X122	X328	X318	X416	X307	X91	X149	X290	X11	X197	X134	X54	X181	X310	X384	X236	X172	X305	X364	X147	X336	X401	X198	X436	X393	X468	X259	X315	X330	X246	X460	X373	X392	X99	X131	X275	X333	X83	X283	X138	X36	X177	X274	X230	X98	X80	X137	X129	X424	X341	X24	X280	X433	X269	X57	X184	X143	X331	X425	X193	X380	X245	X124	X320	X441	X30	X411	X130	X74	X297	X414	X18	X56	X21	X375	X82	X102	X481	X299	X89	X23	X357	X329	X13	X442	X420	X394	X426	X495	X355	X96	X100	X410	X423	X8	X346	X170	X446	X64	X212	X207	X35	X272	X45	X496	X239	X97	X60	X256	X105	X339	X6	X104	X218	X263	X457	X34	X421	X359	X112	X478	X252	X485	X408	X79	X345	X84	X488	X178	X498	X435	X188	X400	X88	X247	X217	X367	X255	X491	X440	X10	X337	X20	X121	X354	X316	X462	X125	X447	X242	X140	X361	X133	X475	X288	X377	X476	X182	X5	X160	X271	X101	X44	X300	X224	X342	X16	X398	X81	X167	X17	X303	X500	X32	X225	X281	X110	X228	X118	X286	X344	X221	X409	X179	X399	X362	X311	X87	X251	X43	X58	X324	X413	X349	X174	X363	X432	X77	X494	X482	X107	X202	X350	X415	X240	X306	X155	X395	X479	X150	X61	X417	X163	X206	X370	X29	X321	X418	X190	X75	X381	X459	X448	X332	X260	X146	X340	X180	X117	X489	X12	X186	X454	X461	X382	X301	X173	X205	X404	X211	X214	X1	X262	X231	X201	X194	X486	X183	X55	X106	X388	X326	X243	X72	X59	X353	X378	X223	X295	X465	X444	X120	X453	X466	X226	X196	X95	X115	X234	X14	X309	X365	X472	X123	X70	X358	X439	X278	X254	X294	X351	X50	X250	X4	X360	X19	X456	X264	X389	X483	X443	X144	X419	X85	X253	X422	X430	X145	X477	X285
sp1	0.145428058961142	0.949350367658922	1.03000951960083	0.290872794437076	0.441140973585876	0.914294981021255	1.03590038447027	0.722809563906056	0.563043722239501	0.777922438437748	0.999570080404713	0.453827278629902	0.0842438757152376	0.643103631582661	0.456360657898865	0.129293208503681	0.610092718756729	0.905175332020928	0.395883102504058	0.554145053440363	0.206798107326855	0.908430814432607	0.676187730208512	0.444963921852902	0.49423896389466	0.468749397859804	0.715061532625171	0.860324209318307	0.662011808794655	0.991310928316483	0.74403815552026	0.761903697298387	0.216880340664737	0.360477290668243	0.0965616786484722	0.167423523985366	0.976057004984763	0.0856411212404834	0.752580571780927	0.514005581793878	0.345482525389508	0.809809712809946	0.371223333755455	0.25449877535546	0.125483126542717	0.323972259154229	0.377728720235847	0.114509130930289	0.962380936927909	0.550691846304315	0.679356595124629	0.164415718063454	0.277159967167432	0.159071983288428	0.11365842530908	0.798014618152384	0.942377180617136	0.486375763507386	0.816030419024648	0.426398261714973	0.822565507660269	0.783174551095579	0.360887856669587	0.199533157609871	0.517475360626205	0.921181610476163	0.53396176263274	0.326600224844743	0.150370529332871	0.55626242354129	0.792981102241741	0.0831199359052106	0.245634869085947	0.829981329939603	0.0749394690395014	0.289815067330219	0.450395073052097	0.158634016575656	0.412258739209094	0.80034606982795	0.140067108726953	0.792620616499378	0.765366740641982	0.422733060383157	0.280718836289462	0.269725343047151	0.667058389729148	0.302523865989096	0.252947162811687	0.812255567771367	0.0706467505556762	0.305258683946153	0.448578416802144	0.701076910692413	0.492377650033154	0.978047116140333	0.251398627751228	0.596045905303727	0.801939355150341	0.876783212295186	0.867206053962826	0.319944988544263	0.769869631868098	0.280218095542591	0.473593748728574	