X469	X68	X190	X7	X42	X36	X124	X118	X45	X44	X204	X237	X435	X94	X189	X333	X268	X187	X439	X304	X382	X70	X287	X404	X169	X182	X143	X482	X448	X213	X98	X394	X258	X291	X378	X131	X208	X28	X373	X257	X369	X171	X416	X19	X499	X234	X111	X175	X454	X210	X399	X281	X235	X219	X221	X481	X391	X292	X474	X59	X207	X17	X200	X354	X245	X35	X264	X27	X471	X85	X212	X247	X358	X356	X412	X365	X457	X55	X288	X392	X398	X349	X158	X13	X325	X119	X108	X413	X113	X62	X421	X125	X65	X276	X273	X402	X66	X246	X496	X455	X146	X266	X129	X211	X29	X465	X91	X82	X181	X214	X176	X144	X446	X363	X260	X357	X279	X145	X34	X261	X408	X388	X39	X463	X401	X321	X443	X243	X18	X23	X57	X296	X495	X262	X332	X371	X253	X242	X186	X25	X476	X152	X1	X459	X238	X397	X224	X30	X415	X41	X150	X61	X431	X366	X423	X452	X449	X151	X95	X470	X165	X173	X184	X93	X420	X179	X362	X361	X456	X335	X2	X201	X12	X419	X52	X324	X172	X301	X185	X472	X428	X75	X47	X83	X53	X84	X178	X106	X32	X491	X160	X159	X11	X122	X375	X102	X232	X492	X393	X289	X305	X254	X390	X167	X80	X328	X345	X20	X147	X49	X226	X370	X424	X202	X197	X312	X133	X307	X227	X405	X251	X128	X493	X498	X105	X60	X222	X199	X450	X406	X101	X497	X270	X109	X473	X306	X340	X432	X484	X248	X475	X16	X229	X73	X411	X441	X74	X318	X120	X135	X225	X180	X130	X50	X310	X490	X97	X337	X228	X126	X294	X480	X327	X43	X434	X191	X116	X174	X100	X311	X117	X153	X309	X170	X37	X350	X353	X319	X360	X384	X436	X344	X134	X127	X274	X38	X157	X87	X343	X72	X341	X467	X433	X387	X218	X4	X302	X64	X188	X67
sp1	0.832941518605309	0.607540513679867	0.433977477325749	0.432653718078073	0.657968971977867	1.26583491219535	0.687676373032564	0.879402872882411	0.445657446980929	0.905346739661833	0.467694497090805	1.11920823922569	0.569829719509085	1.02147406492255	1.00326211994957	0.560880539352532	0.776901895854174	0.691768678793953	1.06025418361716	0.899347500282701	0.643121078793752	1.12634465142133	0.961529914473751	0.392233574418449	1.1207658177679	0.810610882548785	1.02562360286156	0.835410773354534	0.52402802498031	0.694530364130404	0.379721253009775	1.07600949195151	0.597483594074847	1.31411143411638	0.933792808178321	0.773523395044666	0.798113046279905	0.636698264376076	1.15722937323336	0.760069287256952	1.05563145284847	0.956206857242526	0.536540276485879	0.986857064892888	0.548240976283287	0.863174776321612	0.905777953810912	1.116711389382	1.32392048820076	0.673527373111435	0.633394130731403	0.397936680661367	0.684771265936851	1.02137136189184	0.927937180616933	0.762006723747686	0.293421034281487	0.400035983320247	0.37134458142478	0.795510738454895	0.294914203288887	0.386739250397433	0.771434559852085	1.23408216570774	0.811738460084536	0.259875009074915	0.930831759808787	0.359224869653523	0.846722236807241	0.705710628182991	0.963003848329713	0.932928720614254	0.670762461402249	0.483741568778573	0.73707236180261	0.696468653833188	1.22812303121861	0.364723191171481	0.678939237402428	0.683144806297556	1.16036975586263	0.613836273513957	1.08293373331035	0.370451614054245	0.567648314317602	1.16842230085785	0.828770059157844	1.19386498745905	1.12325674938656	0.641572519095333	0.874877827118067	0.799813439430384	1.11762285742943	0.651023291301568	0.647914116526045	0.841410585429923	0.403299094637178	0.597213884492273	1.00143244699596	0.456436671680817	1.03406165004637	1.20936822666846	0.672599900187805	1.04472571174393	0.334440214740607	0.838893367123067	0.746274599788643	0.791484382566666	0.440869751804386	0.45797299076786	0.73465046589051	0.618334451175391	0.701977045135581	1.04721057610964	0.642655652688492	0.580439872433018	1.10520130992969	0.751833174175348	1.14918881785142	0.606664095964	1.08303122487123	1.20495597548374	1.03486545996839	