629257	22	3	19	[5][M+2]-		16	8.51556090682724e-05	-0.0555476080155772
PM81.0447T146	81.0447480081308	81.0446393984109	81.0447937637516	145.917648149097	55.775194273334	168.460630117066	47	6	36		[M-H+Cl]2- 128.128 [M-2H]2- 164.105	54	-0.024779532091252	-0.0199304756595952
PM80.948T823	80.9479605918487	80.9479004663598	80.9479832826888	822.791911551393	818.926879492896	824.448481224112	33	3	30			87	-0.0108796241229746	-0.0386512345402274
PM82.945T822	82.9449942036037	82.9449207761327	82.9450272268373	822.48043342199	818.620691672903	824.077721908038	24	3	21			87	-0.0126600925480095	-0.0462070997847266
PM84.0444T639	84.0443611190827	84.0442996499357	84.0443992603774	639.116785306695	625.929620404143	679.293855549138	68	6	36	[7][M]-	[M+Cl]- 49.0749 [M-H]- 85.0516 [M-H-HCOOH]- 131.057	1	0.0341529876473233	0.0693515979497891
PM84.0808T67	84.0807887691669	84.0807421117553	84.0808226409559	67.3177191637889	60.8964474597148	69.2056872885508	42	6	36			136	0.0380083755350068	0.012773369639047
PM85.0477T638	85.0477026197278	85.0476179723986	85.0481673994574	637.772970093307	627.527436315464	675.572200873591	56	6	36	[7][M+1]-		1	0.0435189796846368	0.0396933247693823
PM85.0284T733	85.0284018689302	85.0283468576954	85.0284360345747	732.772262546489	730.825685878214	734.333012153648	42	6	36		[M-H-COCH2]- 128.047	15	-0.00687684556667316	0.0158035664442978
PM85.0284T478	85.0283802413178	85.028328847375	85.0284246736807	478.075822340558	472.462285441707	480.775653029174	40	5	35		[M-H-CH2]- 100.051	60	0.0357562231629051	0.070194577587374
PM85.0765T65	85.0765140767923	85.076005050881	85.0836966708985	65.167204488473	63.1483766498492	68.2717680025791	42	6	36		[M-H]- 86.0856	7	0.0376971512879277	-0.0463492873959905
PM85.076T162	85.076036415998	85.0759828160863	85.0760944178653	161.51086826424	157.144914959411	179.180991502327	42	6	36			214	0.0446118525816365	-0.0403968118734585
PM85.5737T854	85.5736625603272	85.573612239717	85.5736926254713	853.712757427909	851.383117313941	855.30642070025	38	6	32			4	0.0518365543288469	-0.00998295338843669
PM86.0964T391	86.0964041619018	86.0600179633678	86.096469765913	390.692221601461	315.258865818635	409.734235277273	51	6	36		[M+Cl]- 51.127 [M-H]- 87.1037	3	-0.0158465830875657	0.0864764441826069
PM86.5815T748	86.5814979548175	86.5814624753721	86.5815214284019	747.830520945442	724.525338792825	751.644789971212	36	6	30			6	0.0586679753906511	-0.0114978618890258
PM87.0553T668	87.0553011222594	87.0552493720793	87.0553357932768	667.64354276644	661.759161252434	675.862266729598	42	6	36			128	0.0569125565738646	0.00920893003687709
PM87.0441T402	87.0440659390699	87.0440160465384	87.0441043004442	401.949760673994	391.643883587359	419.787616067709	42	6	36		[M-H]- 88.0523	12	0.000556469580970351	0.0588771541554471
PM88.0393T735	88.0393183908424	88.0392587518333	88.0393562938871	735.114767453232	683.719545469161	737.734997544602	69	6	33		[M+Cl]- 53.0699 [M-H]- 89.0466	20	0.0586158016218094	-0.0136319884415265
PM88.0631T854	88.0631317590858	88.0630748492037	88.0631719001869	853.780570077324	851.383117313941	855.30642070025	39	6	33			4	0.0502263772246708	-0.00554489174103322
PM88.1121T64	88.112076111701	88.1120199152797	88.1121113429468	63.7290257602653	61.73071353459	156.462433156948	44	6	32		[M-H-C2H4]- 117.149	7	0.0504098213902539	-0.00951503830622342
PM88.0757T283	88.0756595980737	88.0755769561189	88.075726766702	283.060732172368	244.673718452874	331.467850170241	42	6	36	[8][M]-		25	0.027850452429758	-0.039654448653616
PM89.079T286	89.079005635809	89.0709457862893	89.0790874882078	285.95675384203	244.673718452874	339.407193915327	50	6	36	[8][M+1]-		25	0.0282998889977127	-0.0396906432212331
PM89.1074T849	89.1073664417206	89.1072963941765	89.1074080519195	849.409691478311	803.880157186464	852.248737668263	34	6	28			92	0.0540493534902984	-0.0109720428412487
PM89.1154T63	89.115384504517	89.115265386815	89.1154242504809	62.7817489179474	61.0811535305271	64.1848735002255	18	4	14			80	0.0504954534692522	-0.0090131648655689
PM89.0686T556	89.0685604769516	89.0685324356044	89.0686010662081	555.53586868298	547.346765810857	556.810673002566	17	3	14			256	-0.022521708761392	-0.0297673011145862
PM90.0549T524	90.0548818565871	90.0548441147567	90.0550157785058	524.186140677905	520.43482507791	555.859355902918	43	6	36	[9][M]-		13	-0.00834610989137569	0.0295034122691788
PM90.055T426	90.0549741004361	90.0549279656231	90.0550326045684	425.712352778439	422.766992906202	435.792166266563	25	6	19			149	0.0229079248898558	-0.0623059304415763
PM90.0914T322	90.0913785193314	90.0908988586943	90.0914409629033	321.960559386979	302.837749584752	336.62011595909	42	6	36			8	0.00268310913096459	0.0802675130437289
PM90.9767T322	90.976665081516	90.9766152458515	90.9767061389818	321.510089880254	295.854638691344	347.757001353444	42	6	36		[M+Cl]- 56.0073 [M-H]- 91.9839	8	0.0171724173749168	-0.0383175490793965
PM91.0582T524	91.058235258037	91.0581999452958	91.058281358797	524.088475606061	520.43482507791	527.296551950635	42	6	36	[9][M+1]-		13	-0.00845905634838329	0.0311508778706506
PM94.0451T301	94.0450715102327	94.0450101091887	94.0451219149251	300.782931584811	276.105327181038	334.676832816695	42	6	36			29	-0.0490158809251663	-0.0220524926348738
PM95.0438T311	95.0438465377156	95.0438008404604	95.0438860680548	311.164730303844	293.076559670551	334.676832816695	27	3	24			57	-0.0489781347527912	-0.0211129285029991
PM95.0604T147	95.0603798816658	95.0603211279476	95.0604233567409	147.388384852003	137.565531807235	168.460630117066	35	4	31			54	-0.0255371530237853	-0.0162052190270129
PM95.0834T690	95.0834080873698	95.0833812604896	95.0834760381674	689.856244108151	686.948076937114	691.853486770586	8	3	5			61	0.0565399857891872	-0.00808741232810443
PM96.0444T235	96.044388921758	96.044345378144	96.0444405133368	234.70251068065	225.010499665674	266.622212186551	21	3	18			112	0.0595195992592515	0.00169434649230495
PM97.0284T478	97.0283966931816	97.0283691938063	97.0284548895472	478.383454093852	473.478845883986	480.952498396084	18	3	15			60	0.0405941788390626	0.0663093924593085
PM97.0284T734	97.0284403629283	97.0283495093529	97.0760902943519	733.995387477452	731.419691812498	745.850571864768	42	6	36			15	0.0220413042438508	0.00583092169847309
PM98.0601T421	98.0601319608394	98.0599799400007	98.0606386943925	420.60419052074	409.225866669286	435.792166266563	22	3	19			24	0.0363859055626901	-0.0375579584751874
PM98.9841T906	98.984144244277	98.9840409906205	98.9842020125982	905.707817706697	903.987753913188	906.628350738598	42	6	36		[M-2H]2- 199.985	14	0.0583986475214948	-0.00383391814369504
PM99.0441T478	99.0441039413391	99.0440445248042	99.0441453898913	478.310454259187	472.462285441707	480.952498396084	21	3	18		[M-H]- 100.051	60	-0.0351312678700649	-0.0180750728056014
PM99.0917T157	99.0916912763149	99.0552613616845	99.0917853346814	156.940040050321	142.01598941774	168.460630117066	41	6	35			84	0.0525828739733422	-0.0253756661553002
PM99.0917T63	99.0917101976864	99.0916449507506	99.0917483488858	63.1729339214043	59.6673267895667	67.3545540933707	38	6	32			259	0.0534150232353322	-0.0370469778883391
PM100.075T449	100.075025687119	100.074896669613	100.112157407518	449.073909892071	361.960339190836	453.30454974441	19	3	12			18	0.0483308291092378	0.0203984852226451
PM101.071T631	101.070962272306	101.05980469312	101.071004629609	630.958473501243	609.562916735008	661.668067027681	30	3	21		[M-H+Cl]2- 168.18 [M-2H]2- 204.157	45	0.0448426748657548	0.0507641435849933
PM100.9884T906	100.988395711789	100.988342365684	101.107428523722	905.573348845855	860.815778418292	906.393271075313	24	3	18			14	0.0582287612434487	-0.00614463407566302
PM101.1074T66	101.107404273206	101.1072557969	101.107423736437	65.5868880793155	64.3584596785607	67.7295182208533	13	3	10		[M-H-CH3]- 117.149	7	0.0455368692242579	-0.0404026079841619
PM102.055T598	102.054983511375	102.054917870469	102.055013940076	597.617158273643	594.05142167802	601.156242003001	42	6	36			16	0.02741226581382	0.0854349226420989
PM102.055T668	102.054964810095	102.054904905337	102.055027889001	667.754522771945	652.751013261636	676.382967852961	39	6	33		[M+Cl]- 67.0856 [M-H]- 103.062	5	0.0589616388834444	-0.0184413086046014
PM102.055T769	102.054994072527	102.033817071403	102.055580268147	769.066973539175	745.359585061276	854.668719270864	41	5	29			40	0.0206765428676144	0.0904443387059849
PM102.1278T64	102.12781742922	102.127742173901	102.127865318343	64.4324194472357	62.1748319442385	66.3736624687025	42	6	36	[10][M]-	[M-H-CH2]- 117.149	7	0.0433753393504781	-0.0012765699772089
PM102.0679T166	102.067925429301	102.067554887485	102.068615888985	166.485074861732	163.29628760783	185.017739217305	7	3	4			48	0.0157918002782578	-0.0179670544485665
PM103.1312T65	103.131157010466	103.057652289143	103.131229041403	64.5614093134123	62.1748319442385	67.9454606159015	41	6	35	[10][M+1]-		7	0.0272920207026003	0.0760104512676791
PM103.0866T328	103.086610159628	103.057479070827	103.086685922687	328.008169006198	230.782997621113	355.967390061177	48	5	30			56	0.00142917645844731	0.105992343455876
PM104.107T66	104.106969370531	104.106858235817	104.107021903524	65.7650889635583	63.2605058555364	67.3545540933707	42	6	36			7	0.0574507189990156	-0.014195253545853
PM104.0706T401	104.07057219124	104.070517389765	104.089992622007	400.850921204904	327.349217105979	419.787616067709	44	6	36	[11][M]-	[M-H+NH3]- 88.0523	12	-0.00160594880984328	0.0622785334693669
PM105.0424T319	105.042370964074	105.042307596108	105.042414281217	318.625922485124	293.539779470224	347.757001353444	41	6	35		[M-H-CH4]- 122.074	8	-0.0272729915525305	-0.00642708368797894
PM105.0739T402	105.073913449601	105.073853333884	105.073971008546	401.710272523915	391.643883587359	419.787616067709	42	6	36	[11][M+1]-		12	-0.00168967090288876	0.0624453681578473
PM105.0423T72	105.042323638724	105.042209504747	105.110229599146	71.5617705503057	66.4569085127684	73.3486273589211	42	6	36			21	0.0254799794180066	0.0255095358131015
PM106.0499T697	106.049889055268	106.049792224198	106.049952496518	696.76641264828	691.770677668553	698.4005593762	42	6	36	[12][M]-		11	0.0568153635033172	-0.0332860717888923
PM106.1107T66	106.110736344385	106.110636138663	106.110988423049	66.4569085127684	64.8183823613382	67.3545540933707	15	3	12		[M-H+NaCOOH]- 39.1282	7	0.0575914891023276	-0.013556836607875
PM107.0532T697	107.053219716159	107.053107562905	107.053281588916	696.764219934938	691.770677668553	698.4005593762	41	6	35	[12][M+1]-		11	0.0568229883449484	-0.0331336546270413
PM106.9506T318	106.950611817569	106.950536279087	106.950653440703	317.510143247929	291.466249999267	346.336684196675	40	6	34			138	-0.00145750339324269	-0.0175770319906533
PM107.0604T149	107.060401447397	107.060373301846	107.0604502632	148.738371207738	146.28404323491	166.183621846597	16	3	13			54	-0.0234906682120903	-0.00416339168896241
PM108.0541T697	108.054058239735	107.966842084605	108.0541663965	696.7299306702	612.083510419585	698.252697412995	33	6	26	[12][M+2]-		11	0.056468438511047	-0.028365658901361
PM107.9668T346	107.966801091969	107.966771391429	107.966823111043	346.263640500102	344.097558202095	349.150550533076	9	3	6			241	0.0523290919094927	-0.0233946073058753
PM109.0285T733	109.02845652658	109.022363145348	109.028501416035	733.208845660075	731.419691812498	745.949114727421	34	4	30		[M-H]- 110.038 [M-H-H20]- 128.047	15	0.0132407604463082	0.0246876006115262
