X343	X440	X438	X55	X104	X447	X465	X1	X265	X346	X54	X357	X56	X482	X46	X190	X362	X306	X324	X471	X476	X410	X222	X384	X180	X301	X396	X263	X305	X455	X499	X214	X136	X470	X143	X495	X167	X450	X144	X8	X368	X483	X21	X466	X356	X284	X164	X268	X374	X217	X422	X339	X366	X27	X74	X386	X96	X462	X67	X187	X156	X258	X290	X81	X197	X293	X29	X113	X421	X32	X397	X245	X175	X345	X375	X132	X227	X484	X309	X219	X475	X239	X5	X87	X28	X86	X243	X9	X50	X493	X387	X125	X411	X232	X134	X145	X481	X171	X198	X445	X323	X105	X199	X488	X170	X186	X308	X269	X210	X416	X291	X453	X405	X264	X364	X13	X142	X334	X179	X157	X107	X338	X150	X209	X286	X127	X22	X102	X312	X221	X15	X385	X435	X16	X311	X500	X304	X474	X373	X128	X427	X176	X260	X430	X299	X348	X31	X139	X69	X92	X149	X158	X237	X12	X124	X398	X432	X233	X498	X454	X17	X196	X395	X354	X14	X202	X73	X423	X444	X278	X329	X91	X64	X206	X457	X388	X277	X99	X7	X216	X282	X61	X363	X94	X340	X228	X425	X370	X18	X372	X262	X461	X207	X183	X78	X116	X378	X122	X272	X292	X135	X403	X41	X215	X141	X289	X48	X261	X178	X433	X36	X391	X97	X84	X101	X310	X72	X389	X65	X424	X358	X121	X30	X367	X341	X463	X76	X19	X497	X288	X152	X112	X419	X353	X307	X169	X188	X406	X489	X60	X119	X193	X408	X98	X90	X436	X376	X185	X347	X383	X33	X253	X189	X351	X168	X473	X321	X63	X181	X274	X3	X359	X123	X256	X298	X162	X109	X273	X327	X247	X138	X446	X252	X382	X147	X83	X259	X110	X211	X35	X349	X437	X418	X266	X300	X212	X201	X218	X191	X360	X165	X184	X401	X281	X491	X442	X6	X242	X137	X80
sp1	0.94753065517707	1.01171807037127	0.375769432307563	0.651374168649907	0.894676755677079	0.324601007919515	0.468599492058269	0.378807696640347	0.2204741251369	1.02480270441394	0.955141786461195	1.08027686421844	0.687370552171966	0.213271865408482	1.11643256002213	0.613557927887236	0.907602465587592	1.15625063025153	0.597280041931891	0.549361322616534	0.526971982973255	1.18944393526224	0.34818571817319	0.850625430976156	0.944670155427307	1.04798449845988	0.911222106278848	0.791284388186114	0.399223310151055	0.764138540461621	0.314982408963553	1.01431270228528	0.348248586039805	0.238648373353444	0.428239355851559	0.325802930959779	0.5254927168492	0.794787018969949	0.656957815196901	0.821270170031412	0.627471335121404	0.297802163505809	1.11659706013798	0.294785073039875	0.689562148206972	0.631973220731394	0.685582084227072	0.750537552776322	0.30316513511913	1.1784549641248	0.847543589655983	0.607255269625085	0.714906783029423	0.521766971228032	1.04674318766889	0.916162119827098	0.956114136742776	0.914533117042095	0.291530492465505	0.543503866121285	1.12208871518775	0.18211603626856	0.44360620920838	0.660575914273753	0.987108541701028	0.957742807940959	0.709613959147057	0.490260139703301	1.07490237834906	0.348060777186312	1.09411004020797	0.404069010853409	0.473327874642831	0.259226963741581	0.87570861281982	0.398650474118398	0.76806715535048	0.65110730950586	0.902881076951912	1.14795865620243	0.85212515217463	1.0512008202059	1.06778160709384	0.31386955575416	1.08338093712716	0.666569282509667	0.774927027709891	0.785518840866217	0.266203186446541	1.06624970336859	0.557137236961421	0.729908789086067	0.652608380855046	0.703521378198917	0.7835231281418	0.302650288792392	0.653591822635055	0.739367033340272	1.14478076569481	0.490859979820958	1.05969024727739	0.366337938986086	0.993977755938908	0.692370050210675	0.40781303465924	0.680771242240615	0.61094264851157	0.644402799182077	0.23657961043323	0.641028695975641	1.12867460172003	0.347669064840996	0.492728209163581	0.723906354788455	0.818849381371846	0.734054941961515	0.607840502752686	0.347518988051376	0.404371987962632	0.302887503334175	0.760401065937683	0.473504112591674	0.863201244479481	