//(simulation time 10000.002124) //length of search table ( 6911 current length) //corr=0.046004 //ll=7259821 A.SYSTEM SIZE 400.0000000 400.0000000 400.0000000 B.NUMBER OF ATOMS 3394 C.TYPES OF ATOMS //type,mass,ellastic radius,interaction radius 1 1.000000 1.000000 6.000000 2 1.000000 5.000000 6.000000 3 1.000000 5.000000 6.000000 4 1.000000 5.000000 6.000000 5 1.000000 5.000000 6.000000 6 1.000000 0.010000 6.000000 7 1.000000 0.010000 6.000000 8 1.000000 5.000000 6.000000 D.NON-ELASTIC COLLISIONS //pair types, repulsive dist, interaction distance, energy 6 3 0.000100 11.399000 0.001 8 7 0.000100 11.399000 -0.001 E.ELASTIC COLLISIONS //pair types, repulsive dist 3 4 6 4 8 6 5 4 9.530000 1 1 10.000000 2 2 10.000000 3 2 10.000000 3 3 10.000000 4 2 10.000000 4 4 10.000000 5 2 10.000000 5 3 10.000000 5 5 10.000000 6 1 0.000100 6 2 0.000100 6 4 0.000100 6 5 0.000100 6 6 0.020000 7 1 0.000100 7 2 0.000100 7 3 0.000100 7 4 0.000100 7 5 0.000100 7 6 0.000100 7 7 0.020000 8 1 10.000000 8 2 10.000000 8 3 10.000000 8 5 10.000000 8 6 0.000100 8 8 10.000000 F.LINKED PAIRS //pair types, repulsive dist, attractive distance 2 2 9.000000 11.000000 3 3 9.000000 11.000000 4 2 9.000000 11.000000 4 4 9.000000 11.000000 5 3 9.000000 11.000000 6 4 13.800000 14.000000 7 4 13.800000 14.000000 8 3 9.000000 11.000000 8 5 9.000000 11.000000 8 8 9.000000 11.000000 G.REACTIONS //old1,old2,new1,new2,bond,radius energy 3 6 8 6 0 7 8 7 3 0 H.LIST OF ATOMS //number, type, x, y, z, Vx, Vy, Vz 1 1 302.2383176421042 365.8692471330345 321.7074712050465 0.443515 -0.166398 -0.135762 2 1 154.0703220108682 263.6979061326938 366.0388523504861 0.061172 -0.429812 -0.144391 3 1 232.9206788107453 377.3729197877753 165.6644660706799 -0.030875 0.119621 0.023922 4 1 231.1242871402200 63.5877015202386 153.5979326055929 -0.137297 -0.286771 0.028469 5 1 105.7576792229807 367.3255943581056 168.9352457592902 0.284862 -0.288774 0.487771 6 1 78.7922844746907 155.4723730063592 70.0799838496907 -0.265169 -0.997755 -0.042840 7 1 375.2371980188318 290.3380797210357 379.6559497388494 -0.178366 0.355280 0.251667 8 1 351.5972270124617 115.4401819854568 103.4487820334973 -0.509244 -0.426571 -0.091984 9 1 176.0568434675569 24.6748861739937 385.5966710049902 0.148529 0.256814 0.025881 10 1 311.1556228737153 249.4789358261740 253.9758699809284 -0.675999 0.486983 -0.166167 11 1 11.9190164207953 100.7087804888814 116.7183023845455 -0.163137 0.274420 -0.078856 12 1 221.3576898597959 358.7686439984125 60.0244187089504 0.196534 0.047060 0.212903 13 1 206.4467259708051 86.9586951775536 105.8613056688339 0.353718 0.340999 -0.511138 14 1 317.3923699183409 184.8673609896426 249.1535360647600 -0.964597 -0.147096 -0.088266 15 1 20.4360374305908 372.1358944625154 237.7958737465054 0.971105 0.537891 -0.147761 16 1 332.1352909711949 280.4654687840225 11.4394053121321 -0.313202 0.031050 -0.290388 17 1 20.0650979282560 257.8742871729748 38.3970555650627 -0.080054 0.070963 0.253936 18 1 205.2135747701932 1.3398376087172 223.8608499166261 -0.258998 0.038147 0.587440 19 1 227.5226576564519 29.2430577942586 290.3999768839665 -0.040252 0.097749 0.455573 20 1 365.3455590677607 335.9484386535752 161.3363438237495 0.021270 0.112255 -0.357500 21 1 398.0395382710179 53.7412392127664 374.9126640951845 0.195767 -0.085008 -0.097798 22 1 66.3136029238348 232.9291488259682 330.3920039345743 0.167541 -0.127525 