PM110.0201T393	110.020071179974	110.020031466668	110.020093688778	393.08649105174	354.25328027869	394.372540425783	10	3	7			3	-0.0274225517895492	0.0334548171034572
PM110.0713T868	110.07132881711	110.071231922197	110.071379905985	867.935393028983	866.083461083369	869.858483530207	42	6	36		[M+Cl]- 75.1019 [M-H]- 111.079	30	0.0311072382780343	0.0754297763080871
PM111.0554T352	111.055375027649	111.020198849032	111.11713392928	351.739563470375	323.826998296538	393.746322912788	26	3	23			17	0.0177484250071575	0.0238827378869157
PM111.0669T526	111.066882233528	111.066618715782	111.068211461381	525.627131278444	522.445905738419	530.968973938874	15	3	12			155	-0.0483201387058938	-0.0303337781013373
PM112.0506T559	112.050591326424	112.0505313252	112.050638363062	558.976451590402	555.645754228306	561.26016338687	36	5	31			49	0.0267982771662482	0.0812767524842076
PM112.0179T354	112.017942710434	112.017913402035	112.017971952709	354.465605206369	350.262056745755	355.308156550506	4	3	1			73	-0.0246450276513397	0.0749239015856199
PM112.087T854	112.086998375726	112.086911555501	112.08704077073	853.712757427909	851.239954528327	855.30642070025	42	6	36	[13][M]-	[M-H-NH3]- 130.123	4	0.0566881613963482	0.00018503971706567
PM113.0345T346	113.034523864225	113.02118376166	113.107463248569	346.164817874787	183.550178183438	378.698877045066	66	6	32			65	-0.010333083247197	0.0909598740508156
PM113.0903T854	113.09032147602	113.090205076597	113.090695531593	853.514870581485	851.383117313941	855.1382689568	37	5	32	[13][M+1]-		4	0.0567949621073945	-0.00111248465733353
PM113.071T710	113.07099594585	113.069225755893	113.071068182404	709.711334306378	708.566885430239	713.466875386932	33	6	27		[M-H-HCOOH]- 160.084	19	0.0529503357814176	-0.0405140676285464
PM114.055T709	114.05499138696	114.054946150593	114.055040947609	708.93373689287	708.138107154336	709.20151147898	9	3	6			19	0.0547282753021624	-0.0316032038232171
PM114.0913T63	114.091309821255	114.091263976027	114.091413488009	62.941128608639	58.7408775305271	65.7259426820481	14	5	9			260	0.0479390154642565	-0.0188624232631093
PM114.1026T747	114.102632997682	114.102571692997	114.102679634929	747.063950131539	710.599915795033	754.818465568611	48	6	36	[14][M]-	[M-H]- 115.108	6	0.0598027613937574	-0.00599968608036961
PM115.0502T618	115.050230730354	115.050059236424	115.050320817979	617.651411926417	616.20569828523	677.080183372129	26	3	18			111	-0.012735644012952	0.0615984178655736
PM115.0866T897	115.086576501945	115.085273807243	115.086670519738	897.299789635747	895.580233447704	901.322838153692	36	6	30		[M-H-H20]- 134.106	47	0.0281029033572036	-0.0465567815751384
PM115.0866T418	115.08664815127	115.083339366046	115.086740815773	417.997247466225	409.225866669286	445.428318325301	35	6	29			176	0.0469199180396169	-0.033904085305054
PM115.1059T747	115.10594462673	115.105890156082	115.105992450619	747.063950131539	726.340124339073	751.496980237035	38	6	32	[14][M+1]-		6	0.0597356688864389	-0.00516490858030826
PM116.0343T672	116.034275330871	116.034198743494	116.034328802782	671.712362190854	661.759161252434	735.75433116665	51	6	36		[M+Cl+HCOOH]- 35.0594 [M-H+HCOOH]- 71.0361	43	0.057760466001284	0.0087418293607892
PM116.0819T334	116.081919663429	116.081849453344	116.081992543039	333.942137914413	327.734389223016	350.453834459919	38	6	32			94	0.0562403587362969	-0.0173918868406107
PM116.1434T66	116.143446284431	116.143375292485	116.14348745588	65.5868880793155	63.1764062660207	67.3858763582455	25	5	20		[M-H]- 117.149	7	0.0192943207302663	0.0194097860831664
PM116.0706T454	116.070593566091	116.070481123724	116.070663038992	454.323944169882	452.153480408326	458.734298585503	42	6	36	[15][M]-	[M+Cl+HCOOH]- 35.0958 [M-H+HCOOH]- 71.0725	124	0.0165732683497211	0.0325056007639655
PM117.0739T454	117.073918812883	117.073765355926	117.073984393285	454.076056024867	452.045779107518	458.13130580993	42	6	36	[15][M+1]-		124	0.0162710074290259	0.0325298591482737
PM118.0862T425	118.086202577334	118.066856360632	118.086292896044	425.097558156978	329.05335351887	457.882476980413	70	6	36			9	-0.0185699299165802	0.0584953499496992
PM118.1227T64	118.1227197441	118.122615166959	118.122762618292	63.9581100419014	61.7593664552239	66.3736624687025	32	6	26			7	0.0461234716575933	-0.0222558512116478
PM118.1227T160	118.122709436462	118.122668287035	118.122764457897	160.239730470422	157.144914959411	179.180991502327	11	5	6			84	0.0400619942540561	-0.0179358193984786
PM119.0526T339	119.052577675984	119.035296858992	119.052663876018	338.95857028925	323.692175206636	367.575778927872	34	6	28			37	0.0338163592498266	0.0719316553918548
PM119.0896T421	119.089574349145	119.089500908655	119.089625614754	420.979414559632	418.452954390657	437.4886769661	42	6	36			24	-0.018604298908974	0.0579057020559328
PM120.0655T598	120.065516216906	120.065454098677	120.06558678691	597.617158273643	594.69373885293	601.156242003001	42	6	36	[16][M]-	[M+Cl+HCOOH]- 39.0907	16	0.0246226089682394	0.0817292611403449
PM120.102T164	120.1019843774	120.101908301699	120.102058466354	164.071129208491	159.700848724165	171.334959737304	18	5	13			214	0.0230512147522194	0.017934784439761
PM120.0808T408	120.080832860161	120.080765745643	120.081119888323	407.99641787277	402.99888222872	415.59755277266	42	6	36	[17][M]-	[M+Cl]- 85.1114 [M-H]- 121.088	10	-0.0168132171328941	0.0602383210007859
PM121.0649T326	121.064869667795	121.064643119643	121.064917589544	326.093475744131	319.643268776969	335.028242800751	42	6	36		[M-H]- 122.074	8	-0.000769118617113707	0.100065121964861
PM121.0688T598	121.068843855385	121.0687982626	121.068906379095	597.617158273643	594.69373885293	601.156242003001	42	6	36	[16][M+1]-		16	0.0243730558236198	0.0813827751815643
PM121.0842T408	121.084175542757	121.084136796937	121.084282686597	408.418669578568	402.99888222872	415.59755277266	31	3	28	[17][M+1]-		10	-0.0181670502213141	0.0604174654896173
PM122.0662T328	122.066239657009	122.063535119203	122.096491705576	328.294358783985	256.256048547601	408.470005363743	26	3	20			23	0.0361310591224771	0.0555210066158324
PM123.0404T313	123.040406932133	123.040301823554	123.055532393552	312.564515885453	276.105327181038	353.410831546567	64	6	36			226	-0.05489918523389	-0.00840312735475268
PM124.0394T346	124.039350582459	123.940148712256	124.039428574324	345.785256940695	309.683170892195	363.676440034941	51	6	36			242	-0.0245303811776977	-0.0214857356189839
PM124.0393T606	124.039346936563	124.039298958694	124.039389637886	606.311521329175	522.31502082092	612.032080547561	22	4	15		[M-H-C5H8O4]- 257.088	41	0.0585170135167834	-0.0154421666346967
PM124.0394T164	124.03937869156	124.039266483076	124.087146067186	163.709299271585	153.233844907137	189.746740337843	42	6	36	[18][M]-		215	0.0558726888642321	-0.0365483866144929
PM125.0234T501	125.023379586083	125.023351893732	125.02343822701	500.870449070136	498.961735810485	503.365580366947	11	3	8			58	0.0474307664328685	-0.0223626671822352
PM125.0707T423	125.070736975374	125.070342970231	125.071054196225	422.729713507671	375.918620495203	438.245130822521	16	3	12			150	-0.0128613737752223	-0.0690231051530674
PM125.0427T162	125.042658256811	125.042582191026	125.082294386687	161.603979217577	160.684798761077	179.009415918622	13	3	10	[18][M+1]-		215	0.0543290720376127	-0.0375021831222253
PM126.0627T332	126.062682446259	126.054975250499	126.102665401121	331.591805380974	166.843950558574	338.197709941853	47	3	31			169	-0.0108881958427315	0.0296804596482734
PM127.0391T733	127.039055674796	127.038972094048	127.039094151297	732.713879133422	731.549435440844	735.214397707444	42	6	36		[M-H]- 128.047	15	-0.00404104598584278	0.0203810424554319
PM127.039T479	127.03904517266	127.038965441653	127.03910501857	478.908976205965	473.478845883986	480.952498396084	40	5	35			60	0.0342539162354609	0.0756011292845643
PM127.0979T300	127.097911391486	127.097787821085	127.123084259455	300.280137689555	269.175090261486	358.909361537709	54	6	36			186	0.00229176644266968	0.0863835408888149
PM128.0707T402	128.07071672638	128.070618617271	128.08202311493	402.227959003566	375.32616315564	419.787616067709	45	6	36			12	0.0100325103086704	0.0542057799749364
PM128.1071T285	128.107099949565	128.081849302899	128.143507028175	285.189766771168	165.879516324274	317.26535828686	33	3	23			180	0.0357473857200139	0.0513093392679878
PM128.1183T579	128.118276571258	128.070666509445	128.118361128016	579.007638479986	575.425325726508	668.686878978024	18	3	12			120	0.0596420548838271	0.00344808870500941
PM129.0547T473	129.054742347971	129.054662804022	129.054805931607	473.087565940011	470.76228320137	526.305256844085	28	6	22			116	0.0398922152251649	-0.0459970504739457
PM129.1136T854	129.113593701912	129.108805867111	129.113693110109	854.026676719249	851.383117313941	856.532447383067	40	6	34		[M-H]- 130.123	4	0.0448675106978628	0.0139191424196682
PM129.0658T639	129.0657853271	129.065645293152	129.065898373501	638.634926080542	629.800991162317	664.738008344657	29	2	26		[M-H-H20]- 148.084	1	0.0451970256040963	0.0360138874537559
PM129.1023T307	129.102293431402	129.102243644523	129.102388860044	306.737242726535	267.883969715128	333.797923462145	21	4	17			90	0.0260322749962932	-0.0151440427487246
PM129.1024T63	129.102363635016	129.102312190589	129.102431018403	62.7787763414793	62.0572782652227	64.0332896845462	8	3	5			261	0.0484028655565512	-0.0223363696723011
PM129.0659T416	129.065947838823	129.065859356039	129.066044657178	415.863706245984	413.736638930801	445.202615433022	42	6	36			101	0.0423585042089654	0.0417483947168273
PM130.0499T638	130.049869313725	130.049812084278	130.049961311803	638.05886962675	625.929620404143	669.187517910486	56	6	36	[19][M]-	[M+Cl+HCOOH]- 49.0749 [M-H+HCOOH]- 85.0516 [M-H]- 131.057 [M-H-NH3]- 148.084	1	0.0283415467096679	0.0690700947561019
PM130.0943T855	130.094300548761	130.086367372695	130.0965121145	855.130379330529	852.767456521006	861.711495792021	41	6	35			126	0.0126114247624255	0.0814840130753348
PM130.0863T412	130.08634806867	130.086302022572	130.08642339681	412.147868481239	409.565071209122	429.301854364898	39	6	33			46	0.00498086797827461	-0.0165318530717899
PM130.0652T287	130.065229002991	130.065172233921	130.097605499299	287.187393972194	252.418561624093	337.851942784943	45	6	36	[20][M]-		52	0.0141740180061662	0.063597516552851
PM130.1591T69	130.159054262911	130.15898870502	130.159116545373	68.5285072577367	67.0491631918635	69.9780948655416	12	3	9			168	-0.00925495272949837	-0.00574447487877382
PM131.0532T639	131.053225877369	131.033944379666	131.053278924092	638.541859565458	625.929620404143	674.232248631433	58	6	36	[19][M+1]-		1	0.0289800280575943	0.0679989757618232
PM131.0816T524	131.081554455713	131.034020748679	131.089659113021	524.085314834011	412.442354812539	527.296551950635	44	6	36			13	-0.00463227350384321	0.0367119436731465
PM131.1292T746	131.129178142733	131.12912009667	131.129219460992	745.835638170776	727.176241775396	752.271136908403	41	6	35	[21][M]-	[M-H+NH3]- 115.108	6	0.051665530286389	-0.0187776184197949
PM131.0686T287	131.068557049324	131.068506286798	131.118016874705	286.587546113217	273.206073794147	322.400155102554	31	3	28	[20][M+1]-		52	-0.0272281422420609	0.0330821576579286
PM132.0539T637	132.053868493448	132.04787392768	132.053967676204	636.783731144454	626.880626853984	706.024968103733	46	6	36	[19][M+2]-		1	0.0419207967867924	0.0460551825524224
PM132.0405T312	132.040469081742	132.003293368362	132.040573620107	311.6312931073	293.076559670551	341.683550061717	26	3	23			227	-0.0540758648508724	-0.00760108353974631