0.318676336639743	0.882742056341376	0.940496676456819	0.4716621982327	0.650628796404329	0.694990536495141	0.933079436908651	0.348970009825478	0.146935621842341	0.810848287875038	0.923500425072759	1.03723836288946	0.267809278738386	0.18472203553656	0.63974499464915	0.493732042056582	0.153083680622769	0.243453426262564	1.02991321662192	0.606605248774345	1.04631764846741	0.86725203743597	0.878055398563648	0.922988255437833	0.318684439479404	0.993874395393344	0.375366127621905	0.581243743269025	0.68504683108547	0.870532399967201	0.698341755130595	0.911287297273151	0.967041208567603	0.298738770861932	0.85670829344494	0.569288999796192	0.922318098691776	0.745861133383887	0.961098676410938	0.958745744656029	0.876108136721703	0.950881789801244	0.646362955772496	0.195072389902443	0.707170219398019	0.925256699149292	1.11992298075297	0.440409022254354	0.483020401595131	0.655357165218416	0.594774732261194	1.03483813438691	1.07396672178425	0.402644029530986	0.876852427791964	1.05394738877598	0.744641396879536	0.690341672291626	0.657784538106211	1.0691506010222	0.321384821656964	0.571384297660426	0.376784398958581	0.847059527774218	0.39365105936132	0.717177014547952	0.747697707364431	0.430249193243931	1.14173693123581	0.795835501962504	0.300437622385673	0.924620166915939	0.992749914241868	0.486407621326636	0.304545186531249	0.255822514223275	0.817023958508323	0.613897318771848	0.70711362718296	0.941144140490277	1.23343714073346	1.09380829266168	0.841826293687065	1.07988760987945	0.195362822250964	1.08106392767676	0.495303797771028	0.54207329723755	0.875355242005638	0.567276266283149	0.821530276241683	0.233154604531651	1.04777714912194	0.579892216972039	0.66761259165548	0.368814813309107	0.302565841471717	0.744306696350881	0.381963208376602	0.406689152927145	0.562684117407218	1.09250775329544	1.09966172825481	1.07540411071467	0.754959939751811	0.396188244186727	0.941205206572771	0.474070450671403	0.761766967408949	0.554939570930052	0.651859603978454	0.434682903799197	0.885556864279928	0.495877110313116	0.746502484496589	0.76412728812481	0.200526494825944	0.296870432520152	0.26165017031886	0.552868745168957	0.74232003102506	0.450484856881863	0.732500950989308	0.437992138579276	0.224121851477359	0.807445300997562	0.451432249446375	0.974930444552327	0.829125711899664	0.0752745146145158	0.564579105749573	0.778852192104479	1.00619165812637	1.12700058906993	0.999115221801811	0.741038302205721	0.389996551703345	0.978827851438929	0.355125628996008	0.616404265794473	0.668995719449294	1.10735754315559	0.500124330729187	0.119398151597576	0.642076610286683	0.748653402026016	0.497779763344627	0.36685878371631	0.958574987925715	1.22634666273313	0.850783865095549	0.365025082714859	0.816970969589514	0.664994419463884	0.775042231749893	0.396616599601345	0.968037639487788	0.525516623186475	0.767344403010658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sp2	0.249457704139797	0.453239558497444	0.87713995971717	0.982403402449563	0.183904612699431	0.848861629376188	0.621859190287069	0.150074077644266	0.901281883008778	0.301166941178988	0.257152203705042	0.412818207172678	0.319312278414149	0.722649645060301	0.514390546595679	0.372123958542944	0.396248780423776	0.91343586309813	0.642892249161378	0.0300286513565293	0.0750907278198105	0.765116901136935	0.482515356270597	0.181234466251828	0.965116851963103	0.429534962866456	0.698298554634676	0.0420424409507084	0.532356429612265	0.376940224552528	0.443797969492153	0.0292276665637544	0.351363171823323	0.922692383406684	0.560369930462913	0.460707901045681	0.338398311519996	0.270079675363879	0.120987209162116	0.862540461355821	