0.463187658847781	1.00889023534807	0.550833356962104	0.600648806810005	1.17393704271341	0.786069437161803	0.440092732313743	0.985871625896841	0.772120311120331	0.557247131353947	0.389905447757186	0.668531317407141	0.339831122601556	0.400504147437731	0.604856143719164	0.50104212251223	0.539505277796892	0.55323093816593	1.03959949276271	1.12863460972173	0.908987727660335	0.925664326500894	0.356802400667295	1.22686132339354	1.05119898271144	0.84326606521939	0.467386877195433	1.25449494160684	0.850683188793569	0.83209515183606	1.22389891404723	0.760246593308287	0.640024373327462	1.12499935681725	1.0217246548868	0.610990941607821	0.510598190138606	0.515832569334174	0.774311311286365	0.773183955507965	0.609653318317302	1.11991222217132	0.911877461067143	0.977903516665241	0.562964183631584	1.3190814366458	0.88332014070481	1.01788623551906	0.453398628400521	0.899510414425541	0.70506308986691	1.08595613225713	0.399993510435259	0.475877144360268	1.10380142673322	0.802691156256886	1.16995358266697	0.507087505213909	0.822227174844746	0.285912107392243	0.548946595541044	1.00404390843698	1.26199518564847	0.582398703885095	1.15032846163228	1.26225506095731	0.654894412376663	0.550772385524472	0.634478437991126	0.740837618520385	1.12606076674834	0.702502114861904	0.779912875254504	1.24833066278976	0.557945982327316	0.774230644576166	0.329019784013482	0.304313317209328	1.0610412986967	1.21435536096005	0.888426631561699	0.703242736594848	1.04042449924768	0.882483700175036	0.581023149791189	0.999902215397182	1.17370165582679	1.07143866268409	0.872770243269704	1.16994197769484	0.895019976482143	0.854731538534112	0.291726082108444	1.15539400319608	1.10540824335945	0.865130601396326	0.798274798504908	1.18125181965329	0.56748569781634	0.446061277033656	0.936048751044244	0.566712194479031	0.208347027641569	0.779533970804533	1.015784002326	0.611911930091127	0.760156638771543	0.999757319791027	0.523341559406561	0.350237317419165	0.942866072693072	0.475962183633381	0.461065470252511	0.652948815247137	0.721037640484678	0.727375284670939	0.656942303813829	0.265533043388331	1.10455179226875	0.506388656894642	0.736971708041239	0.490588769638365	1.30363497981705	0.368669348945938	0.775010927244557	1.14329877997081	0.944578656178266	1.03516005205221	0.989627154196188	0.835920077362107	0.510583504683418	0.746003407212218	0.997664525345468	0.560564152722133	1.28851612825092	0.970629019136413	0.907560229404236	0.674189695152646	0.941954298501091	0.933603982091457	0.966973064787565	0.969757940234364	0.937625058939793	1.07656414759013	0.818223741065002	0.896725611941638	1.01955892344433	1.19407609731974	1.18688406867821	0.565043961392432	0.654662468467249	0.610870551342903	0.653575367876253	1.04771618469116	0.727908425173697	0.909051447077399	1.23678448700564	1.26456308105172	0.381971161348405	0.682920064637289	1.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sp2	1.0254343024823	1.20717079803962	0.624039810163762	1.12781732291716	0.588596962356724	0.385823372143574	0.992399629612578	0.583713466943657	0.668329397974626	0.67718132712651	0.541554336984159	0.46203337429325	0.242929261856234	0.609792450728337	0.312385601975302	0.794521717769692	0.445695680647926	0.749104449515231	0.77519486111419	0.324384370310139	0.58476359477087	0.893392357220887	0.272484563035663	0.581972810795237	0.354834787122951	1.09093893484511	0.953224039537943	0.863193217518384	0.427979996948581	0.928123745928799	0.442951748474306	0.9023598370917	0.600756403510153	0.875297696345833	0.698198558100018	0.582275978462687	0.79996036805588	0.393734749587091	0.533546677686603	0.582102946228478	0.84371902507125	