0.96310291029853	0.961355279001561	0.176624112448095	0.969826947453605	0.321212818077901	0.28518277338205	0.0890090874405772	0.369578161018262	0.589013391308487	0.240270357983132	0.674424863144446	0.985878267231855	0.199859816192936	0.843824761507843	0.381742709587982	0.710125064469407	0.394856614510348	0.0950054108739684	0.669913999353834	0.0936255571258734	0.714452578313838	1.02948923654896	0.770207380913365	0.923154693175828	0.399575282863179	0.682777984354346	0.868538960511325	0.23216970020568	0.797270043285922	0.514633910371112	0.936934136465587	0.158651041211814	0.913312260794786	0.779692493017886	0.510753682652016	0.766704229682613	0.780150621365514	0.882817440506895	0.955551111058893	0.137200343834105	0.228405145533183	0.718682099419616	0.853886526205477	0.492171791114112	0.410353634600597	0.437482505338782	1.03935123429868	0.140286427720565	0.692154639652282	0.228482557072608	0.221515146218077	0.617161440641745	0.618657195532345	0.832331365112227	0.228085031553808	0.598201395522512	0.63893764507527	0.93984918518657	0.434285991304228	0.595656061502359	0.388113154297468	0.552842247109843	0.312465802881349	0.469592302313914	0.75749660989696	0.101777244785401	0.1543230499895	0.215501701855642	0.481197028986006	0.201314115930398	0.286321523753792	0.523200828994773	0.0831459755573663	0.761339890816738	0.451300751348495	0.420733640576324	0.423177326162248	0.191847133592287	0.126663120135987	0.521293503505842	0.978760569107508	1.01959655144385	0.983618257125717	0.742735130955405	0.48333956825204	0.327832859802534	0.949219858327313	0.642732096452598	0.302471981050799	0.0721530214473216	0.348762399546083	0.770069340172745	0.69028048377781	0.254717168217811	0.231588425700547	0.275520877774573	1.05433307999595	0.0635720844657278	0.372770519824326	0.498534900212012	0.549488825998743	0.377014970806037	0.772637753281844	0.16745396555444	0.549020283870544	0.722976754731534	0.506399836498805	0.895749915116563	0.754876619365725	0.71412262278459	0.651099884423369	0.9938018644869	0.429136958196572	0.930903295376399	0.928897465209629	0.73687158829824	0.544176785939967	0.250492540435899	0.082658180116694	0.11308052988233	0.265964356752875	0.162422127350618	0.522465052702529	0.472913318611296	0.0326232235096961	0.39956138474514	0.103418808781032	0.750812952344746	0.308609087993029	0.814874609707954	0.344523706848498	0.290826799732749	0.58648838512297	0.518062025294703	0.345020312769116	0.646597124680424	0.953248404582016	0.385044714198917	0.816494635305193	0.339811986264066	0.876076209879599	0.672507185253105	0.980214603835029	0.336630512870331	0.475500147188872	0.194233264393819	0.640091103058864	0.110469343661165	0.157298804872621	0.28738522892989	0.704165169356891	0.505019363895531	0.122163470335696	0.990883958934771	0.768188887708448	0.273288634692184	0.31683416065931	0.984437632153382	0.0460746429767536	0.321757915693652	0.780548940815519	0.153095382516992	0.280348249431824	0.932123516704219	0.137461677783584	0.0991458094273928	0.946135596493374	0.228073871019734	0.772586013211813	0.268052474709139	0.0602526695080324	0.959785035718361	0.287782398540322	0.2830692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sp2	0.555439599948323	0.626352925290337	1.10646239425923	0.866072957709155	0.427935794951679	0.857787776194983	1.07218222586515	0.719051090681404	