PM132.1019T390	132.10194570526	132.101767866877	132.113281375015	390.183646780617	366.461255372959	445.428318325301	58	6	36	[22][M]-	[M+Cl+HCOOH]- 51.127 [M-H+HCOOH]- 87.1037	3	-0.0177253791028321	0.0805797262978298
PM132.1325T746	132.132545079388	132.132490660084	132.132583061083	745.828963473715	729.692184527862	752.271136908403	33	6	27	[21][M+1]-		6	0.0574787105588986	-0.00359872202488688
PM132.0656T605	132.065599832549	132.065564022338	132.065662839645	604.700834975353	603.767420420663	611.297471179213	17	3	14			196	0.0530902294516521	0.00644768637817164
PM133.0319T442	133.031933396475	133.031886327279	133.032006129787	442.2943589489	436.77468684351	443.3786379934	22	3	19		[M+Cl]- 98.0625 [M-H]- 134.039	33	0.0051026341760367	0.00347667256094672
PM133.0608T668	133.060754329566	133.060675644352	133.060806059652	667.64354276644	661.759161252434	675.862266729598	42	6	36	[23][M]-		131	0.0557002305397673	0.0093517814213627
PM133.0972T898	133.097248613171	133.097194791349	133.097316076636	897.636999104118	895.825880466013	901.322838153692	36	6	30	[24][M]-	[M-H]- 134.106	47	0.0255969178998096	-0.0504133837317909
PM133.1052T389	133.105220404319	133.10508498755	133.105314185335	389.255686952925	366.461255372959	397.195034241786	42	6	36	[22][M+1]-		3	-0.0175253852995718	0.0815061757544958
PM134.0448T736	134.044842716189	134.044760328476	134.044897417642	735.778198352341	733.198999114531	737.048052083429	42	6	36	[25][M]-	[M+Cl+HCOOH]- 53.0699 [M-H+HCOOH]- 89.0466	20	0.0589434926642886	-0.0175287805052162
PM134.0641T667	134.064082508406	134.064000363465	134.06413089943	667.186945786228	661.759161252434	675.862266729598	42	6	36	[23][M+1]-		129	0.0562533860052043	0.00900327988652589
PM134.0813T589	134.081263244657	134.081194540616	134.081318172713	589.110103053308	584.30589569496	593.273828339241	42	6	36	[26][M]-		35	0.0350148146839983	-0.0226952278520935
PM134.1176T276	134.117637502631	134.11758942905	134.117683676695	276.388224589218	244.673718452874	304.939605758579	26	4	22			71	-0.036804144035329	0.030664990594299
PM134.1005T898	134.10054394513	134.100482724351	134.100623217408	897.67763164038	896.164519120806	901.322838153692	18	4	14	[24][M+1]-		47	0.0265438846703458	-0.0499144446752097
PM135.0481T736	135.048149467639	135.048056664834	135.048222222131	735.778198352341	733.012181322528	737.533051938143	42	6	36	[25][M+1]-		20	0.0590216735832539	-0.0170994576361599
PM135.0845T588	135.084548071686	135.030176420996	135.084662291962	587.990441017763	492.122646415643	593.173055351697	37	5	30	[26][M+1]-		35	0.0366104167698234	-0.0169311729068045
PM135.0649T672	135.064922542605	135.064850603839	135.065808032383	671.839153460301	661.759161252434	678.576950756843	34	5	29		[M-H]- 136.076	43	0.0561443848380507	0.0064090280678489
PM136.0619T350	136.061888195939	136.061795839533	136.079214454523	350.404059432536	321.689022017872	377.135690406028	65	6	36			17	0.0140261078553472	0.0895050310439223
PM137.0658T361	137.065837246483	137.065163039117	137.082574209709	361.078151592574	320.941939993916	377.135690406028	47	6	36			217	0.0231331480650208	0.0893708656317151
PM138.0551T369	138.05509759287	138.05504267636	138.056407841885	368.650817077142	352.761473918321	380.240942454348	28	2	26			53	-0.0372690669061858	0.0123914034552989
PM138.0914T327	138.091419930534	138.057968913774	138.091504944592	326.52882277123	319.643268776969	366.406546371043	43	6	36	[27][M]-	[M-H+NH3]- 122.074	8	-0.00336396612712118	0.097960046545563
PM139.0946T327	139.09459373423	138.995430454795	139.094847594896	326.794554226648	319.643268776969	369.674403758815	40	6	33	[27][M+1]-		8	0.00601355411072073	0.0704070592533989
PM139.0503T413	139.05031348029	138.995448217565	139.050444029428	413.204094087046	372.249045824464	420.465538027324	38	6	32			46	-0.0151653774485879	-0.0352784733292744
PM139.9147T331	139.914743894358	139.914699714597	139.914789050498	330.507444502417	323.425220749308	336.161354045034	9	3	6			170	0.0497487546064879	-0.0157466839819205
PM140.0108T906	140.01083364451	140.010764964817	140.010889970333	905.725281663778	903.987753913188	906.916058932897	42	6	36	[28][M]-		14	0.0585624519708387	-0.00105210592467898
PM140.0344T507	140.03438924865	140.034301679849	140.068401923816	507.171563189166	472.462285441707	596.120968194992	29	5	22			51	-0.00260837433885268	0.0752597388811193
PM140.0683T339	140.068283918416	140.068240664977	140.068341586246	339.247076733136	334.540307929711	346.392548010729	8	3	5			193	-0.00732795048009768	0.0147501589313692
PM141.0141T906	141.014102276856	141.014010057394	141.014172934252	906.206293606857	903.987753913188	907.850792721703	25	6	19	[28][M+1]-		14	0.058255204201464	-0.000355090622732207
PM141.066T333	141.066024093434	141.047334806935	141.06731585754	333.03545027446	293.076559670551	366.119426904966	38	4	25			267	-0.0223814314461777	-0.0288048687029393
PM141.066T532	141.065995799912	141.0311836913	141.066254087041	531.80753421487	529.324507592988	554.631800719001	16	3	13			189	0.0468083686645749	0.0501121596488576
PM141.9128T331	141.912833029575	141.912778727831	141.912870722498	330.507444502417	323.425220749308	336.161354045034	9	3	6			171	0.0496346614838879	-0.0156037005453971
PM142.0263T917	142.026284795131	142.025836796115	142.097796605042	917.400119819143	916.053418468536	920.587644685694	32	6	26			93	0.0437019415543239	0.0140104807184151
PM143.0816T414	143.081552215088	143.072775598897	143.081627951609	413.938579194385	398.053396503885	442.937309079475	45	6	36			210	0.0546307845259141	-0.0268059623227661
PM144.1384T689	144.138441074235	144.065581993213	144.138556661419	689.038028920228	604.725424191742	733.154018309234	18	4	13			61	0.0466396876941856	-0.00855220336023623
PM144.0816T432	144.081593868887	144.065624701116	144.102110652534	431.647828515583	376.376125002151	480.865619763451	33	4	25			98	0.00139627422967729	0.0859365355787998
PM144.1019T335	144.10194081333	144.101874460588	144.102011486504	334.923561731066	328.101646884105	336.118704226834	12	3	9			42	0.0489690211323183	-0.00533239333677826
PM145.0496T732	145.049624973053	145.049515499692	145.049770211012	732.288711426831	730.825685878214	734.649443416819	42	6	36		[M-H-H20]- 164.073	15	-0.00570144224437798	0.0232238747451657
PM145.0162T905	145.016221174045	145.016117380981	145.016302738722	904.978342627881	904.163524071026	906.538016718197	9	3	6			14	0.057902995140243	-0.00630131486015477
PM145.1449T606	145.144869248044	145.144801196415	145.145182167844	605.549406647447	574.443624414314	663.43219504981	40	6	33			197	0.0603599341722617	-0.0083837120931687
PM145.0496T478	145.049606172636	145.049509894429	145.084477044082	478.126835648624	438.416578441633	480.943287855162	29	3	25		[M-H+HCOOH]- 100.051	60	0.031694803502547	0.0605106194128841
PM145.1085T329	145.108522159037	145.10836275324	145.108594686491	329.257576654885	320.20139415913	347.523140813438	18	3	15			172	-0.00769515452112063	0.0349910785470135
PM145.1336T66	145.133622262058	145.104445902276	145.133757082606	66.3002356179307	62.873010827497	156.808762162047	13	4	9			7	0.0481663680828707	-0.0389293527002722
PM146.0925T376	146.092489344551	146.060063780955	146.11763677258	375.791939424891	277.875630666128	440.547415648676	54	6	36			26	0.000831343363678985	0.0959535194712795
PM146.1176T64	146.117640301459	146.063503858627	146.117695494821	64.1580500090182	60.8414672814353	159.151527046444	43	6	35		[3M-H+Cl]2- 86.0856	7	0.0520024095967875	-0.0171030887979233
PM146.0601T528	146.0600907274	146.059952766005	146.060153796832	528.080048428274	524.385030106253	533.582476284266	39	6	33	[29][M]-		187	0.0597865671460732	-0.00351419631772385
PM147.0764T637	147.07636936009	147.076295016536	147.07642948022	637.332264061354	625.929620404143	661.668067027681	50	6	36		[M-H+NH3]- 131.057 [M-H]- 148.084	1	0.0318467203936707	0.0709237035521128
PM147.1129T862	147.112898152536	147.112808026379	147.112942616237	861.924095667888	859.754536196247	863.967026691681	42	6	36			28	0.000354624999709934	0.0941843672484907
PM147.0634T528	147.063425697985	147.044125136684	147.063550520632	528.107629334868	524.903999257537	547.734428659992	28	4	24	[29][M+1]-		187	0.0164113020940267	0.0810292073875532
PM147.0474T407	147.04744174438	147.044193635184	147.063477161038	406.73985484836	396.48232156816	438.309984013648	21	5	16			151	0.00531206335651088	0.0925074321923737
PM148.0606T665	148.060584922684	148.060318755062	148.079583236358	664.710594560242	625.929620404143	676.382967852961	78	6	36		[M+Cl+HCOOH]- 67.0856 [M-H+HCOOH]- 103.062	5	0.0583236827139678	-0.020332003698402
PM148.0969T556	148.096909953118	148.060508475699	148.096972532558	556.044083324084	513.942489550036	557.606884649707	47	6	36			75	0.0573197047912425	0.00164412770012675
PM149.072T651	149.07197590201	149.06349782123	149.080392269042	650.666889684161	625.929620404143	676.382967852961	78	6	36			31	0.0592919857082367	-0.00599276483592351
PM150.02T479	150.019976644408	150.019881043186	150.054906066311	478.986287338647	476.525506697174	516.739074983902	26	4	22			238	0.0272589989083843	0.0189153469542165
PM150.0897T314	150.089732891709	150.077415603086	150.112597026822	314.247415073527	246.259489252811	334.685269095577	69	6	36			67	0.0246049977178523	0.0820162142885041
PM150.0644T667	150.064362864183	150.064265420527	150.076103592654	666.524031898933	664.707563197025	703.583943424251	14	3	10			5	0.0581007855325108	-0.0211229224553906
PM150.1125T72	150.112496381092	150.11243330391	150.112543916404	71.7432436400759	70.4224426996626	72.8738552743164	5	3	2			166	-0.030860547056733	-0.0186360420423632
PM150.0584T442	150.058378256936	150.058309206569	150.058444428972	442.482545711169	438.003810331608	446.444887950974	42	6	36		[M+Cl+NH3]- 98.0625 [M-H+NH3]- 134.039	33	0.0120511979806584	0.0150025185568864
PM151.0353T303	151.035302049209	150.997728346871	151.035365285538	303.023974855316	276.105327181038	339.91599052222	44	6	36		[M+Cl]- 116.061	29	-0.0482796637734599	-0.0172512896377817
PM151.0476T640	151.047618809734	151.047535938347	151.098081827925	639.625911036431	632.288503996717	713.611869093149	37	6	28			79	-0.0193633279265053	0.0707769805523317
PM152.0567T547	152.056747730482	152.056655465502	152.056836013319	546.762702044992	492.122646415643	554.063465342167	61	6	36		[M-H-C5H8O4]- 285.105	27	-0.00188817177418376	0.0632979619740247
PM152.0317T639	152.031658455576	152.03158382744	152.03171355893	638.984805513906	632.288503996717	645.065692191741	24	2	22		[M+Cl+NaCOOH]- 49.0749 [M-H+NaCOOH]- 85.0516 [M-2H+Na]- 131.057	1	-0.00217831625348274	0.0883407428810259
PM152.036T296	152.035967309249	152.035862537468	152.117173415334	295.70485896203	182.311172285155	330.251196476725	44	6	33			66	-0.0271941089076467	-0.0189739827160999
PM153.0329T312	153.03290996935	153.032791291639	153.041319623121	311.833276359213	276.105327181038	374.899444688326	61	6	36			228	-0.046286472100954	0.0269725851051112
PM153.0767T718	153.076731329673	153.075846754674	153.111139665162	718.391269572144	717.145746449844	745.850571864768	9	3	5			22	-0.0313606916222912	-0.0454736784953346
PM155.0427T665	155.042749839484	155.042661283573	155.042812320039	665.428495183369	656.300481795051	675.862266729598	40	6	34			130	0.0538597080022182	0.0352973522558505
PM156.0422T341	156.042219859913	156.042155842797	156.042306079334	340.999318942252	316.321864569761	394.02796492694	26	5	20			193	0.0556118585413186	-0.00600378962548811