0.32450499746818	0.354553146189321	1.01917565243472	0.737730253228896	0.390969557440908	0.662441629053663	0.876331818342706	1.11614995816458	1.16495486243983	0.862120180728087	0.945817817814972	0.690836113236457	0.901033517478636	0.746699106402338	0.904625277099945	0.419440610589149	0.647177562160899	0.619587258015774	0.305814971415411	0.488190293416798	1.05990327503365	0.459242932837329	0.667369943729881	0.746621652759854	0.655193862962372	0.965384917280983	0.685398355383862	0.33927845167873	0.261798156141037	0.856805922125048	0.812999718650456	0.707259943469181	0.678326613764977	0.946375501603937	0.475216351634821	0.410941337434418	0.328019280006799	0.857845872324925	0.741484249321956	0.433157976085331	0.946545540935077	0.61782648626243	0.611273407747022	0.767980286108035	0.955289265362306	1.03961862700732	0.653310213601265	0.416114921539741	0.585702235313156	0.386654222311942	0.61592285773341	0.391806462118151	0.419166285328505	0.540715058087645	0.403718717494703	0.773838475240782	0.993817893237025	0.405737183652388	0.147569218499346	0.315688208903292	0.548664598728635	0.305466555892592	1.0468871505228	0.643388564540752	0.735772257349599	1.06270279926071	1.05885480204546	0.740950783990687	0.717396584840394	0.248275078247744	1.00942020920362	0.877622527906119	0.988496382324928	0.799506814259759	1.03833760952697	0.114520260714812	0.477448752258173	0.940988478733918	0.397938575293993	0.395116228919475	0.346880621449287	0.683284895893849	0.780049652194975	0.35683144393326	0.305899771834888	0.950340546835151	0.628425036398896	0.728707955771046	0.486907286247216	0.476797463245019	0.326693944587433	0.778087510728875	0.826032401882923	0.192474846853924	0.276972091479293	0.537527419224118	0.365033144349266	0.270861742691462	0.0534898659396099	0.373128084434827	0.232902004997345	0.986385077044815	0.662514225386366	0.484027789299887	0.689080055615527	0.413350825184212	0.603851644486104	0.237556429164132	0.660827643060349	0.833350062460677	1.0948001023333	0.296293610116798	0.921927952671453	0.508844968385086	1.05421244770889	0.383921596862691	0.608454311456192	1.00605128996785	0.258618044104416	0.787423977014674	0.890087080324792	1.08075745158633	0.43067140646923	0.233950717181148	0.36009035480317	0.8466671479597	0.9301368144572	1.00492740400021	0.449042683608737	0.334772250724565	0.852012519832376	0.651808733488504	0.417625063284212	0.322030244637013	0.515679773417245	0.905544749204464	0.923464860656361	1.05267440970877	0.336483880706967	0.778595983148661	0.416365074346118	0.353099353478595	0.5629973511111	0.192474288500828	0.771212856223721	0.975281086480738	0.899460481945319	0.811714414090422	0.469761895753941	1.10278902619257	0.773173362355665	0.32479674264399	0.663504840212202	0.824524723750871	0.843695356949257	0.518072485605482	0.559637605442377	0.954088072847064	1.04022778648382	0.820440670397	0.507798150235627	0.681677172746288	0.96461618923706	0.835635584408585	0.590916148285877	1.07625229968757	0.877546529546293	0.683438583370513	0.969039181072535	0.53228333727424	0.225961824698216	0.437203183639113	0.496203124251827	1.1442724824605	0.302034426795914	0.552406416935283	0.600683265625191	0.536358485198062	0.271028044734992	1.05263119914901	0.914009097858519	0.216581788022597	0.664965074501914	0.71052125214882	0.404658545800382	0.847573997783824	0.420131423465135	0.506689005181482	0.992911415677991	1.03190985241628	0.136165416365035	0.425012905637335	0.883671909665347	0.452116741943246	0.315874792549886	0.88029014058609	0.925737191775341	0.391520321624846	0.808056869746769	0.305798968500978	0.848928925812086	0.958126140323928	0.364982901407848	