0.960256952093915	0.977731462800876	0.855135581223295	0.634098380571232	0.956042291363702	0.0182115380361258	0.733564347261563	0.822532926453278	0.10153606665559	0.881973762065173	0.602170567028225	0.011664668718236	0.52164860116318	0.50555427116342	0.663983012316749	0.567483903607354	0.822453413857148	0.534796812804417	0.406076156999917	0.451676053926349	0.600148950703443	0.160855191820608	0.747626932803542	0.0586399236711883	0.410640293266625	0.4706319575198	0.406003538984806	0.236870909121907	0.657576140947641	0.117563617080704	0.243807598023428	0.994743380928413	0.358066449174658	0.263243675698565	0.688087794231252	0.512346278643237	0.667985744774342	0.925562483957038	0.617745457217098	0.953972641378642	0.704807139234618	0.279474610695858	0.964110687142239	0.143118393544361	0.109235115794414	0.935663610696793	0.358412814559416	0.642328544287012	0.81337538920343	0.405519465915859	0.0185143990085823	0.763694223947824	0.980198011267931	0.177118897770209	0.541727534728126	0.804899473907427	0.0990207633334729	0.546210121130572	0.0961781729271209	0.165829889399196	0.415659970836715	0.325294475769627	0.866566276410595	0.261855047197259	0.228176129311409	0.131562905892787	0.593450159998612	0.885956966551021	0.100108564309152	0.0648331468189977	0.625639626989142	0.653182668844239	0.408038642257453	0.445397997740657	0.986513549461961	0.861898127710447	0.763092473847792	0.924346967134625	0.499852921580896	0.940047127194703	0.947658847551793	0.559077036567033	0.414797657169402	0.0387578482665316	0.330776079092176	0.990544887958095	0.0192227705184442	0.679232554743067	0.340849923202769	0.969447784824297	0.716038356069476	0.995729704154656	0.958881880855188	0.160194746876848	0.445482717128471	0.758494265144691	0.12625757372774	0.921673567034305	0.929529430577532	0.104957545109215	0.492252142867074	0.423250989522786	0.838015043176711	0.341098907636479	0.989501653937623	0.55862775631249	0.277228624560191	0.506431938614697	0.808901933720336	0.223424267300779	0.623066228581593	0.547109568491579	0.664864801336081	0.0422140588882595	0.0271323475310469	0.0412534119489037	0.594453585101292	0.212614022552008	0.286347488639981	0.313684106338777	0.0648536835641008	0.886186677962542	0.419246495701373	0.473043178441004	0.876201833132655	0.407063507940621	0.477961980272085	0.209466596068398	0.822296868078411	0.378637708723546	0.699228577781469	0.445106036728249	0.194552177787641	0.248451883442993	0.727546960581095	0.179099760437068	0.463057080283762	0.306789597962069	0.598466602619738	0.633147138869391	0.323558570584286	0.5175813077949	0.95445164013654	0.848108013160527	0.476216860814021	0.467101548565552	0.0117735188336061	0.634005610132591	0.196033994801053	0.534035793971271	0.862968208268285	0.767325622262434	0.339052616851405	0.141250872192046	0.572241890942679	0.644100428093226	0.327597675146537	0.558173802448437	0.822476285975427	0.655780895380304	0.450252093141899	0.736756508704276	0.602156012319029	0.784614726435394	0.786918421741576	0.104282166974427	0.739451909204946	0.569656704319642	0.519316279795022	0.893399827415124	0.108262981612833	0.184653224789077	0.784934077411891	0.234776679208513	0.792052524862812	0.438482011668385	0.162303357666304	0.25668243854489	0.254955166720447	0.514839473180474	0.907430509570987	0.239527186155462	0.399290408007801	0.29566472838637	0.839988462394104	0.252833305162221	0.557919594692067	0.5055371504277	0.970846405485645	0.175731372224155	0.117124960398322	0.452134859282524	0.523403423838318	0.0689864852972702	0.0859771538879604	0.640230921562762	0.118740100086405	0.225421015442513	0.0769204624464896	0.866608477430419	