0.689018 23 1 353.2788359808710 341.0521625199407 358.8861372557610 0.187743 -0.192487 -0.021377 24 1 276.6172452825659 149.3635733797956 222.6094740779335 -0.482994 -0.042138 0.216091 25 1 165.8331955515530 244.2287722582497 262.5135507741975 -0.051861 0.372955 0.137547 26 1 50.6491128450980 316.6331624896533 123.7325533375232 0.304930 -0.638765 -0.028076 27 1 348.8931139481460 221.8555556265658 68.1662346903784 0.326239 0.209694 -0.169531 28 1 325.3802615769559 333.1016819013785 278.5090457000424 0.276562 0.050531 0.081658 29 1 342.7339936067293 70.6459008143274 318.9702823231355 0.098713 0.418096 0.278982 30 1 177.5577057849932 93.4562964585267 319.9875252664000 -0.085850 -0.146935 0.783712 31 1 225.0947915320882 196.3707526096862 393.3060479699858 -0.037968 -0.211140 -0.191965 32 1 49.3924384273537 207.5134457911930 249.2281175340983 -0.211049 0.548318 0.214430 33 1 65.6046241558312 121.4917750830424 166.4036286987123 0.279606 0.309820 0.240783 34 1 344.0387440814972 112.6924746843540 152.5617126651910 0.343040 0.185837 0.080514 35 1 196.4974166373184 380.4830212875916 274.9671946866613 0.638300 0.152945 0.133335 36 1 387.7407277111387 135.8167956673971 298.3011409235897 -0.081138 0.177418 -0.192602 37 1 283.7153527257005 255.8653136528990 131.1928690715578 0.101898 0.556630 -0.331285 38 1 87.2580632704367 306.6646947714103 338.1891010141448 -0.097000 0.227954 0.631143 39 1 196.1385690269697 46.6035712797175 119.9171845078744 -0.044557 -0.012156 -0.376425 40 1 250.6214262388551 233.1952496206972 301.3506647871881 0.328143 0.502189 -0.599757 41 1 26.9567256754885 104.0163447181646 44.7706222543023 0.062826 0.372156 -0.177934 42 1 350.7777946734928 55.3119694372733 27.6036660179644 0.255733 -0.394149 -0.172996 43 1 102.6774359769640 373.0806867767152 155.7860949737751 0.559870 -0.190843 0.095744 44 1 210.5268094402073 101.5732860882937 301.2621047064083 0.232686 -0.424469 0.575701 45 1 240.3220702447504 209.8204437567770 132.5181462742924 -0.108502 -0.267623 -0.415550 46 1 334.7165989059640 3.5069213628360 135.0083105360812 0.004833 0.107527 0.182143 47 1 91.5323844536067 233.5455636692264 316.5120545576642 0.195838 0.223066 -0.224393 48 1 142.1310591345290 113.5594359628137 207.7722508028844 0.357950 0.309917 0.023386 49 1 230.0249140590215 50.8548404862978 362.7807265221144 0.428455 0.291559 0.260510 50 1 143.1139758756979 165.4117388533760 383.9831455451719 0.642400 -0.416681 0.075376 51 1 309.4029891562096 106.9763916488174 103.8137977531938 0.510024 0.243061 0.648367 52 1 132.2516608484883 34.5347387942205 111.2937864587172 -0.371527 0.265156 -0.066286 53 1 63.4507060511237 247.6207954235858 380.8621897300001 0.161588 -0.001666 -0.243945 54 1 31.0441824500615 394.9923235246195 90.7363786192289 0.349813 -0.339633 0.285069 55 1 157.5562649265600 138.2030149572697 88.7479289119471 0.576251 0.377628 0.460784 56 1 301.5550464587926 313.5423219025822 285.7378210882334 -0.150821 -0.051696 -0.313310 57 1 133.5961453266825 249.9690387881647 58.0436864745104 -0.546763 0.554008 0.181897 58 1 131.7784288684828 134.1587244718424 73.8075794332164 -0.477249 0.045602 0.456978 59 1 329.7809064411834 213.7028431612670 103.8173630533019 -0.136251 -0.205931 0.349459 60 1 3.8513172109134 187.7308777646696 130.4512599232594 -0.010664 -0.267659 0.239313 61 1 332.2262636425098 360.3611947302419 39.0269646063274 -0.705017 -0.543501 0.103570 62 1 243.1321805305088 95.9920404044956 292.7929290078144 0.692487 -0.408096 -0.408656 63 1 394.5245901181247 295.2999267670585 384.5879996391549 0.543330 -0.195442 0.016068 64 1 287.5496701926442 327.7503343451518 302.9660637069219 0.047743 0.251110 -0.132012 65 1 55.0405804308053 357.3053421295635 140.8964097028912 0.396594 0.688201 -0.016179 66 1 57.4208024415493 156.3431684114833 331.5088968779509 0.201354 -0.044763 -0.026755 67 1 84.8183152095367 197.9576971089671 394.0707048190487 0.001467 -0.327993 -0.426307 68 1 44.4276809482911 383.2777561836936 214.0812608697808 -0.246201 0.218403 -0.218126 69 1 128.4241312070669 94.7860866971211 300.8848343877672 0.500633 -0.307566 -0.594782 70 1 49.7069335870169 393.0723682443183 107.9437566987757 0.156367 -0.279318 0.241234 71 1 166.2979327631254 381.9090384484554 193.6474588353381 0.352022 -0.279139 -0.211429 72 1 48.2466191617726 274.3617044509845 23.9515319041087 -0.418431 0.658737 0.061836 73 1 378.6804933371434 296.2668794033976 162.3676720352753 -0.035703 -0.580321 -0.022459 74 1 219.4598440730858 300.9281900539920 396.2877582206038 0.218498 -0.200081 -0.311139 75 1 391.5676198787550 123.2906396163901 71.7073101865681 -0.301297 0.498776 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42.9320006726675 116.6959731836697 197.7311618183035 -0.517926 -0.104621 -0.022114 1826 2 43.2568298381390 126.0921502186816 200.2206614263946 -0.564115 0.195915 0.339872 1827 2 44.0006629515915 136.5956085584637 200.9883471319794 0.362301 -0.069027 0.454517 1828 2 42.9472172513150 146.7501552768830 204.2653068312077 -0.177473 -0.120848 0.240632 1829 2 42.7692471301770 157.4716410375424 203.3400679621391 -0.067934 0.010641 0.376776 1830 2 42.7370342149897 167.9297440848010 200.9590512305575 -0.654014 0.368986 -0.025911 1831 2 42.1137270545059 177.4189901120210 200.6739277875130 0.238207 0.750784 -0.353210 1832 2 42.8256430359948 186.3899771930673 197.2350296004511 0.053368 0.005936 -0.077626 1833 2 42.8049448249754 196.2109910327218 193.3251741855748 -0.018518 0.079891 0.274035 1834 2 41.4986475314044 205.4929959794172 194.0545866595375 0.229824 0.175736 0.462519 1835 2 41.1487649085609 215.5696710740626 197.0297786249304 0.628436 0.199752 -0.241269 1836 2 39.7928360667413 226.0773541421158 198.9022529476478 0.367814 0.582464 0.162927 1837 2 41.6746733526609 235.9087544240705 199.7657619213641 0.366131 0.607213 -0.318435 1838 2 41.8466876303566 246.0565331387272 203.4938086478029 0.020235 -0.143458 -0.072230 1839 2 42.8262581336684 256.8471159931065 203.2341691129974 -0.130814 -0.252933 0.080717 1840 2 42.5876437082816 266.5894099735751 202.0430280210372 0.111444 0.325271 -0.551978 1841 2 43.8170997919727 277.1031647374710 200.8562815248226 0.737465 0.077300 0.330264 1842 2 43.2702071720638 287.9650095542428 201.0140348841544 0.295783 0.082331 0.213007 1843 2 42.9197106084315 298.2795689532719 201.5325214769290 -0.264014 0.425439 0.039784 1844 2 42.8128788573076 308.5636150434110 202.9013279990590 -0.244848 0.419299 -0.048348 1845 2 44.2692961881036 318.6068529736178 203.0992097294505 0.283680 -0.037350 -0.185468 1846 2 42.4379198120000 328.1714512692441 203.2262638542515 -0.459637 -0.126622 -0.881440 1847 2 41.9537985634502 337.5037533194539 201.4756620084102 0.307505 -0.517091 -0.217782 1848 2 41.6267588720799 347.4933627170892 199.7744812244062 0.309826 