PM156.0768T868	156.076767247786	156.076666396368	156.076829844616	867.772642643025	865.128006021922	869.150796899908	42	6	36	[30][M]-	[M+Cl+HCOOH]- 75.1019 [M-H+HCOOH]- 111.079	30	0.0336805419316459	0.0760894577132294
PM157.0455T344	157.045497517277	157.045425965113	157.045541386398	344.029138307928	329.596856613754	347.757001353444	10	3	7			243	0.0566245746814452	-0.00359500291060626
PM157.08T868	157.079994778313	157.079801395015	157.080608100589	867.593477109735	865.128006021922	869.150796899908	42	6	36	[30][M+1]-		30	0.0335966276730217	0.0767925081948301
PM157.0608T673	157.060754467363	156.954117950924	157.060843490532	673.395787895206	658.764492738461	733.403328962988	33	3	20		[M-2H+Na]- 136.076	43	0.0562741143101356	0.00967421733181533
PM158.0925T854	158.092466993179	158.092345034586	158.092519799841	854.158174625856	851.239954528327	855.600606911538	42	6	36	[31][M]-		4	0.0575949688422421	0.0184182762806864
PM158.0994T321	158.099376221601	158.040275482246	158.117952151752	321.224361571675	252.166377911156	367.453558821055	58	5	30			141	0.0311355644475511	0.0512807683260891
PM159.0252T479	159.025236696061	158.964160238251	159.05140407543	478.735798878249	416.985619573307	558.451486923128	53	6	35			239	-0.00588236185819141	0.0648229079976259
PM159.0765T710	159.076469963356	159.076365592335	159.076542007689	709.608605343717	708.641466659651	713.466875386932	42	6	36	[32][M]-	[M-H]- 160.084 [M-H-NH3]- 177.11	19	0.0554008636663225	-0.0321629281444255
PM159.0959T854	159.095916152178	159.09579236616	159.096051922866	854.026676719249	851.239954528327	855.30642070025	34	6	28	[31][M+1]-		4	0.0575682832045953	0.0182233417720776
PM158.9641T325	158.964130535969	158.964007663297	159.124139621375	325.267812985677	304.920923709134	347.757001353444	30	6	24		[M+Cl+NaCOOH]- 56.0073 [M-H+NaCOOH]- 91.9839	8	0.0164818258455843	0.069070684009547
PM160.0794T710	160.079423880416	160.076024567347	160.079843845878	709.971215308804	708.768059078311	719.669054000894	24	5	19	[32][M+1]-		19	0.043004395455833	-0.0190998536587801
PM160.0758T271	160.075754825564	160.075660501263	160.133337474007	271.403513484034	240.2897563006	357.908631016288	25	3	20			44	0.0325218766615353	0.0203796465601216
PM160.0759T65	160.07585539542	160.075705948758	160.076310516124	65.4178107603916	64.056355626138	68.3010402167732	19	3	16			7	0.0347891930439101	0.0366712794627211
PM161.0921T442	161.092104354455	161.06324748677	161.09224023557	442.102334595055	358.446280642889	446.444887950974	53	5	35			191	0.0324065656737747	0.0333695541219403
PM161.092T555	161.092044112325	161.091887603307	161.092165214418	555.351269752867	550.157938673749	558.473242746611	34	6	28			75	0.055470434315987	0.0397443550831172
PM161.1307T792	161.130707891526	161.080830170945	161.134481911733	792.24801046676	708.641466659651	797.541368514827	26	4	21			74	0.0566167793551426	-0.00642930382556334
PM161.0823T152	161.082301555561	161.08225905278	161.082356972374	152.040443946045	147.388384852003	172.763730242318	13	3	10			121	-0.0292710875363593	-0.0197447904495197
PM162.0762T606	162.076178140941	162.07610645255	162.07626027299	605.902027637908	604.505033967189	613.631278926275	34	4	30			198	0.0112340759913782	0.0840005713554973
PM163.0979T148	163.09789945991	163.097728659836	163.097989347805	147.666082758052	67.7789341040911	172.763730242318	39	6	33		[M+Cl]- 128.128 [M-H]- 164.105	54	-0.0315554569582494	-0.020396035000028
PM163.0755T363	163.075487246816	163.075341927903	163.075682613634	362.71976914425	289.378604154026	376.367622866652	37	6	31			50	-0.0346475459875303	-0.0124983069387606
PM163.0638T733	163.063801987053	163.06004131475	163.070091833694	732.802491195857	731.391321949622	734.300801971943	29	3	26		[M-H]- 164.073	15	0.0104042522897727	0.0226698104299143
PM164.0741T755	164.074143545239	164.074000318827	164.091978064817	754.706718103115	710.529918744872	771.171213079895	83	6	36			39	0.024314993029965	0.092811227867565
PM164.0671T311	164.067066340699	163.990368499076	164.128167158356	311.164730303844	262.018100905991	368.367005816764	53	6	36			229	-0.0479495711166987	-0.00290877312471715
PM165.0547T546	165.054706950983	165.05465822444	165.054769175855	545.894258025114	543.548211322097	547.800622189617	19	0	19		[M+Cl]- 130.085 [M-H]- 166.062	27	-0.0123802558797545	0.0906802987603507
PM164.9352T269	164.935161393372	164.935057032912	165.113837145212	269.124212331732	165.879516324274	334.676832816695	60	6	33			203	0.016258262998933	-0.055484295174581
PM165.0777T762	165.077732444738	165.077538598095	165.095228002465	762.323188045637	711.980826392962	770.894444791316	39	3	27			99	0.0245468202973524	0.0928397513736946
PM166.0532T667	166.053203092334	166.053022477894	166.053308085412	667.124749659652	660.412067330272	669.596060903172	22	3	19			5	0.0522780714182905	0.0426974992851857
PM166.0863T408	166.08625276547	166.086146139651	166.086360071551	407.956289770778	402.914045741405	415.59755277266	42	6	36	[33][M]-	[M+Cl+HCOOH]- 85.1114 [M-H+HCOOH]- 121.088	10	-0.0174373604031471	0.0551492999744924
PM166.0646T311	166.0646134249	166.064528459963	166.107362227352	311.403408555299	293.076559670551	334.676832816695	20	3	17			57	-0.0528104873657428	-0.0133914393227408
PM166.072T627	166.07204080531	166.071957750545	166.072075785964	626.853062690198	625.929620404143	630.795464985051	8	3	5			247	0.0597500580017283	-0.000859339672421436
PM166.9508T184	166.950771117015	166.950700582171	166.950862806527	184.000000413241	176.536398415266	209.325811540894	42	6	36			36	-0.0292945102262819	-0.0504937225154719
PM167.0896T408	167.089617045198	167.058211687863	167.117971033918	407.735750202064	302.005569641221	415.59755277266	46	6	36	[33][M+1]-		10	-0.0174509361632087	0.0548143463818666
PM168.0454T66	168.04541409985	168.045316453759	168.045487886496	66.2008170279895	56.9513907895667	71.261630955584	28	4	24		[M-H-C4H8]- 225.115	135	0.0544071713063205	-0.0205432972955606
PM169.0358T567	169.035751827102	169.035659558908	169.035867137841	567.096044524443	564.108199725877	571.878874781341	40	6	34			91	0.051887823937842	-0.00185903160763991
PM168.9489T185	168.948904727239	168.948836902518	168.948977668977	185.451445917994	177.802074895588	192.950643312919	22	4	18			36	-0.0291727680228182	-0.0506717729564155
PM169.0584T637	169.058390716137	169.058268885597	169.096651311453	637.470721205958	607.718798038595	656.035422128253	44	6	36	[34][M]-	[M-2H+Na]- 148.084	1	-0.00649107243809319	0.0876472679592635
PM170.0614T637	170.061431286428	170.048253389029	170.061706010829	636.915979761005	619.396511527192	645.065692191741	42	6	36	[34][M+1]-		1	-0.0278806992302383	0.064359066368943
PM171.0763T637	171.07633111604	171.076232434308	171.076411995635	636.818265318118	625.929620404143	661.668067027681	46	6	36	[34][M+2]-		1	0.0361238366957538	0.0686826025393698
PM172.0946T317	172.094591598287	172.077937153803	172.133398142927	316.589020575539	295.854638691344	361.38370735112	22	3	17			8	-0.0259244668835853	0.00284407578791286
PM172.9564T823	172.956397505095	172.956284286838	172.956445510381	823.130168996042	818.620691672903	825.990484561532	37	3	34			87	0.0483431086964763	-0.0158642461759972
PM173.0785T65	173.078474666896	173.078351660787	173.07854623742	65.2019322177261	61.9127958394236	69.542965294976	41	6	35			7	0.00390780264764026	0.0623239526108098
PM173.0674T301	173.067357130582	173.067214608161	173.139787338158	301.158585608327	276.105327181038	334.676832816695	44	6	36		[3M-2H]2- 116.061	29	-0.0434416394362746	0.00616923415529792
PM173.0915T666	173.091509772497	173.089550636961	173.091889288541	665.778067819076	664.035285026479	668.686878978024	12	3	9			5	0.0565136832103115	0.0187266151746725
PM174.0761T665	174.076085447686	174.075942836925	174.07622719386	664.710594560242	654.794016708617	668.184873469343	40	5	35		[M-H-H20]- 193.11	5	0.0576747202185185	0.0172008845622962
PM174.0687T327	174.068701680477	174.017706201271	174.14896411223	326.72861884878	246.259489252811	354.658122139625	48	6	36			142	0.0517022625414809	0.018663099270307
PM174.9533T823	174.95329002269	174.953173441349	174.953359344339	822.59405871845	818.620691672903	824.749542698564	25	3	22			87	0.0475870044682305	-0.020425784599294
PM174.9381T323	174.938071676975	174.937962356491	175.039064108863	323.007887568145	294.776641954897	365.095844813824	13	3	9			139	-0.0119995113073384	-0.00919419851254655
PM175.1441T742	175.144148577384	175.079201184599	175.144245543767	741.934048469339	662.960292447206	746.918282637948	51	6	33			62	0.0593016221061168	-0.00633441607460985
PM175.1078T505	175.107765455261	175.086583185126	175.10788221496	505.2953497696	500.811616137277	587.499848932419	58	6	36			51	0.022113359178047	-0.0551181826039172
PM175.1189T854	175.118851319274	175.118712249049	175.118922841439	853.97445396787	851.239954528327	855.30642070025	42	6	36	[35][M]-	[M-H+HCOOH]- 130.123	4	0.0573532178970671	0.00657530831053128
PM176.1224T854	176.122350822293	176.12220540529	176.12241728177	854.026676719249	851.239954528327	855.30642070025	42	6	36	[35][M+1]-		4	0.0573701160352314	0.00662480063777223
PM176.103T710	176.103041441443	176.102926339367	176.103178845198	709.517670442524	708.641466659651	713.466875386932	42	6	36	[36][M]-	[M-H+NH3]- 160.084 [M-H]- 177.11	19	0.0552954944182801	-0.0339060941247875
PM177.0619T596	177.061949777568	177.061831083533	177.087189301803	596.201164691231	555.649541115144	601.209409284154	54	6	36			159	0.0482724510294001	-0.0397338418392288
PM177.1238T854	177.123799848728	177.123665556736	177.123908249939	854.101294601864	851.239954528327	855.600606911538	42	6	36	[35][M+2]-		4	0.0574920271922253	0.00802133344109477
PM177.1065T710	177.106498345598	177.106391828868	177.106694097144	709.524825789972	708.641466659651	713.466875386932	41	6	35	[36][M+1]-		19	0.0552761099447207	-0.0342689072348761
PM178.05T532	178.049979959683	178.049903229961	178.050088981057	532.293632535383	530.113859892721	533.298621912048	13	3	10			32	0.0575717821336758	-0.0244166760598228
PM178.0355T65	178.035487237666	178.035426673999	178.035537318165	64.8016576249197	64.3777269392406	66.4206721810331	6	3	3		[M-H-C4H8]- 235.105	7	0.0508902735804535	-0.00979485128379015
PM178.1261T285	178.126122777191	178.08964913446	178.126226600766	285.078761039963	182.311172285155	389.369119541567	47	6	36	[37][M]-	[M-H]- 179.133	25	0.0215347871211596	0.0827753615216084
PM178.1077T709	178.107694021807	178.107401223253	178.108911925852	708.981695359441	707.427356927427	713.611869093149	27	6	21	[36][M+2]-		19	0.0550157370964138	-0.0352715669990084
PM178.9927T440	178.992744775769	178.992490695511	179.049353345843	440.076306856795	364.866744821604	453.892187519169	40	6	31			33	-0.00935995126475709	-0.0492068920302144
PM179.1297T280	179.129712714616	179.129571980262	179.129799532644	280.2195781007	249.688743961324	319.031965661502	31	3	28	[37][M+1]-		25	-0.01768819275885	0.0843945735081234
PM180.1219T274	180.1218985808	180.101970917891	180.122021125406	274.16378529435	237.752088117123	289.378604154026	31	3	25			249	0.0193019264738798	0.0699937684675736
PM180.0327T680	180.032654871715	180.032381213834	180.086810868181	679.779005702435	674.034696067186	762.703920278071	35	6	24			104	0.0197168338502218	0.0106105160628354
PM180.0881T493	180.088068055441	180.068978195494	180.088271955728	492.518799059092	486.399869957755	564.426934962679	30	5	18			102	0.0522150757113346	0.0278780612972311