0.502341639017687	0.303371558431556	0.991349490126595	0.257453256754282	0.281198571203449	0.659957213327289	0.863369167316705	0.389783423626796	0.423962383996696	0.491417524637655	0.072730487444547	0.666961173061282	0.0469614778918449	0.128286459593042	0.367971097584815	0.0531796387706143	0.334185239160434	0.946268669096753	0.368055927567185	0.174660493027648	0.728698821039871	0.534104074584321	0.652492768131197	0.64593793777749	0.349394055781887	0.609695864608512	0.229766344442836	0.0587306382285403	0.279651504010162	0.0595707482550524	0.0431420736584761	0.0140580785614355	0.0416900898440614	0.186503658386432	0.149207292567547	0.260113667465393	0.403121303534136	0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sp3	0.723906515473959	0.323944633191482	0.721574264051752	0.400093870056079	0.928537600500976	0.368281107322068	0.573492150172778	0.388903560632308	0.675409055943922	0.293801259697757	0.901856558919053	0.710908534679073	0.459827050298125	0.551671508555674	1.10655436359576	0.675390856245804	0.747136831897617	0.290075485931952	0.572576456418084	0.356829284530945	0.380795107339245	0.735718998742944	0.904928325480574	0.188450977862451	0.486146184205112	0.891910896535846	0.54500527012686	0.624343878204787	0.954752572551146	0.625940746660786	0.590645751161554	0.903806893274261	0.564186177096376	0.51149607542242	0.291409781813088	0.514914147572791	0.287036807666334	0.916186649220553	0.994949402460579	0.816412267634158	0.286737040781493	1.05504640943454	0.786724478220741	1.05492100718014	0.509178949782008	0.46356864319881	0.96206955616432	0.440777748858145	0.534212106590186	0.793455421513362	0.323614316637979	0.540128603926195	0.41555221040855	1.01984255758245	0.833422954462573	0.625701378236379	0.280448932061328	0.254109348444957	0.803211876723854	0.912336673164279	0.24756571592224	0.52275906343481	0.233004041414322	0.281435054139556	0.381459583592049	0.149409725858806	0.425396512194432	1.11015082969144	1.11530378929874	0.143154298514721	0.367801377134972	0.557575108272342	0.831616330229532	0.813416761817443	0.441605428303928	1.0592198308919	0.722910030636315	0.665407804838085	0.0557180702193669	0.822307534303553	0.547445987571508	0.907626197076483	0.760124781168788	0.431643213164539	0.206895960316046	0.299196064934002	0.681570973875295	0.902138601817146	0.980579945683854	0.455082796329968	0.280556642029089	0.382630019191836	1.14936506797876	0.425696971765492	0.839503169887244	0.722670043256884	0.673135912574029	1.02216082829293	0.77722958997231	0.64032536020352	0.445433548641383	0.322082534192218	0.127453472090794	0.429546282310986	0.446728437227732	0.30963224826091	0.489371738663057	0.508905595814505	0.741757658054091	1.03385176165057	0.93669343670212	0.470748120789073	0.671190781184107	0.625484976637671	0.542389387662824	0.45436159620178	0.681835241322027	0.416444774954019	0.449834568595143	1.08587806276659	0.489410508689505	0.407413101976993	0.663187675685642	0.661674886787519	0.443150936377141	0.811518396149977	0.499107729271496	0.561628664745071	0.0317213924549602	1.15927163970575	0.448901567926705	0.336124063604843	0.402323602606276	0.255495386820054	0.871595515660926	1.19164410010831	0.620408509991357	1.01525606321449	0.531339721568929	1.05853309663354	1.06853668636282	0.688186920448944	0.900668071028441	0.926168376880875	0.911241549584205	0.802319164702902	1.04620562028391	1.10617772601208	0.642298512713431	1.19390819670288	0.463603069867576	0.978554548977527	0.306606971332579	0.862338849617714	0.699695436425714	0.104662422157823	0.453247123564253	0.359359245258709	0.298788755478375	0.102253689127852	0.72547722772798	0.454168106877159	