0.243651067179797	0.665709628711223	0.543754549821608	0.584330744061946	1.029456349181	0.336543133427733	1.0477902761177	0.679810226029939	0.98657618641138	1.06022367412228	0.980212527385959	0.742064260529402	0.942524127954491	0.62959560461051	0.186459460054265	0.583964547078312	0.424739409306201	0.554489463670355	0.866051653044167	0.36303620269604	1.18473884675306	0.492115644653785	0.86673749921247	0.941672886852135	0.683429254671978	0.182475674973237	0.992017841277742	0.489227968350995	0.591530445971261	0.570324874605917	0.417492137897658	1.08482665170255	0.80268867335353	0.506229396790346	0.914300527290265	1.01676546818426	0.567137312981415	0.906341468651344	0.482063532358691	0.601853080406155	0.886419384963166	0.762934786049788	0.50125622330293	1.20486931108312	0.956293625852781	0.327841061279756	0.907774321270055	0.468889675228277	0.722091455553365	0.871364167673682	0.736888478946846	0.366061487303883	0.757746548111032	0.65456039642616	0.619053094983489	1.06675000680807	0.230774565249362	0.878639417641745	0.571916678543307	0.861539168514996	0.839206586659819	1.13133049752505	0.651528319328559	1.15932215776934	0.874556079688824	0.875573421784308	0.451722777341647	0.815434440434412	0.987452991984307	1.0122904492263	0.790404549608147	0.853057959891458	0.880325504659882	0.880339563125947	0.71635239005046	1.09375662934758	1.11073987435787	1.06992913283411	1.05035326067682	0.709805988873795	0.689186598286641	1.12336417289659	1.06982370441205	0.359752776270885	0.677642336198884	0.443658229891534	0.629067458640897	0.397166009822959	0.605047656446452	0.995412561682834	0.803604917976145	0.764691830875398	1.18900819515878	0.352573152814481	0.631334671672842	0.659449283905072	0.534138816396501	1.14601050357862	0.413765359449112	0.539093244107879	0.4422028562537	0.392361726036571	1.0915729449287	0.925886620667015	0.805802045294504	0.725305719128366	0.744263161071123	0.389608029156223	0.311066054147826	0.807971792064262	1.13384494086239	0.866952429849889	0.655141739964992	0.816673811612162	1.22555452364609	0.515927382043336	1.17794281458509	1.10628833598248	1.12748823427193	0.847856041272898	0.551675355093088	0.195193634394173	0.851103992472646	0.852543626251496	0.548642283229024	0.443093020811664	1.05444362153478	0.979839230334273	0.722391291950084	0.831307443299212	0.397310208393419	1.08086689712854	0.632846525470133	0.931956291637685	0.451978304755155	0.555806024865591	0.60279940995612	0.750202501436928	0.533118903476727	0.574211154382433	0.953478987724601	0.343838524361506	0.845335134722845	0.421756012426503	0.378832769520896	0.517852136149219	0.771937688462385	0.953241821207111	0.909754576938081	1.22598598688982	0.934238083153316	0.761754334111089	1.24007143345117	0.423047493646105	0.928287057635226	0.352659916888763	0.684554144616266	1.09881681647945	0.0915733546052086	0.322939026298719	1.13875273873492	1.28563109280393	0.523524000240429	0.602033801567069	0.925781381041498	1.04597673186765	1.01897851618748	0.25119183862086	0.269645999331345	0.429880497548496	0.692207361242255	0.810003349792157	0.634609081673372	1.11531881189181	0.548302055411383	0.505060296225251	0.801353528620524	0.781453083029613	0.902460615269788	0.58866787791059	0.971521107912886	0.721101029843915	0.126937055229706	0.464075928192322	1.07083938027681	0.967599051140698	0.925889326225794	