PM182.0813T546	182.081257962908	182.081115193581	182.081367629402	546.453034007817	543.548211322097	548.456808619513	39	5	34	[38][M]-	[M+Cl+NH3]- 130.085 [M-H+NH3]- 166.062	27	-0.0127171401611617	0.0892691326894335
PM183.0847T545	183.08470407226	183.084556186342	183.087211139647	544.877714416245	525.804048277734	548.456808619513	19	3	16	[38][M+1]-		27	-0.0131463722893498	0.0888252775943217
PM182.9458T323	182.945750654962	182.945642589124	183.138051691355	323.461024474648	313.965866663296	382.921981710271	19	3	11			143	0.052872899204831	-0.0255973303672026
PM184.0734T838	184.073448885184	184.073289822151	184.073544427565	837.954197896911	833.733901145998	905.533193265631	46	6	36	[39][M]-	[M-H]- 185.081	38	0.0522662338188965	0.000502579696607764
PM185.0324T637	185.032443821962	185.03232309727	185.032513524537	637.264598907943	628.247513452593	657.01855907766	41	6	34		[M-2H+K]- 148.084	1	0.0577233702889221	0.0112681197797359
PM185.0768T837	185.076782479445	185.076633888966	185.076879466814	836.978063297481	832.494650795808	839.940646384057	42	6	36	[39][M+1]-		38	0.0518758398424064	0.00248150689837679
PM186.0763T480	186.076316016103	186.076265284148	186.076430712825	480.379795321114	477.235849385162	482.840846365262	19	3	16		[M-H-H20]- 205.095	236	0.0352381774109849	0.0808400603674758
PM187.0353T453	187.035307393304	187.035224007261	187.035398485758	452.587113143467	448.702517943128	453.73012208616	42	6	36			2	0.0180285092485555	0.0242944368606514
PM188.0709T439	188.070850743541	188.070704411034	188.070974665033	439.409526095419	431.852840483506	440.547415648676	41	6	35		[M+Cl]- 153.101 [M-H]- 189.078	190	-0.0165410171447659	0.069291074750026
PM188.176T773	188.175968772281	188.175917370678	188.176087620584	773.426156598755	759.466024770251	782.232084336169	26	4	22			64	0.0599473917576664	-0.0120216844919483
PM189.1349T742	189.134948925536	189.134759830529	189.160086667747	741.549879308136	657.69021351195	750.444961384658	81	6	36			240	0.05826423334424	0.00873229858687923
PM189.1236T385	189.123564831935	189.087225717243	189.123736955789	384.933284740019	354.965362538733	394.372540425783	41	6	34			78	0.00733641733783607	0.0834318096208372
PM190.0128T496	190.012830525828	190.012737113234	190.050013832188	495.796114735625	439.762010319855	498.952491291451	26	3	18			233	0.00958420819934148	0.0857485228381656
PM190.1634T690	190.163394669356	190.163357837493	190.163488369398	689.856244108151	687.985784039302	691.853486770586	8	3	5			61	0.0596821713613687	-0.00188057421585248
PM190.9122T312	190.912168980282	190.912044391983	190.912283064038	311.66264741783	292.450090164164	327.149890707853	25	3	22			230	0.0568842759528686	-0.0209418026994767
PM191.0537T649	191.053742324612	191.040394020066	191.10294488947	648.876989910942	634.365648130339	688.572938736861	58	6	36			31	0.0401648635846013	-0.00535476975658985
PM192.0505T513	192.050472469017	192.010913604564	192.050594714514	513.214176912254	492.122646415643	516.151665299031	14	3	11			85	0.0564780998776334	-0.0245374736503035
PM192.1418T285	192.141818600881	192.061942147707	192.142025003952	284.801317664092	246.259489252811	334.676832816695	72	6	36		[M-H]- 193.149	179	-0.0115737476394304	0.0849073104898974
PM192.1063T666	192.106253630078	192.024472208385	192.106358171001	666.282565246793	664.035285026479	675.22708006225	18	6	12		[M-H]- 193.11	5	0.0584337055097365	0.0152607817035428
PM193.1454T294	193.145352697233	193.063443126365	193.145552633206	293.809018727704	247.388291704006	334.676832816695	59	6	35			244	0.0302707188473777	0.0676994664121151
PM193.0511T746	193.051118906956	193.05097578051	193.108326282413	745.96277729042	662.960292447206	749.907150192203	34	3	23			6	0.0549878576074407	0.0252162418011731
PM194.1177T65	194.117747020385	194.117595808249	194.117904256303	64.8174482553032	61.7593664552239	68.2717680025791	18	0	18			7	0.0100789007850766	0.0982882598846867
PM195.0326T530	195.032612230864	195.03213226392	195.032832290344	530.070061160373	524.013471206348	534.255835985817	32	6	26		[M+Cl]- 160.063	32	0.0143017499105257	-0.0569086778410866
PM195.0495T746	195.049508504499	195.049083997618	195.05004054786	746.350639308232	745.850571864768	747.200899557895	10	3	7			134	0.0537122992114347	0.0267741337896418
PM195.1226T62	195.122635391386	195.121450037879	195.123192405921	62.0230718246864	57.7042667804129	67.3545540933707	31	6	25		[M-H]- 196.13	80	0.00377032393471235	0.0834602429720843
PM196.0463T953	196.046270247996	196.046223737183	196.046440695011	952.877523100168	949.471844444106	954.035273265631	9	3	6			86	0.00781998736093373	-0.00405740221209146
PM196.0639T452	196.063936851919	196.063824252144	196.064051567371	452.234012900133	445.202615433022	453.22977071912	42	6	36	[40][M]-	[M-H]- 197.071	2	0.0565030190373412	0.0222292164534523
PM197.0677T452	197.06768810912	197.067572472775	197.067820938201	452.234012900133	445.202615433022	453.22977071912	42	6	36	[40][M+1]-		2	0.0564040237154216	0.0219065353590535
PM197.101T854	197.101021457165	197.100814584291	197.101231177883	854.052135064047	852.133927109143	856.067375466791	27	5	22		[M-H+NaCOOH]- 130.123	4	0.0478729327018215	-0.00213031204843864
PM198.0434T813	198.043357703899	198.04327495261	198.043429927113	812.71595035755	806.298365692387	816.118011699681	12	3	9			77	0.0596445152047528	-0.00295756184354791
PM198.0598T452	198.059811327152	198.059687224743	198.059943196516	452.092693120454	445.202615433022	453.22977071912	42	6	36	[40][M+2]-		2	0.0563441367137972	0.0222102985176283
PM198.0854T709	198.085415100582	198.085155609094	198.08626431888	709.349517699663	706.642909267337	713.360657643063	30	5	25	[41][M]-	[M-2H+Na]- 177.11	19	0.05908810812781	-0.0145063033546606
PM199.0441T598	199.044076326545	199.043959731482	199.04416654713	598.236864732535	593.803469558355	601.209409284154	25	4	21			55	0.043139563980336	-0.0351633186264415
PM199.089T708	199.088986886793	199.08885461562	199.089382837288	707.884678672344	706.46700330587	711.454423112895	18	3	15	[41][M+1]-		19	0.0591735930606838	-0.0133799132869026
PM199.063T452	199.063006637871	199.062856269007	199.063124953229	451.587715067687	442.937309079475	452.898241495009	16	3	13	[40][M+3]-		2	0.0552788687365364	0.0194722663508708
PM201.0873T404	201.087271934379	201.087124847123	201.087369439803	404.380901513413	375.596342281939	417.333430938758	23	3	20			109	0.023928880968184	0.0862474677037634
PM202.1264T64	202.126404548278	202.126200938822	202.126477899614	63.7480991924697	62.8435451520554	65.5701246491084	15	3	12			7	0.0570123860291317	-0.0192317155874914
PM203.053T479	203.05298192167	203.052883323547	203.053105799464	479.032563145501	472.462285441707	481.809451566352	23	3	20			60	0.0299004634645629	0.0804055706661566
PM203.1389T358	203.138874598051	203.13877805241	203.138973753641	358.191906330037	337.22745885903	362.941585092896	34	4	30			248	-0.00930065943629858	0.0897258751422228
PM203.103T922	203.102959813005	203.102869960367	203.103084923343	922.142129909182	920.695481232861	924.357639591617	14	3	11			115	0.0570954564138521	0.0312147428408821
PM203.15T633	203.149968500834	203.081856238615	203.150070243878	633.000417234725	536.765910437811	655.071287380083	39	5	31		[M+Cl]- 168.18 [M-H]- 204.157	45	0.0510258844599394	0.0292567085177413
PM204.0866T479	204.086554275828	204.086442605554	204.086632698712	478.913406876766	473.478845883986	480.775653029174	41	5	36		[M-H]- 205.095	236	0.0389810663487252	0.0727585694559439
PM204.0866T732	204.086555513248	204.08639915077	204.153510298947	731.758075825149	654.07854936519	734.581007652914	35	4	30			15	-0.00142800868677954	0.0218873732977109
PM205.017T370	205.016976221797	205.016918585587	205.017042674929	369.606318883834	351.807145875254	375.154455981587	11	3	8			222	-0.0236237513332976	0.0840279271246475
PM205.0824T734	205.082378951886	205.081695485247	205.11854531934	733.800446568082	655.066587053638	736.850931145351	44	6	28			15	0.0572575449719625	-8.78320509759306e-05
PM205.1291T860	205.129124287595	205.128909393226	205.129247781363	859.568361817228	857.971271595538	860.436449209603	8	3	5			185	0.0270412336028456	-0.0596323541964283
PM205.097T440	205.096997825903	205.068102402577	205.09714511495	439.957815818799	334.676832816695	529.146508161377	66	6	36		[M+Cl+NH3]- 153.101 [M-H+NH3]- 189.078	190	-0.0169710223763439	0.0640001711967353
PM206.0552T836	206.055195309238	206.055119510626	206.055276539776	835.921484800107	831.370831925938	838.902220821294	33	6	27		[M-2H+Na]- 185.081	38	0.0433483645291064	-0.00325004888674561
PM205.9615T266	205.961493586951	205.961449656598	205.961600536176	266.096273501302	255.93947114584	288.776301255943	16	3	13	[42][M]-		204	0.0584077733428191	0.0141760660661473
PM206.1022T596	206.102171749093	206.102111776709	206.102254208427	595.906467886555	592.34301926698	600.802510988652	8	3	5			159	0.0563863590334864	-0.00536030716162031
PM206.965T265	206.964972630091	206.885690298208	206.965069353723	264.991500731366	232.946219039656	272.752671834051	15	3	12	[42][M+1]-		205	-0.00452036762574674	2.34095253351865e-05
PM207.0144T640	207.01435607921	207.01411818497	207.097391354641	640.039013527572	633.584353109297	663.866279417049	40	6	34			258	0.0491737583121279	-0.0274461667381334
PM207.0651T362	207.065138368671	207.06490424266	207.11284807018	362.018787023457	314.47776803297	439.409526095419	70	6	36			218	-0.0472910395881284	0.0338795871301197
PM209.0007T733	209.000720804493	209.000611645611	209.000823160861	732.990170957344	731.097424802014	738.325839845407	28	4	24			158	0.00323136374628406	0.064434194050512
PM209.1396T268	209.139624511399	209.139511912227	209.139752341705	268.111947690788	242.478032638954	297.432486816897	41	5	36			206	0.0594527365469498	-0.0017443068810728
PM209.0009T478	209.000884690629	209.000752251813	209.092040915845	478.160672648284	439.409526095419	480.952498396084	16	3	13			60	0.00320492631029546	0.0887942913779506
PM210.0762T556	210.076174871036	210.076010625058	210.076472822749	556.414916611389	554.007377385555	560.905916845235	42	6	36	[43][M]-		255	0.0538517215942957	0.0291502456539671
PM211.0797T556	211.079680498686	211.079477088966	211.080491367164	556.355809643672	553.724186717302	560.905916845235	34	6	28	[43][M+1]-		255	0.0532505878518017	0.031201136679134
PM212.0587T530	212.058697410329	212.058603624691	212.058807753597	530.058068230391	524.953633313687	533.71064093616	39	6	33	[44][M]-	[M+Cl+NH3]- 160.063	32	0.0585938063384407	-0.0214702458477938
PM213.0624T530	213.062445242402	213.062335009212	213.090575306122	529.897845476077	441.141806295225	534.255835985817	36	4	32	[44][M+1]-		32	0.0591253975195109	-0.0139060700493391
PM213.0846T665	213.084565270207	213.084404560065	213.084687475944	665.326547277363	653.093473395445	668.150583080173	30	3	27			5	0.0520814530414406	0.0433336816524054
PM213.983T823	213.982998368829	213.982858669316	213.983068269179	823.088501304681	818.620691672903	828.775471150396	40	5	35			87	0.0553340035185916	-0.00421946701222068
PM214.0589T707	214.058858289485	214.058802078641	214.05893232204	707.227493736262	705.754369489541	708.570446386225	14	3	11		[M-2H+K]- 177.11	19	0.0588427487893896	-0.0172961200913574
PM215.9795T824	215.979535633003	215.979385275788	216.062673532046	823.946571366053	818.620691672903	847.897291112328	43	6	36			263	0.0424546238168228	0.0206876770416263
PM216.0814T283	216.081385771127	216.081276824949	216.081471344855	283.325201083703	249.688743961324	324.260738907822	41	6	35		[M-2H+K]- 179.133	25	0.0440215982221469	0.0519083758946581