0.252723135040782	0.622725972790467	0.955638443919904	1.01204275739838	0.87843393549594	0.52400916954672	0.502480618414326	0.914073871276151	0.145290916499709	0.907086003766722	0.991813153968939	0.943072291504143	0.653084558022064	1.06508721129398	0.389964003570184	1.0105799401037	0.654403965313315	0.149536280569346	0.446526805636814	1.0767921001626	0.162197046996498	0.701594977216191	1.13013762607545	0.406954910175107	0.689187766327994	0.520632488020024	0.575206005540473	0.572557781276541	0.440045899435959	0.392442560939275	0.802881143565801	0.468355419963639	0.644975744740207	0.629011360005381	0.765346573037047	0.721232725337643	0.753266955892802	1.043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sp3	0.5728143703221	0.768131975829584	0.841207130538398	0.806553654116906	0.146006529434612	0.311407559781663	0.133771106163797	0.0193979865004385	0.612018737108185	0.883765385569049	0.401646309979856	0.529782594192516	0.293696335055681	1.05826367111073	0.968214908421628	0.58548039248823	0.530750695452847	0.640717406343828	0.693892586423283	0.349161634696517	0.0550081569542246	0.12515643779589	0.233172659149097	0.755513402228547	0.578305187520802	0.799673647890369	0.687256329673129	0.15580710465352	0.538051964140937	0.700814018107876	0.468262258539228	2.9071945691538e-07	0.241817218039076	9.29215449622958e-07	0.0363046181653037	0.706458832932997	0.606879514352234	0.642501854523501	0.530976075383393	0.583514917672141	0.290666521620812	1.03736380115588	0.340524271443933	1.9337905332248e-05	0.436358916695749	0.175809705092053	0.829927127924269	0.830094638529636	0.61070119668034	0.606285135676014	0.407390182585127	0.397981370489465	0.326419687735042	0.199467176631095	0.519868286805375	0.718400923385725	0.597138412742706	0.888298424575773	0.897366826634568	0.468838726962169	0.493441965925041	0.511087448626007	0.906413101810506	0.0961678826534717	0.197702898939679	0.262025061701302	0.485586257254968	0.651044041805403	0.495582032075047	0.669657153783187	0.0444222073564933	0.350062832511532	0.626769946484579	0.453729140816699	0.459090031634102	0.688306271885059	0.962363415034588	0.321884182343676	0.0727037004420441	0.179679212819635	0.422211192953336	2.30121728665135e-06	0.695120907755147	0.550597002072037	0.469202333702308	0.097658548050756	0.511799441035286	0.162384763626757	0.186313303011402	0.66665239013726	0.445499521647674	8.68806971933755e-06	0.0747822072950082	0.448041338060882	0.8271590854644	0.781335029854564	0.0394720258004902	0.433675308233693	0.515961168701292	0.152079595584743	0.639828060725726	0.635056040156821	0.100601950230588	0.748567737558295	0.323918994224967	0.40941965113413	0.33273754550345	0.76110917996737	0.223985197294491	0.479286062084483	0.894038189343539	0.36608772892199	0.630742545869019	0.307550636883482	0.814322557133631	0.686378340297114	0.0889501807456628	0.378717079088436	0.741973374757845	0.281705791152792	0.495967817678993	0.173457692791735	0.591817754493335	0.563737746305341	0.330441717329856	0.349772033379107	0.166976618241199	0.509154431600641	9.46049086489162e-05	0.324697938477136	0.344825352784604	0.663106710902959	0.465743094885956	0.791303767415429	0.892387524434559	0.607926985505375	0.513823688989711	0.152121786038474	0.867278388491671	0.118196640683848	0.579856099163284	0.140951227031034	0.585648946198458	0.166933170461298	0.768161013405332	0.627169410077881	0.64433347864467	0.635465329741761	0.583325796603095	0.900624597172214	0.749202020292076	0.375605237799841	0.544545859549423	0.397144963229864	0.638683317094351	0.340515516352697	0.330711653050527	0.000857438301287808	0.137723789031833	0.780285067669906	