0.712326693874461	0.547270919299515	0.946967843464974	0.541003109727016	0.831619605591297	1.07173820674175	0.696831172593706	1.18386808264379	0.515481107040583	1.07587889671889	0.693858584758479	0.576039018598337	0.843363137608501	1.05655802219498	0.836939643305779	0.5770937975678	0.841409508132665	0.67114764105635	0.382308168203715	1.13218158796953	0.694733948025068	0.757536935397827	0.831054934967889	0.966395051298815	0.413235762204253	0.468536884410005	0.944184329873614	0.774302142514534	1.22347341675481	1.00193435368645	0.822722742859827	0.48709496897266	1.02252018737741	0.768122806655028	0.870915985400193	0.286027910945435	0.346491476520648	0.556131810249273	1.25716988397104	1.08292689203512	1.0924394797641	0.558441969315368	0.576281998329933	0.728873729713592	0.941801333015616	0.913806183660453	0.481425898061155	0.758288645688044	1.069555910967	0.452267068034068	0.947454702527668	0.862109990185193	0.5027820709701	0.802493733184667	0.843604749178637	0.508806353834603	0.388833920517283	0.950807231568554	1.03728957355124	0.920297811898972	0.835953795866662	0.520557418629394	0.664988101119227	0.27935500048163	1.01678907419241	0.39324927588367	1.09612375835852	1.03324671859144	0.485535623898536	0.95987078190415	0.4695140636785	0.891241249194304	0.343809652159417	0.685113953492965	0.525019665084011	0.639589236220595	0.424166042339817	0.926432042586891	0.509330674708994	1.08808228240407	0.782629703419239	0.515839931156736	0.887108895423211	0.978116042475772	0.677673038985479	0.330468184222962	0.662328969109668	0.8117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sp3	0.129678082157957	7.60373148709241e-05	0.412407468619009	0.702239243803336	0.76542184125308	0.586890054845622	0.435718628262632	0.659811654648672	9.13592975769736e-06	0.543187820333756	0.562451414380963	0.352996152396371	0.500901162529574	0.423429809209971	0.608674443596806	0.204240036606763	0.0221015671820521	0.309052013067841	0.321059286752577	0.695569880813363	0.216458106668891	5.45155736596092e-08	0.000232502498293122	0.0702581136172798	0.736469229978316	0.679332302383466	4.45654448353389e-10	0.716735656231968	0.558406087838208	0.0221754241453813	0.399100488226986	0.491418460818741	0.0892278252998247	0.120370987200231	0.0637486205912993	0.485042894097506	0.425654032946329	0.685067685938925	0.0765323288354804	0.549808805678506	0.00613157224037999	0.211274171968874	0.735342768169418	6.03760666438071e-10	0.0784726649097268	0.781763097906628	1.38405615539483e-05	0.509121533602814	0.34596092853065	0.279411926286417	0.0232506662043088	0.549385726244359	0.437124527103561	0.141721940130831	0.613346342727738	0.0398400206317191	0.0236546771042707	0.273852160835102	0.657461123191818	0.0214854625120549	0.158046447106541	6.35088759954287e-08	0.203191108328168	0.799435959382395	0.184539304189259	0.273136441957882	0.562277194868607	0.355251104210874	0.636828307804089	0.435497159276044	0.27508278258355	0.538070650825879	0.796470159788771	0.319580780438012	0.382748003482187	0.605085917695745	0.00114887832275427	0.299723642513116	0.391161719204203	0.616981113204776	0.811751113547405	2.97251394062096e-13	0.129762440912356	0.425430296487089	0.685899285516862	0.399169166194032	0.524242529208199	0.000120068975769535	0.362801386798017	0.600174837941656	0.0385708116590457	0.0683041960893243	0.224938246619931	0.0653694157877174	