0.220159861606115	0.819700375804236	0.744581838730361	0.630928985671129	0.788215001006333	0.6277605035903	0.706773663829443	0.942913777824793	0.559553344438547	0.803889099291595	1.10652419077764	0.435328376232205	0.828251074592455	0.375761204221171	0.955739821153003	0.684536107958214	0.433840145532313	0.615543851731588	0.647854825031271	0.831325149765359	0.244172329789587	0.4756822215451	0.820829632062526	0.822926786848404	0.392307312406456	0.356155587779931	0.306293788336898	0.656324436635174	0.765693674152046	0.256424582552894	0.775874007894552	0.709281863799738	0.529709427528134	0.304591676608393	0.41296732876978	0.0361235491693664	0.970281934830839	1.08235503555089	0.953930939882659	0.776611022534032	1.02672921042864	0.584173301171479	0.320216692101632	0.531077858523207	0.224853545311415	0.837305618007917	0.539467357593589	0.773837267724729	0.69386463789426	0.673091183612134	0.586126118983626	0.515113249052948	1.07993940614494	1.10339371955368	0.262379521166278	0.212231823210893	0.556926772300743	0.866796292378133	0.863669955720209	1.00979022077758	0.339875721117905	0.171603220871849	0.626427582852943	1.10095976758467	0.887110912590651	0.922029433833619	0.574841110083262	0.588202385786527	0.756891652914154	0.377171977459231	1.03368094939138	0.596974894573375	0.651936280198468	0.23113436583989	0.697931663787016	0.970897232176273	1.03955478575265	0.465366433047393	0.536576401854138	0.889820146903486	0.635601248563799	0.954157864058844	0.195533011935818	0.551403852362326	0.824738197873805	0.253807847782428	0.144251878544057	1.05913310636035	0.400862392371926	0.831327800229462	0.560135951251272	0.944036075930856	1.01340554630033	0.187805721141214	0.748173021700174	0.91810562428663	0.193519506367718	0.317410994029575	0.848787124994684	0.992066938414791	0.647527036445105	1.062908974382	0.429272852629171	1.05993758180198	0.737810099725725	0.375701423367122	0.110706875229182	0.940871064284977	0.552020372227071	0.370622035496308	0.942523018334632	1.12499698945738	0.889442585793112	0.624676799434464	0.629529029663676	0.303052381127256	0.348015507467816	0.357868948151027	1.00535849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sp4	0.401097759195368	0.641761210287427	0.461173233743191	0.00156403847895809	0.0748830384096194	0.428331913345774	0.796539821093636	0.000216148662359583	0.252347017005284	0.446369226601504	0.625059801216454	0.604720844413555	0.125208435883831	0.0223067149578633	0.3819342358129	0.114548790999302	0.78484051795975	0.244089760602834	0.323354676106687	2.5777743641248e-06	0.394622229748236	0.606806255637195	0.49790052063699	3.87156626682123e-07	0.28693564366953	0.000683747513049879	0.297561105061759	0.414534601705588	0.100180080109724	0.368043636374088	0.855596837167845	0.732702735113761	0.000195792761468831	0.397059928266587	0.248354977994658	0.505304771570626	0.25923534341932	0.670829920088567	0.252520988083375	0.675986402948135	0.660504756602836	0.252894884755777	0.600178721312235	0.425955681727541	0.00030600289927773	0.351196200789412	6.53481506050336e-05	0.687364459533976	0.126538176233563	0.664681485789622	0.550657128956765	0.496062796422154	0.755384799789141	0.652108713998726	0.586055515326494	0.244279556040535	0.598946807615841	0.224271428060101	0.131707056952164	0.80150742156932	0.0152324282203265	0.174005239161484	0.584725034207371	0.51776833602731	0.148221372325097	0.466086908642608	0.127447338724574	0.803227582379376	0.652507115209181	0.154892664903824	0.155551833921889	0.229711804768793	0.537169690055647	0.419466608444421	0.00021036665329491	0.189089998510184	0.0373458824250512	0.271000719924646	3.1397622270439e-06	