0.00235470030939726	0.328508390520985	0.600254513793339	0.468340450489438	0.52355154785395	0.35800839026539	0.596062757045068	2.82167990981078e-06	0.292090905253023	0.456037249108418	0.546497301943838	0.602040791982799	0.555638745504537	0.844923468336507	0.294985035397517	0.794753192989833	0.740405914936052	0.00736416813733095	9.78470985211418e-08	0.449147577981997	0.418216518153609	0.297464547322354	0.751251563139725	0.0989376832528925	0.829701647695636	0.726286456631561	1.45499090779307e-06	0.468068738297527	0.297381927058112	0.253534117050843	0.000560803899347824	0.500104145063036	0.611567457967324	0.802935791891887	0.587929781343255	0.282829766687864	0.703225266824328	0.794086952743118	0.198607464280951	0.521787435565337	0.636102073229085	0.6357120445577	0.0774640884031766	0.517161256346772	0.783825804062522	0.475198133671277	0.403423497132192	0.503072365074147	0.281135853236089	0.000176183280961345	0.00776407457511827	0.339290217946254	0.33319733808294	0.149805374325125	0.797473265172637	0.961094252533713	0.849853866972053	0.772008366554883	0.181959665336775	0.372358580463944	0.809799023983815	0.229491941989802	0.18719259624088	0.0974338579704518	0.694930198018308	0.117709176943816	0.553272436907386	0.475937761501438	0.762904730043928	0.738353712815862	0.556555068010714	0.0798976988182302	0.352665272916094	0.843071311808075	0.191529186617372	0.0687694442565437	0.53352182190304	0.771257269803496	0.549188760225133	0.351943489487144	0.543405358387526	0.414168889101883	0.451347418586186	0.296221644197255	0.780089488586972	0.000991718585374256	0.079604934127557	0.444899432460124	0.417704186412622	0.205842773908405	0.376547818113944	0.203325621097646	0.0304520444076933	0.354735442266694	0.00508987793667654	0.68009435277407	0.480948815886393	0.821190333404126	0.175071142729455	0.824243634602604	0.371421920533652	0.569533412760841	0.871053723286207	0.479652355227477	0.379124450066208	0.761060564653785	0.747074936405541	0.22430332224143	0.818562789405927	0.686073183009799	0.0898971777330385	0.171003040974291	0.777744554923297	0.486521966514978	0.628201391321996	0.84383435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sp6	3.20725296294162e-25	0.0470189815383502	4.57181688334869e-14	0.094398360324119	1.21678906623892e-05	0.167700773766324	0.54053026185404	0.208691083806924	0.0621299461748785	1.63161101132336e-21	0.146053634907946	0.502513502797778	0.300641650820162	0.363702978337796	0.194325916681826	0.0104491161186947	8.12796315002662e-15	0.114585000416696	1.27333797285194e-08	1.09527251587149e-13	1.66717294354045e-15	0.295977268368	2.68313384291835e-14	0.591842123907047	3.02941233973058e-20	7.52552384388579e-21	2.78114553485079e-23	9.64538091521977e-20	3.50315090285923e-15	5.09468040729383e-21	0.648050540712232	5.32436966762135e-16	0.290946596854788	4.57303122184914e-11	6.47763103287665e-10	1.81498599039931e-07	0.00525688944089725	0.19687595172842	0.388252638525084	3.7597917964215e-12	0.380966352959048	0.475901441048376	7.26298591485272e-09	8.9060389615632e-14	5.49919915830288e-18	1.89274624498272e-06	0.454346812140454	0.356101965326048	6.14897601597805e-16	4.78562232327963e-26	6.15899439054314e-11	0.300336183774418	0.000123531824931342	0.405528381610254	0.355627881288041	0.209559822811839	0.163423122495948	8.85798296450824e-10	7.06018841628463e-20	0.270705318649294	7.88966295025754e-11	0.0371783313978102	2.91497711478647e-15	2.33855645161034e-13	8.02556966757263e-05	2.60820036187162e-08	1.21018803952686e-20	3.08863046650952e-09	2.87683596066789e-13	2.85969903186624e-14	0.141890026166173	8.60111219424557e-22	4.6260566458034e-07	