0.357191374539584	0.0962113139973719	0.774803427458811	0.319437320991615	1.39793451590624e-09	0.48627936616921	0.53710515746062	0.448602991370655	0.595054081694178	0.00167286233919243	0.140619002390345	0.294512732173038	0.550623534716062	0.670285616113419	0.44451786346346	1.25821952063301e-05	0.320046047633217	0.827352561316648	0.383990881783019	0.569760754499141	0.0364304067496996	0.11718943644515	3.1932554375262e-09	0.661301538133128	0.323534578742759	0.453069119419337	0.287626376926595	0.469812237626261	0.774638127639336	1.49193332279879e-06	0.741395329610523	4.4392494432967e-09	0.373165259217176	2.89539029844445e-10	0.318333028464458	0.0538512951009638	8.14751840111062e-07	0.719741078966078	0.0979243004635013	0.729275191113166	0.641086465991075	0.426322923176861	0.333263622079842	2.2498392636428e-08	0.00104525031999255	0.430038757360053	6.9059233361322e-06	0.53018940812577	0.0128732364985852	1.24682271541371e-06	0.158152959195323	0.325820285658283	4.02235740916749e-10	0.00666228475281239	0.577279622342479	0.66011345960227	0.66128552165845	0.438156784299203	0.605570664851943	0.0833286843515084	0.665272705187088	0.55348362932056	0.000127997375703152	0.562999149621919	0.325619725793042	0.0254811301622265	0.58623702990779	0.457184956259759	0.0947811298816541	1.12468454371809e-06	0.608136171547744	0.460719366673507	0.0558021548367831	0.252045841762816	0.314531251096957	0.476686380962831	0.189934865311846	0.46465046074982	0.551512050536508	4.47367715609572e-05	0.476240988100932	0.0836482852886327	0.0864646873732625	0.532491781833323	0.0024285361440281	0.734861124393777	0.389129373799849	0.31891444725327	0.311645695802182	0.544723436683298	0.547785993992101	0.412235705845379	0.308408778165903	1.99344684532361e-10	0.000176256507673722	0.245328855011148	0.238511974212096	0.216616791837916	6.02671014157415e-10	0.760710102068189	0.480311775134159	0.718075716008042	8.98088130226953e-09	2.71480229473088e-05	1.43762536189381e-06	0.698857811684562	0.76433196741951	0.601857127831034	0.000508464910952647	0.432292542842883	0.467761822812572	0.611508863873756	0.173561505434717	7.00308553995991e-13	0.463084146181068	0.180462921047667	0.452999067888107	0.0390451384784047	0.141793215228923	0.595347733959192	1.35881001893645e-08	0.720150439886657	0.0775103439267493	0.669917794359657	0.644697338850958	0.0679757797477021	0.287232550457847	0.144613419404345	0.329232480836749	0.732763299103408	0.186649496460701	0.63955548103894	0.560745836296739	0.263290098634918	0.622807150026895	0.322582946101138	0.568403998301235	0.254972652078948	0.10030391902075	0.395472053442086	0.511501034131918	0.786242268337787	0.698034526736914	0.618576218798966	0.702269088690065	7.10633509716618e-07	0.00397948141096727	0.254002826666631	0.603151832942007	0.323495848207774	0.166562196328414	0.111196071389786	1.42434579728369e-05	0.666416544263452	0.154560286792403	0.720364168431582	0.345964438594185	0.139418760750924	0.0413555502546929	0.255471613055225	0.515431344101079	0.521295732619796	0.631668899461647	0.117002298131859	0.00749983919014091	0.619658514264762	0.0515844688031527	0.396368632714095	0.558031532920903	0.436189699832309	0.623337158975291	0.121854767934724	0.268235909800331	0.0960566898936726	0.171250315337295	0.0942861314734346	0.441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