PM217.1042T62	217.104182566915	217.104044078137	217.104291318793	61.9408216473119	57.7042667804129	65.5701246491084	42	6	36		[M-2H+Na]- 196.13	80	0.0178968120916251	-0.00985002837729876
PM217.1287T455	217.128657500221	217.124731390597	217.154089273688	455.060233952151	381.38550026145	457.101441765725	41	6	34			125	0.0336277181561375	0.058291372880761
PM218.0452T453	218.045182208186	218.045087276638	218.045255852523	452.870979891645	446.444887950974	453.892187519169	42	6	36	[45][M]-	[M-2H+Na]- 197.071	2	0.0408511133265312	0.0384531748028455
PM218.1171T63	218.117141617272	218.107624723454	218.119495840112	63.4203134757299	57.7042667804129	65.5701246491084	12	3	9			7	0.0463311600702492	-0.0339336241248892
PM219.049T453	219.04896695414	219.048863710204	219.049063707281	452.91198349863	446.444887950974	453.892187519169	42	6	36	[45][M+1]-		2	0.0403536088940985	0.0379761687993719
PM219.0971T668	219.09708747884	219.096839416139	219.170341540274	668.370758562128	657.193253726865	717.467973663185	44	6	33			97	0.0568161418259601	0.021947473506928
PM220.0407T453	220.040744657214	220.040646697332	220.040850904171	452.804114415308	446.444887950974	453.623298532803	42	6	36	[45][M+2]-		2	0.0398241915864077	0.0402267849017023
PM223.8756T329	223.875647906098	223.875574840902	223.875708601363	329.487593819854	324.423692417636	334.887657437659	9	3	6			173	0.0500205963384569	-0.0162142383319867
PM224.1076T68	224.107589044962	224.107475792771	224.107696131289	68.2943433736417	61.9127958394236	71.261630955584	17	3	14		[M-H]- 225.115	135	0.0570640403005753	-0.0192511903608605
PM224.9922T193	224.99220150805	224.992078928604	224.99233870387	193.166016025192	190.422308006523	201.767026739509	22	5	17			122	0.053905799582401	-0.0369127253954703
PM225.0754T353	225.075448786748	225.075285285539	225.123004598436	353.021782816478	311.107082751735	413.42403229062	54	6	36			251	-0.0475537102883003	0.0165598228463423
PM226.0706T632	226.070598166116	226.070397716994	226.070806249612	632.340656790616	628.161028270451	636.780009024642	24	5	19			209	0.0592705073558707	-0.00968714117023511
PM227.066T720	227.065966951437	227.065860233969	227.066080373394	719.664724444369	717.485556944075	724.928794948882	34	3	31		[M+Cl]- 192.096 [M-H]- 228.073	22	0.059723100153971	0.00536252243766702
PM226.9512T343	226.95122450304	226.951093547474	227.125269073473	342.805821576253	312.766083828387	397.405536537433	34	6	28			96	0.0117451082148953	-0.0716210484299286
PM228.0066T663	228.006569726187	228.006437776299	228.017909365403	662.90189791907	594.097007932037	668.03901681467	11	3	4			132	0.00560281792971708	0.0393554534249584
PM228.0992T666	228.099217178668	228.099049049522	228.169956896015	666.34152771037	631.949760691331	729.468111626654	61	6	36			133	0.0553413758767306	0.0216218064370856
PM229.0861T75	229.086134186134	229.085999626789	229.086445776197	75.4572130112877	73.4040074755265	77.9316449570957	18	4	14			113	0.0572953262310557	-0.0252909628117589
PM230.0967T280	230.096704150823	230.096520482138	230.096816477475	280.095226658927	246.259489252811	311.66264741783	36	6	30		[M-2H+K]- 193.149	179	0.0550387814692379	0.0314094419592921
PM231.1001T304	231.100078135253	231.04930956614	231.169487417331	304.239933872533	272.128354672359	378.796461392767	21	3	18			107	0.0347257833632897	0.0221388444833387
PM231.0969T559	231.096863095165	231.096755611907	231.097057221876	559.127235402883	555.649541115144	560.746604731418	18	3	15			49	0.0506569144701923	0.0240157358232276
PM233.0625T600	233.062490405346	233.062256177564	233.113065521055	599.715402429023	528.686043948223	615.430926807159	63	6	35			225	0.0270585030292704	0.0582961986148111
PM234.0188T452	234.018846701604	234.018742408295	234.0189501178	451.824850206644	446.444887950974	453.212060186664	42	6	36	[46][M]-	[M-2H+K]- 197.071	2	0.0602014247886347	-0.00976197786739357
PM234.0399T531	234.039884668315	234.039797095607	234.039977866161	530.800481028309	527.200416030406	534.255835985817	32	5	27			32	0.0569959958813486	-0.0252350607090623
PM234.0973T63	234.09732903511	234.097296428039	234.09754857405	63.2404764470126	61.0824367662576	64.0332896845462	4	3	1		[M-H]- 235.105	7	0.0523636737457214	-0.0103666941854581
PM234.9559T906	234.955879742542	234.95573225263	234.956021676287	906.119846255889	904.163524071026	907.850792721703	42	6	36		[M+Cl]- 199.985	14	0.0570592380161101	0.00956081851677501
PM235.0225T452	235.022488252989	235.022299055488	235.022574415525	451.506666477188	446.444887950974	452.985718082281	22	3	19	[46][M+1]-		2	0.060152290010789	-0.010331675648181
PM236.0159T451	236.015868331702	236.015738157438	236.015993261986	451.430866791308	447.602077805785	452.898241495009	25	4	21	[46][M+2]-		2	0.0602244250745615	-0.00959695412951179
PM240.0497T368	240.049667191915	240.027008472477	240.049790271016	368.182771631995	329.53274721749	460.595783173088	29	4	24			223	0.00142786943901241	0.0500173186053985
PM240.0895T736	240.08952291793	240.089400743442	240.089618989711	735.657287510507	735.019362845931	738.470589810947	15	3	12			165	0.0574751341417885	-0.0104737859919001
PM240.8656T329	240.865558609248	240.865462917873	241.05338825067	328.84157581901	322.800723647286	374.807497857186	8	3	5			174	0.0456883699606097	-0.0127004671607365
PM242.9242T319	242.924219299379	242.924110921807	242.924389714075	318.693067700923	294.776641954897	347.757001353444	38	4	34			8	-0.0269493695493395	-0.0184847660894255
PM244.0916T721	244.091603568095	244.091479409207	244.091788406936	720.512638129318	718.468464608748	724.928794948882	42	6	36	[47][M]-	[M+Cl+NH3]- 192.096 [M-H+NH3]- 228.073	22	0.059491044181274	0.00565635781055086
PM244.0781T487	244.078113097517	244.078028670355	244.091348972238	486.721073308255	480.378210156501	558.826628175547	23	3	18			76	0.00945359990568011	0.0979487066518351
PM245.0954T720	245.095407816831	245.09526246454	245.095848424831	720.457248360298	718.468464608748	724.981467196799	42	6	36	[47][M+1]-		22	0.0593734644020497	0.00602884386954768
PM247.0793T478	247.079261063674	247.078078836384	247.127865015192	478.223386131098	474.869932441715	485.159753969833	28	3	25			237	0.00652444465357784	0.08478003811305
PM250.0136T532	250.013561670008	250.013507840559	250.013658580793	532.06688085116	528.495057783139	533.298621912048	16	3	13			32	0.0588879536458175	-0.0182820003153212
PM250.911T186	250.910983277808	250.910901786078	250.911101001481	185.826627955925	181.484163318548	192.950643312919	12	3	9			36	-0.0296311073796817	-0.0506052268577578
PM252.1432T586	252.143236809049	252.142408862862	252.143374343644	586.412584109853	578.676296156417	592.838127821502	30	3	27			81	0.0552440002160456	0.0247879206034505
PM255.0967T332	255.09666057412	255.096540693263	255.096802961891	331.615553977943	316.321864569761	353.410831546567	42	6	36			175	0.0582338722971984	-0.00790488416289238
PM256.0806T607	256.080647405255	256.080555400289	256.128261078926	607.254739230354	507.429108719532	615.032757227815	47	6	35	[48][M]-	[M-H]- 257.088	41	0.057911554365075	-0.014958575251424
PM257.0842T605	257.084217267368	257.084144844558	257.084286893646	605.465149729164	604.404269845009	606.405870867035	12	3	9	[48][M+1]-		41	0.058144265699188	-0.0151303626783917
PM258.1086T767	258.108598710237	258.108453963037	258.10874794885	766.684498265296	756.498641599689	770.948905819554	35	5	30	[49][M]-	[M-H]- 259.116	40	0.0378655134073913	0.0221223602783884
PM258.8978T309	258.897826378608	258.897698009676	258.897989465321	309.006219751899	289.33382721715	346.336684196675	35	4	31			266	0.00636416834964235	-0.0234366499462655
PM259.0708T453	259.070764807766	259.07057676059	259.070946884035	452.964271896965	447.602077805785	453.892187519169	42	6	36			2	0.0400898037162612	0.0431255503145468
PM259.1122T767	259.112196443497	259.07948361383	259.112497478091	766.684498265296	731.419691812498	771.832139789225	33	4	28	[49][M+1]-		40	0.0372387164938914	0.0225850669528515
PM261.1294T60	261.129392560146	261.129259051643	261.129847470807	60.0841343946222	56.216352469263	64.3892990101643	40	6	34			100	0.00775371585777889	-0.0237567696103572
PM261.1423T445	261.142309354067	261.140606401024	261.142969678056	444.523986953109	440.17435465848	533.809600091444	27	0	22			105	-0.00494965616722084	0.0822208545032454
PM261.1544T794	261.154424254349	261.154346369908	261.154537790742	794.27008252985	785.407802313995	805.4036080388	16	3	13			252	0.0549429535409192	-0.00590498171341118
PM261.072T207	261.072039856285	261.071821018025	261.072190107756	207.110104424432	203.162275595735	226.729827988906	16	3	13			106	0.0568300869686271	-0.0347684607432537
PM263.0724T669	263.072430621492	263.07207655368	263.0863397267	669.330146679865	551.762879541755	739.629922742911	61	6	36			200	0.0408475454065703	0.0619239946033312
PM265.0663T464	265.066310235089	265.066179189945	265.066481426062	464.474063210018	459.8887258605	468.3447971054	21	3	18			89	0.0467235792293227	0.031937232010142
PM265.1105T361	265.110510326675	265.110372836834	265.153420318029	361.247668059067	330.685845184078	370.047966774871	14	3	11			219	0.0520648154159052	-0.0119213819465152
PM266.0734T559	266.07341779345	266.073341674536	266.073537173159	559.403459049977	554.759733987663	560.905916845235	21	3	18			49	0.0177601287220686	0.0868996971746101
PM268.1027T340	268.102707316993	268.102574668621	268.102879443702	340.03633954751	307.05948683578	357.775274610516	42	6	36			37	-0.0114852072599255	0.088740863733179
PM269.1064T345	269.106446075694	269.087640327292	269.106752989794	344.978833009923	329.527353635664	439.644869362828	30	3	24			65	-0.0112373286206372	0.0876269104496896
PM270.096T544	270.096005105686	270.095787922762	270.096124607686	543.957984405866	541.503575890878	546.53132933935	20	5	15			184	0.0579715674594529	-0.0154603123834093
PM275.134T675	275.133959897675	275.133608995478	275.134290322026	674.734035499369	671.981747566608	686.046087512552	26	3	23			201	0.0464259980574697	0.0467719814963487
PM275.0662T531	275.06619766257	275.066056394598	275.066284671591	531.08195338779	528.495057783139	534.255835985817	15	3	12		[3M+2Cl]2- 160.063	32	0.0573087555373003	-0.021778199546046
PM276.1173T793	276.11731909741	276.117060491701	276.117464279524	793.308217341353	781.496759912722	798.744043460145	26	3	23			253	0.00854611684306732	0.100166428481436
PM277.0876T589	277.087632370696	277.087445996532	277.101810369023	589.293156131107	476.482891565792	594.428796732089	56	6	36			192	0.0534004428317291	0.0205878307234909
PM277.1014T768	277.101437374671	277.101267938691	277.120973014858	768.482729938616	685.240287822766	798.744043460145	23	3	17			194	0.0550384635486478	0.0296939743953931
PM277.0668T408	277.066837337061	277.06665572137	277.16409541194	408.355024928914	351.047096812747	421.223160660541	19	3	15			152	0.0181363906052255	-0.00284817116701116
PM278.091T593	278.09101428605	278.061748238971	278.091187349882	592.988076625058	590.428615270004	605.867872331461	17	3	14	[50][M]-		160	0.0545375527151853	0.015750573510189
PM279.0923T592	279.092312074424	279.092105332383	279.092672357455	592.222166847822	586.977395828915	594.428796732089	22	3	19	[50][M+1]-		162	0.0521941330483687	0.0240475283922954
PM279.2301T419	279.23009527817	279.081347700898	279.230200336797	418.691346741717	413.357878574241	441.532908473797	24	3	21			177	-0.00774195717494995	-0.0055635297035608