0.0451420480153725	0.0490680575366082	0.502251308420629	0.285824831816805	0.497400120903802	0.315275906527577	0.408157117677474	0.273768533543733	0.177294870552993	0.29572548198437	0.147201165061693	0.424543608167536	0.000303020837861967	0.115414792435043	0.307920713510019	0.422927905999297	0.0693749517855896	1.21706086084501e-12	1.02184282167044e-07	0.0619500455843013	0.587748009532145	0.260153477273499	1.21974784789176e-12	0.00853461192411382	0.38116293861549	0.206196184353155	0.0581324907083785	0.525131008285859	0.000243975661736011	0.0234961570408166	0.0273152640456175	0.269262043919156	2.20356741367469e-09	0.360544454715543	0.327503845769804	0.220377447126429	0.36501477369409	4.67423465294112e-18	0.557098215672108	5.80246014478079e-09	0.348742884355628	0.106549929483154	0.478576189773196	1.17053058377351e-10	0.315718771049796	1.09885257453697e-06	0.130693267078661	6.71764770882658e-16	0.465534291134435	0.120910740716847	0.507532679034662	0.525100055778989	1.40870763665689e-11	0.393988910644577	4.49410766503825e-06	0.255739019858293	0.357229610265394	0.440830605878036	0.061221133836948	0.000346177559068545	1.59205806409907e-12	0.000132917769175686	0.17349501293626	0.295667350962361	1.10746443994374e-09	0.60479958683651	1.09550515275481e-07	0.146328439607942	0.458187476872109	0.000993262103965841	1.95419103629977e-08	1.77706211830467e-15	0.427975297743353	0.173793192251826	0.287071315231352	6.43230938882969e-18	4.74404831558394e-12	0.193709529221586	0.00987684167790879	0.272140986053297	0.300181510265532	0.0379728256215622	0.350535549760901	0.539558077555116	0.288508982529355	0.0802229791993413	0.596901941633956	0.178465163588811	0.013479857069768	0.299310110785889	1.34619191663752e-15	0.000212232803093179	0.498241973123767	5.47716836982756e-19	0.0906213019126893	0.044214295410314	0.135614677069759	9.82346293073793e-10	0.255929058735864	0.12340535291431	0.0707736487340077	0.00132407736021933	0.00764171950460193	0.197887032924903	0.352247473539919	1.90073145849974e-10	0.38485627346628	1.00805917255709e-13	0.478725570076301	4.42334434125694e-15	0.597353015741242	2.85749368844764e-17	3.34660136748609e-10	7.83322638546454e-08	0.343418694741942	0.450001207108463	0.000502199689494766	0.15161376452053	0.193901935520524	0.147616083711185	2.29755587967589e-20	0.0431355532957354	1.38427143051117e-09	0.339041679289236	0.0120154918580505	0.260354064323163	0.0335762920015332	0.000362461568753884	3.60080645712347e-17	0.188399166050323	0.42290707525592	0.0786079865079407	0.288310670504265	2.10111618086658e-08	0.454997200399201	0.00138136058091093	0.0758734782478962	0.179998060959255	1.27012444155969e-05	6.22743744251696e-15	0.155244370159126	0.276038669534974	0.148350826025389	2.23717025676091e-17	0.371119314393765	4.05086622519361e-17	0.000631985274420829	5.95800295756158e-19	8.98617716344739e-09	0.010326803049401	1.00109572614257e-07	0.0117074606551065	0.153842807932772	0.197496730701336	0.150536393660329	3.30215790983931e-06	2.41487649201266e-08	0.272336269992045	2.13851561183168e-08	0.158235036322992	0.00259511336234057	5.0968797081848e-07	0.475522464926709	0.364256988640831	1.08953928953129e-05	0.166800854295764	0.535548114230156	7.10540923829522e-10	2.85970825018226e-12	3.20776138826616e-15	9.7385612462298e-07	0.238275830449803	6.57883681121267e-10	0.0410779150118034	2.35752199401724e-08	6.96827120768103e-08	0.373987108008067	9.66356388463221e-16	0.204756667244539	3.7320046593535e-09	1.88053483356406e-16	0.000857370731524418	0.264228573722031	7.55703636710582e-14	0.219733324654216	0.00875856205286	3.20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