0.574501245866695	0.055628636926132	0.474550922141916	0.593928383929731	0.025432789463598	0.459632146660388	0.300513472355031	0.299045616714593	0.210273310417177	0.0155472267242357	0.283337329167426	0.320143743596998	0.32803551532279	0.732682473173116	0.39910420292096	2.22263042982241e-05	0.414558199652716	0.74518891908288	0.323234199396868	0.569636714566108	0.738240067022232	0.339360351054317	0.368805711169627	0.106890849752919	0.838862440103649	0.245304680566623	0.00567453400164121	0.594083289169277	0.747025632878101	0.253433683920882	0.416391367977044	0.720747105111743	0.413722463767823	0.751268395859643	0.0290734051186273	3.32164653381748e-07	0.731328515356586	0.497869683566738	5.90923952021636e-05	0.487480352236921	0.761020868855215	0.836180475318848	0.156993285153644	0.771968683250239	0.0897274678241724	0.0567813502622062	0.000125622700600966	0.490210759372662	0.27287996720552	0.000360945855238129	0.759061332199013	0.586850233410378	0.30890258850671	0.00210964040657074	9.10169005614019e-09	0.475907267202514	0.82906420584038	0.246251826659793	0.170905579587136	0.0018791048118465	0.561831997241087	0.500242421531829	0.086873145926897	0.382174025228573	0.238326215911292	0.544867241005169	0.00154460021985091	0.565661580552207	0.586053808599699	2.32724158915705e-06	0.642339897155187	0.377334671117432	0.705349004867918	0.672603555056438	0.0560303729049729	0.574541079632674	9.18248997802711e-08	0.0565441408933132	0.304757107439401	0.401445313618827	0.0236251772277471	0.234388404917973	1.14992474907295e-07	3.26890992955448e-05	2.38652757608234e-09	0.711841795211277	0.000194092606341258	0.157359754591806	0.824385172404437	0.413844116155302	8.29737854088631e-07	0.565886346001426	0.564479437610891	0.546698479717291	0.508637862577617	0.43042262650069	0.000734253003374277	0.618833741926515	0.391873633532781	0.212047180031916	0.661697127313598	0.770032496215752	0.672076058125047	0.184067015099095	0.837132025001389	0.617281258590965	0.841171924411533	0.358456993601401	0.190044090589665	0.615529497145333	0.422005221978039	0.041440123238329	0.559364447300684	0.327478162867751	0.00696929145547895	0.697581661827972	0.12636961244837	0.273217560606361	0.00479014563476622	0.284890084591391	0.478928583750587	0.593584863679737	0.189019090313542	0.211227934878218	0.732234879715666	0.497717026732381	0.221907550636884	0.763559593860709	0.618586893906623	9.40067537859945e-05	0.318154815274878	0.138257645947563	0.564040253965123	0.118135679184217	0.0379525347122712	0.360862200541326	0.584257431260743	0.430945840270533	0.214039306133979	0.686313366481985	2.22791387339226e-05	2.62837585358775e-09	0.199021892052787	0.888418058269648	0.223386584966906	0.730246474832671	0.163065125695435	1.31226484294298e-09	0.527017774157592	0.212312928947682	0.635487923113155	0.825046079265057	0.668697248638641	0.75580115589892	0.672244484273437	0.164151748076611	0.218786265756401	0.482822510253872	0.0931440048274028	5.25218975486081e-05	0.165717242221489	0.720011100694608	0.0996119873739484	0.00301877408147173	0.413270946415793	0.613264472498921	0.398197756812709	0.273743702884866	0.00473020545152758	0.330745512452228	0.53269382332329	0.0799728886214399	2.00296027829552e-09	0.0650728565105559	0.53632355379666	0.746736811893218	0.60462171699046	0.115539833472977	0.51962880765653	0.108068822220402	0.00145506890982076	0.728644993201593	0.678527227620073	0.153141523553211	0.60086783075438	0.146366701186052	0.505306887449142	0.53874852782287	0.114122261943739	0.0222962505085603	0.103456773332508	0.233748533149082	0.676960976586166	0.41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