PM280.0904T765	280.090431121859	280.090270744293	280.090547785479	765.17452481104	758.119304392982	770.948905819554	21	3	18		[M-2H+Na]- 259.116	40	0.0314559819742277	0.0215312673380243
PM282.0471T559	282.047146338878	282.04701305422	282.047217047827	559.403459049977	554.759733987663	560.122589240268	11	3	8			49	0.044118390355119	0.0589582887641996
PM284.0973T549	284.097287119911	284.097184575767	284.097540157789	548.79056694743	544.661800032108	554.063465342167	31	5	26		[M-H]- 285.105	27	0.0252090444953262	0.078271974910085
PM285.11T446	285.109971010244	285.100973796212	285.110102294921	446.444887950974	442.102334595055	546.010792301136	11	3	8			18	0.0347357633068725	0.00782894500756786
PM286.0906T718	286.0906217479	286.090547426278	286.090668504379	718.201394322044	717.417879663598	718.583621636872	13	3	10		[M-H-CH3]- 302.133	22	0.0578562791124307	-0.0171494576296642
PM287.094T353	287.093996160466	287.093597299763	287.108709485703	352.529816234974	341.513710085379	398.897636644321	20	2	18			164	-0.0248600307907978	0.0109278765728536
PM289.1381T414	289.138083322827	289.137809305225	289.13844106228	414.342627783296	379.612629087579	420.042211128996	36	6	30			211	0.0414332202053406	-0.0418080334958902
PM289.9215T264	289.921531297945	289.921463383262	289.921704525719	264.347033390923	255.93947114584	268.6343136541	12	3	9			207	0.059099776373154	-0.0122732534715082
PM291.1287T966	291.128729071117	291.126635782643	291.129570105735	965.97748176419	963.745189003689	969.588646963956	34	5	29			110	0.0576280285748563	-0.00714320411888944
PM291.1037T427	291.103663532235	291.096100094464	291.103843511005	427.3731236189	404.662469127291	433.082026568286	32	4	28			9	0.0520803530729272	0.0439936503083724
PM291.9055T906	291.905535156539	291.905425583021	291.905602726083	905.963232170472	905.224299591617	907.130233606857	6	3	3			14	0.0586692141710971	-0.00105093672637488
PM292.1964T854	292.196374956325	292.19627199365	292.196656480855	854.257247531228	851.239954528327	856.532447383067	22	3	19			4	0.0515886877943229	0.0436780466590948
PM293.0619T593	293.061937644484	293.06181955631	293.062034130721	593.170205307134	586.977395828915	595.314504173375	17	3	14			160	0.0592880939485454	-0.0098305966308914
PM293.0831T793	293.08311492744	293.082867253476	293.200123841661	793.176371384447	720.594505993461	854.171389347528	22	3	11			254	0.0543901820087215	0.00655963735407852
PM294.0362T607	294.036179826257	294.036063984845	294.036302701723	606.733707004638	605.539427350632	607.718798038595	6	3	3		[M-2H+K]- 257.088	41	0.0585951850393405	-0.0147940383707128
PM294.936T184	294.936025189158	294.935888320928	294.936197747522	183.798209810058	179.077076231322	190.949741154792	17	3	14			36	-0.0277713871879811	-0.0456720781508458
PM298.0948T856	298.09475124422	298.094686843381	298.094909484685	855.816125520472	853.79482183091	861.470872798437	20	3	17			127	0.0486883741933332	0.0142599514757312
PM301.1043T527	301.104307255316	301.104212552205	301.104591087011	527.361991439716	524.953633313687	531.086782931324	26	3	23			188	0.023315473010204	0.0172135623217337
PM301.1123T711	301.112271773949	301.112129649171	301.112418379022	710.971694931085	710.047242055383	715.605130686767	14	3	11			19	0.0551057819966336	-0.00881862068909374
PM305.1441T599	305.144060829221	305.140665778812	305.144375458075	598.631943216973	594.735804060676	601.871993550131	19	3	16			55	0.0583672019795294	-0.00163218654899165
PM305.0982T223	305.098207893881	305.097572266507	305.09960471169	223.021912793192	217.901495944633	239.50624431163	18	5	13			117	0.0565281494364104	-0.0154797461493795
PM307.0982T676	307.098189693158	307.097900861722	307.100334224764	675.903950207062	662.3697415523	731.419691812498	43	6	36			72	0.0561679242266888	0.00732245223145482
PM307.0773T424	307.077270418953	307.077164285556	307.112788587482	423.625136146172	369.91403327758	431.044499121026	22	3	19			9	0.0583245142298395	0.00380428202995229
PM307.2243T71	307.224301658362	307.187211110863	307.225118545198	71.0973596365489	64.8183823613382	73.1428122136555	9	4	5			21	0.000622431010121702	-0.0660645098384178
PM308.0894T693	308.089416643275	308.089199124658	308.102100675865	693.216702020258	667.770971097582	700.406271756126	15	3	12			154	-0.00629761389914593	-0.0154544815268317
PM311.1254T452	311.125377757525	311.125191268041	311.125567419717	452.348724051554	451.191271668051	454.747717850152	42	6	36	[51][M]-		2	0.0436763113761577	-0.00181848623465053
PM311.2563T604	311.25633707675	311.255988037068	311.256599741413	603.818249137827	598.996407407603	610.122053345069	21	1	20			119	0.0490583372271439	0.0486553809832105
PM312.1287T452	312.128716763216	312.128471500592	312.128994751906	452.352907670344	451.384687353916	454.747717850152	42	6	36	[51][M+1]-		2	0.0434596595914042	-0.00165941008223411
PM313.2721T547	313.27209361414	313.271863104174	313.272283029205	547.304246166176	541.479098275245	556.754795892328	42	6	36			27	0.0543382131287773	-0.00392475712127823
PM313.1201T452	313.120073590328	313.119594582405	313.120612969728	452.103940750943	450.8592564902	453.106316994966	22	3	19	[51][M+2]-		2	0.0433317204404547	-0.00431642102504992
PM313.2721T357	313.272062477783	313.271913087651	313.272355755268	356.900861413388	341.735821626943	369.975732802521	30	3	27			69	-0.0517214484269571	0.0302160178920641
PM315.1261T639	315.126078309735	315.12588418666	315.126256284706	639.015410951506	634.365648130339	643.35107021844	21	3	18			123	-0.0361641788139185	0.0505448693615062
PM317.0972T278	317.09722974034	317.06105462146	317.097861157252	278.183251192218	228.496531331033	334.418259225855	32	3	18			264	0.0448877746170807	0.0232687362995904
PM317.2064T60	317.206445208979	317.118118070671	317.206722510851	60.3787473881022	56.216352469263	67.2801243679167	20	0	20			269	-0.00865986383330627	0.0830255969449957
PM319.1128T207	319.11279534078	319.112514572349	319.113280917546	206.721682902854	199.026955137373	222.307336789565	32	6	26			271	0.0547536717829907	-0.0254686727614055
PM320.8641T284	320.864070125699	320.863998409354	320.864222240188	283.685069966464	276.105327181038	284.925191081169	7	3	4			181	0.036160305764821	-0.0228565812311394
PM321.1135T608	321.113489748161	321.112975453651	321.113674155183	607.614859348984	603.570032630135	611.592757562824	30	4	26			195	0.0507160510361828	0.0329966259781848
PM321.0957T382	321.095695460127	321.095483713195	321.128249466983	381.527587190859	349.621236794105	407.329420447618	22	3	15			103	0.0136490646929609	0.0651379836218388
PM322.111T498	322.111018686147	322.086912823839	322.111180245158	497.885341455424	440.118419023078	501.011339043716	23	3	20			234	0.0066484871416731	0.0717988556960335
PM323.0718T669	323.071758821971	323.071639948964	323.171071584675	668.770892279403	663.43219504981	748.798452112044	17	3	14			202	0.0582402134063318	-0.0165833175859618
PM323.0507T278	323.050703482737	323.05050530385	323.122654749074	277.852916042261	268.185562497222	363.838997665569	16	3	13			88	0.056318707747771	-0.0232263912155016
PM325.111T732	325.110961944237	325.110334036636	325.112220064077	732.001078014997	730.061036663494	737.930225387155	37	4	33			15	-0.00947028919480117	0.0220714422532107
PM325.1375T496	325.137460814194	325.08611942632	325.235309356511	496.298980881368	458.69758706239	526.755552128469	20	3	14			233	0.0368369263206468	0.0228817287255451
PM327.0457T287	327.045721882038	327.04556149071	327.045851424756	286.824985561254	280.771279523666	301.774565546913	15	3	12			221	0.059734736094575	-0.00885875145519456
PM327.0667T499	327.066680663763	327.066388006293	327.120033167232	499.328841535974	494.573042499909	532.151777529573	40	6	33			58	0.0536807399656729	-0.00738174231519893
PM332.9319T906	332.931862850824	332.931706719122	332.932326170805	906.297428353512	904.480021079198	907.308950507572	20	3	17			14	0.0587044554117362	0.000921452985502792
PM333.1139T526	333.113899484653	333.084326376839	333.135484149168	525.674783266226	520.373817080893	660.573887555784	35	4	29			156	0.0529219186201698	0.0316188737510767
PM334.8715T186	334.871510150931	334.871367571673	334.871809056557	185.848999517908	177.802074895588	210.444707675055	21	4	17			36	-0.0297895662055249	-0.052347756857461
PM335.1084T239	335.108438518449	335.107934878309	335.109167274231	238.838517951201	227.675011332873	279.679070459128	25	3	22			108	0.0567536176429561	-0.0123625905315715
PM335.0622T835	335.062227013052	335.062097956287	335.062308242974	834.757096400939	831.370831925938	836.61426018713	14	3	11			38	0.0592155107549895	-0.00522452430347775
PM335.2562T360	335.256161848853	335.059106634389	335.256561602681	359.761558735965	341.735821626943	388.760131256291	34	3	27			216	-0.0478082337086778	0.00756227218966804
PM335.2563T556	335.256328375842	335.255728500346	335.256489732732	555.581931417994	547.499388606789	556.762008907606	11	3	8			75	0.0473960219050833	-0.0309228612564778
PM335.2178T68	335.217777744227	335.180936166658	335.255778541961	68.3989300291898	60.5565875011633	71.3569072153079	9	3	6			167	-0.0407865275964691	0.0275222340379215
PM337.1088T718	337.108793913634	337.108342968869	337.109259146133	718.150649678045	716.378066731064	723.492490288297	42	6	36		[M+Cl]- 302.133	22	0.0515317289452206	0.0223181437059917
PM337.088T610	337.087983167917	337.087733206092	337.107667936417	609.819561493472	603.945225996482	642.33409573789	31	4	27			195	0.0571426408353829	-0.00298522055575248
PM337.2721T364	337.272094009085	337.069921093362	337.272638035978	363.695241333215	348.641620799818	407.21348576332	41	5	32			216	0.0520917286163934	0.0150213930218842
PM337.2721T471	337.272074932455	337.271850049197	337.272358514594	470.79686479209	469.036554548241	474.17594284814	17	5	12			272	0.0545844493537981	-0.0370219282427347
PM338.1219T494	338.121867227282	338.121656339732	338.122056568867	493.622288006508	489.841767256449	497.947439906392	23	3	20			270	0.0591945788757487	-0.00279891286568395
PM338.34T64	338.340020244574	338.339723245357	338.34015385577	64.0215649216515	62.0244092750631	68.2853602605353	8	3	5			137	0.00407823495851926	-0.00910720364594979
PM339.0454T436	339.045397575972	339.045206834859	339.045545593872	436.31929053776	419.658899957097	441.045467710136	14	3	11			118	0.057467143016979	0.0017700296934211
PM339.1242T495	339.124177725492	339.124007513327	339.287089366289	494.555890332429	363.095451915226	497.947439906392	17	3	14			235	0.0276046294400924	0.0472860233258596
PM343.0404T501	343.040363810173	343.040294485206	343.040504424381	500.774768380317	498.961735810485	503.365580366947	14	3	11			58	0.0586335065485988	-0.0143827809434165
PM344.0509T291	344.0508821234	344.050681528581	344.051039668223	291.089289533591	286.165429964909	337.851942784943	18	3	15			59	0.0517625563481963	-0.00555912457569326
PM347.0625T632	347.062513811393	347.062418708493	347.092502145026	632.351118390934	629.081991969745	730.539285052435	15	3	12			45	0.0262130566289188	0.0583076238454075
PM348.0683T997	348.068308450621	348.068198415265	348.068451485373	997.285058538571	995.559641232861	999.161364685694	13	3	10			70	0.0595960625516317	-0.00402212454765872
PM349.2284T853	349.228395929845	349.228182742065	349.228913790848	853.420273355846	851.383117313941	855.1382689568	39	6	33		[M-H]- 350.236	4	0.0581295189803878	0.00500927148299741
PM349.0875T478	349.087461271975	349.086957276479	349.235384407558	477.912143901037	398.367644943451	525.36178064549	30	4	22			236	0.0285043769373651	0.00261790786817004
PM353.2664T452	353.266389081919	353.132637400332	353.266665491655	452.045779107518	345.059240940313	453.892187519169	31	5	26			125	0.0521206354613619	-0.0429114600798597
PM355.1155T413	355.115495227228	355.097761243016	355.116998554157	412.622848502783	332.188292782008	429.750039848963	23	2	19			212	-0.0363809337175516	0.00545437877510208
PM358.0881T319	358.088102991882	358.087956108472	358.111278969055	318.751998206635	312.60441190981	368.875995429907	18	3	15			144	0.0577851823301984	-0.0147886808880059
PM360.1483T732	360.14834538166	360.148134438067	360.148662971263	731.753980065251	730.825685878214	734.649443416819	42	6	36	[52][M]-		15	-0.0136120547665635	0.0313970864704507
PM360.831T316	360.831034336264	360.830910056056	360.831134797756	315.968231171166	311.210235343156	324.418274822389	11	3	8			145	0.0561694383061508	-0.0229812569054939
PM361.1515T731	361.151536038273	361.151305931883	361.151775688467	731.467092139837	730.061036663494	734.649443416819	21	3	18	[52][M+1]-		15	-0.0161245409303024	0.0307149843112148
PM365.1028T732	365.102785646642	365.102546895714	365.103125496094	731.811369772613	730.665106186982	734.649443416819	42	6	36	[53][M]-	[3M+Cl]- 110.038 [2M-2H+K]- 164.073	15	0.00781984862775182	0.0584233821352153
PM365.1183T367	365.118277971499	365.064476117498	365.118814916039	366.615974688794	335.185410150518	377.545383157509	28	3	24			224	-0.00615197813384455	-0.00677138186458511
PM366.1063T732	366.106331160258	366.106107173525	366.106676420773	731.811369772613	730.354826393054	734.649443416819	42	6	36	[53][M+1]-		15	0.00771492833765479	0.0593665290777804
PM367.1079T732	367.107908510263	367.107687506413	367.108218018445	731.96771952327	730.825685878214	734.649443416819	42	6	36	[53][M+2]-		15	0.00773618310158815	0.0603694242957077
PM369.0767T378	369.076719677009	369.076553022379	369.077509463085	378.240911179705	369.48545543096	388.552431270913	21	3	18			183	-0.0286654231264929	-0.0247934608851324
PM371.2104T854	371.210375660354	371.209864872915	371.21068937406	854.306315532779	851.685124577272	855.600606911538	21	3	18		[M-2H+Na]- 350.236	4	0.00864988920562519	-0.00258333583187154
PM373.1255T428	373.125523127492	373.125027898336	373.126406737379	428.138949811743	402.99888222872	431.548950784546	35	6	29			268	0.0232425998356338	-0.0443221130225657
PM373.8823T266	373.882270594502	373.882186119712	373.882454576813	265.930928456145	256.845107569925	269.377821913106	10	3	7			208	0.0588279571070517	-0.00511735913142517
PM374.0616T213	374.061575714586	374.061467762536	374.06172314298	212.815668497392	208.023590598921	216.725936999524	12	3	9			82	0.0569437119770713	-0.0226856872570415
PM381.0774T732	381.077383237014	381.077168475576	381.077620321502	731.920207862561	730.322911979268	735.310254373359	42	6	36	[54][M]-		15	0.0566396551345156	0.0126426052784025
PM381.0927T360	381.092677611906	381.092482115979	381.093148868548	359.716741484882	318.742429189663	372.136688606321	41	6	35			50	0.0522461440343243	-0.0269345847009084
PM382.081T731	382.080958289329	382.080839324148	382.081198026134	731.001072622626	730.117656666244	732.607231616803	16	3	13	[54][M+1]-		15	0.0578092103090128	0.0141342214844261
PM391.1187T451	391.118672265816	391.11842388081	391.118833740984	450.899495830141	442.937309079475	452.353587329101	37	6	31		[M-H]- 392.126	18	0.0563290716369333	0.0149134154261633
PM393.1329T279	393.132883274138	393.131833516581	393.133052792237	278.775615019794	270.477349981228	290.769981844506	11	3	8			88	0.049430007889762	-0.0215074552322187
PM398.8066T314	398.806568347507	398.80636404571	398.806888266929	313.622531497291	312.60441190981	322.903903772714	12	3	9			246	0.0535179846813364	-0.0281841866915259
PM401.1767T339	401.176738356038	401.154605296153	401.177175836044	339.17238735915	323.226808505357	444.309327582147	21	3	17			37	-0.0319718385882246	0.0395934960669432
PM404.8258T282	404.825792904367	404.825476163967	404.826229198274	282.082776025101	276.105327181038	292.229317563815	13	3	10			182	0.045274489087529	-0.0169494295185114
PM409.1088T349	409.108767919021	409.10852754731	409.109076503893	349.451164132074	332.429930971564	363.676440034941	30	3	27			17	-0.0278273311371912	0.0136829678203435
PM411.1035T294	411.103537294693	411.103397478964	411.103663418565	293.952443979698	291.783527577322	296.180769816268	12	3	9			245	0.0536659795342013	-0.0272995676842451
PM413.1007T451	413.100671209659	413.100495100201	413.10077868498	450.68576166	442.937309079475	452.623857288585	21	3	18	[55][M]-	[M-2H+Na]- 392.126	18	0.0410458850975868	0.0366885399953762
PM414.1036T450	414.103629166434	414.103547607293	414.103801815415	450.448354648086	445.428318325301	451.914534027367	9	3	6	[55][M+1]-		18	0.0402661320234909	0.0371427241082555
PM425.0835T336	425.083450113112	425.083181202323	425.156399240055	336.378924113412	265.577566069019	363.676440034941	57	6	36			199	0.0557862380799817	-0.010671914711791
PM426.0868T311	426.086797709339	426.086652342367	426.087100820158	311.183406590495	309.683170892195	359.089572879823	15	3	12			231	0.057214426634896	-0.0179738308098552
PM427.0821T311	427.082080137046	427.081936941249	427.082363620426	311.183406590495	309.683170892195	349.389108023638	15	3	12			232	0.05733750270478	-0.0148527536552615
PM433.1112T467	433.111195114458	433.110827516443	433.233305760767	466.568131363457	463.412668050964	518.476872458115	19	3	16			265	0.0565992480780723	-0.000638944417125253
PM439.1408T814	439.140846496826	439.140635739002	439.141103731654	814.240660350949	806.141166120034	816.878827436409	42	6	36			257	0.0486044791415579	0.0155317656328458
PM457.11T217	457.110029291395	457.109743855624	457.110387716416	217.218483573745	211.023458301073	255.981958475094	21	3	18	[56][M]-		34	0.05609954586353	-0.0206020250679776
PM458.1135T216	458.113470845778	458.113329446626	458.113653151421	215.720339986391	211.023458301073	219.57588078802	12	3	9	[56][M+1]-		34	0.0559836161710005	-0.0217105974786279
PM459.1103T216	459.110315716503	459.110205110711	459.110530417643	215.720339986391	211.023458301073	218.656581801493	12	3	9	[56][M+2]-		34	0.0561036359156438	-0.021752451949044
PM502.7971T179	502.797058335704	502.796793711311	502.79727389364	179.064868649209	177.159574693039	210.444707675055	19	3	16			114	-0.0199756659172565	-0.0596208330741416
PM525.2471T250	525.247076458295	525.246862571979	525.247406373225	250.129232026204	235.001036256592	263.818653027253	25	4	21			83	0.0450290842360949	-0.0471812364659926
PM539.2272T274	539.227182820063	539.226859394948	539.22757005406	274.350767000669	256.766046395141	315.898974334959	28	6	22			250	0.0554146656371461	-0.0258157310912879
PM539.29T546	539.289953303755	539.289296088193	539.290505731388	545.894258025114	541.479098275245	549.999861545653	21	3	18			27	0.0537963982031292	-0.00846888834417889
PM549.4901T514	549.490125135394	549.489879581993	549.490892076445	514.416576260551	508.435954862488	517.343260771995	16	3	13			85	0.0497678227844875	-0.0100081317327674
PM571.4705T508	571.470478219374	571.470063783515	571.470800340619	507.796555501493	501.048579860775	515.245325332113	40	6	34			51	0.047130248692787	-0.0442801034919346
PM572.474T513	572.473978801496	572.473792800662	572.474246664069	513.220200220798	509.668375857683	515.245325332113	12	3	9			85	0.0467844115485584	-0.0456051409306958
PM573.4856T507	573.485578780153	573.485095067166	573.486304162155	507.350537395682	419.637916810122	515.245325332113	40	6	33			51	0.0530988646444693	-0.0302550480635436
PM573.4863T628	573.486264657619	573.485801171512	573.486794613518	628.001732840107	623.923637887049	635.182414952244	36	6	30			68	0.0539313403483258	-0.0179524420215349
PM574.4895T513	574.489521061466	574.489350424315	574.489757180088	512.527945260961	509.668375857683	515.245325332113	12	3	9			63	0.0531435440776572	-0.030131208631655
PM575.5018T627	575.501806574105	575.501340854931	575.502364659176	626.906249435688	622.224531282191	634.195716570131	41	6	35	[57][M]-		68	0.0533634201357027	-0.028818406605719
PM575.5019T418	575.501856283009	575.501588074267	575.502221562174	418.242599511995	397.405536537433	420.894025755117	24	3	21			178	0.00364005311267052	-0.0772831399905874
PM575.5015T510	575.501471501434	575.501187164458	575.501736246993	510.224572866865	502.909440474868	514.332904520497	20	6	14			63	0.0519587606134583	-0.042425771385414
PM576.5053T627	576.505343297393	576.505122025599	576.505899298912	626.667740131564	623.184757150059	634.195716570131	22	5	17	[57][M+1]-		68	0.0523493105001795	-0.0295118437152424
PM577.5172T506	577.51715208039	577.516760881253	577.517585416469	506.291144671125	502.909440474868	513.412592312723	30	6	24			51	0.0519172209530963	-0.0351314497742861
PM585.4506T70	585.450600174394	585.450403870976	585.45099366234	70.0157294193801	68.5500590597373	71.7259904231307	27	6	21	[58][M]-		21	0.0277735690435513	-0.0676662247586186
PM586.4542T71	586.454179403718	586.453873826474	586.454453578689	70.6046732903446	69.3792930919461	71.8413896332002	11	3	8	[58][M+1]-		21	0.0261583661158055	-0.0692338642464518
PM593.2755T65	593.275495325991	593.275065915759	593.275639188995	65.3837318753284	61.9127958394236	67.7295182208533	13	3	10			7	0.0560297009324119	-0.0175664827268132
PM595.1657T510	595.165653030308	595.165386776644	595.165978717154	510.108375092897	504.536119725666	514.332904520497	38	6	32	[59][M]-	[M-H]- 596.172	63	0.0574274528224458	-0.00943853751698537
PM596.1691T512	596.169126590506	596.168969955981	596.169430835121	512.232610135127	507.847320737325	514.332904520497	17	3	14	[59][M+1]-		63	0.0573291816984385	-0.00989281752837279
PM597.4877T415	597.487715318305	597.487445323418	597.488058741546	415.183093203147	389.190378538545	418.491093834947	25	4	21			101	0.0181877067679396	-0.0562279936030052
PM599.5033T413	599.50334799944	599.503038321245	599.50384354833	413.084631609731	370.352950989444	417.714771999177	33	6	27			213	0.00979383107866538	-0.071672293616604
PM611.1553T585	611.155323232825	611.154917613617	611.156237257448	585.139937087035	579.587384018097	590.256569878205	33	6	27			262	0.0558760488479109	-0.0225920829294149
PM613.4776T356	613.477581869617	613.477101247499	613.478498231106	355.87568978695	341.735821626943	365.110162037924	20	1	19			69	-0.0497144209724607	0.00908778178662927
PM617.1432T512	617.143238363122	617.142303935153	617.143594267041	511.860792004069	509.697543904161	514.628762388813	24	4	20		[M-2H+Na]- 596.172	63	0.0455531179500175	0.0322353456230065
PM627.6784T327	627.678362226259	627.67824130822	627.678414877643	326.847917183391	322.188147206559	330.747189332227	5	3	2			146	0.0433409261749328	-0.0109949006292789
PM629.6769T327	629.676886768378	629.676857032351	629.67741202344	326.847917183391	322.188147206559	330.747189332227	5	3	2			147	0.0431169590658257	-0.0108116997052315
PM633.1394T590	633.139407754466	633.139196899596	633.139683995174	589.707370640697	585.031985131068	591.175936325245	16	3	13			35	0.0516735022825144	-0.00205530694591814
PM695.4577T415	695.457716851799	695.456533889381	695.458285547787	414.917655188082	375.596342281939	419.265701362338	24	6	18			101	0.000213732618531975	-0.0793326893309046
PM697.4735T407	697.473492475438	697.472731407258	697.473923636744	406.674077544716	387.396520938948	416.512435891268	12	3	9			153	-0.0102857387970766	-0.0824224069502187
PM711.6391T327	711.639053761571	711.638913261776	711.639522061644	326.847917183391	322.800723647286	330.747189332227	5	3	2			148	0.0441979933570736	-0.0120830227909165