0.265653 -0.282331 1849 2 50.8985100543832 357.5044480079381 198.2149585625223 -0.037728 -0.126383 -0.241503 1850 2 51.4555848095282 367.8826972089873 195.6166710298642 -0.523187 -0.499484 0.356328 1851 2 50.3105515187187 378.4332404333975 197.3353939899281 -0.382344 -0.268864 -0.150293 1852 2 50.3069318363309 389.3773416394156 197.6065017819013 -0.023679 0.066581 0.011147 1853 2 52.3299415375424 0.0260551123888 198.3192796066620 0.632975 0.046573 0.020050 1854 2 52.5844252487049 9.2005628615859 199.8094240383957 0.092790 -0.495331 -0.209227 1855 2 53.5304450006413 19.7700091705171 200.2155408455131 0.237151 0.022614 0.022466 1856 2 55.8682151348383 29.4508356620088 202.9047898184225 -0.108783 -0.314238 -0.015883 1857 2 54.9020859994120 40.1209409507783 200.4769269593556 0.020515 0.063980 0.102577 1858 2 54.8046907220363 49.2430921456771 198.4611575110723 -0.302004 -0.085437 0.455226 1859 2 53.1937489104588 59.7646199033877 200.4856287078987 -0.347501 -0.030254 0.202786 1860 2 53.5278644533592 69.0073225453906 202.3123248968588 -0.522399 -0.331044 0.233947 1861 2 53.4112521016900 79.1915371551447 203.1157253247575 -0.196367 -0.202111 0.211555 1862 2 52.5716222703045 88.9875364087018 199.3131436882887 0.178344 -0.018951 0.172656 1863 2 54.3937136695051 98.2834893958060 199.4613529521722 -0.229860 -0.413061 0.127968 1864 2 52.2594136303424 107.3723485486286 199.1489428074351 0.161641 -0.456609 0.342659 1865 2 52.1629869011534 118.0461539863651 196.5694868882193 0.307981 0.089673 -0.501434 1866 2 53.6474136116388 126.9950073462936 201.2756183923637 0.210484 -0.177928 0.750681 1867 2 53.1646185562875 137.5348864575759 202.8010884678625 -0.029627 0.041299 -0.016599 1868 2 52.2259272323712 147.5752937425960 202.0713906023050 -0.112715 -0.199071 0.470626 1869 2 52.6130607590025 157.7913086892021 199.4580711269563 -0.050782 -0.249297 -0.052835 1870 2 52.5888222434990 167.8306636997143 202.1086698239145 1.015487 -0.519295 0.061027 1871 2 51.7102595840151 177.9255611111416 199.2037282082763 -0.147423 -0.022349 0.251438 1872 2 53.5454405179136 187.9659615665165 198.6225861372697 0.041071 0.141157 0.410526 1873 2 52.5442411615022 198.8076714814334 197.1401441987169 -0.295132 0.252545 -0.223323 1874 2 50.4501876599366 207.6873956593016 195.4907669559985 0.098289 0.128708 -0.176125 1875 2 50.3186225336426 218.2385727551087 195.8592679945464 -0.227598 -0.416774 0.020363 1876 2 50.0024821480217 228.0377750530646 200.5674081308188 0.002487 -0.143332 -0.051752 1877 2 51.4288086042326 238.3204109816229 202.1670845795375 0.334738 0.499552 0.185795 1878 2 52.3886138831688 248.8383575624444 203.8264380397923 -0.000551 0.465067 -0.208334 1879 2 52.5745861015972 259.5810854872651 203.8325075958954 0.178586 0.416672 -0.425893 1880 2 52.7886506110975 268.4040700383268 201.8647207682220 -0.293234 0.170426 0.496069 1881 2 54.5073749760618 278.0525694172068 199.6685599808792 -0.360640 0.173951 -0.154013 1882 2 52.9889825704090 288.0900348028302 197.8666758812881 -0.563294 -0.028736 -0.297435 1883 2 52.6076525135083 298.6687995897594 199.3075449422119 0.280236 0.294449 0.461929 1884 2 52.5627056306072 307.8189838296315 203.1381000420013 0.060796 0.490064 -0.628300 1885 2 53.6759488653498 317.6856834584051 205.5010791193156 -0.020435 -0.059143 0.226078 1886 2 52.6237924857411 328.5348433222497 205.7262350680150 0.185323 0.140867 -0.402907 1887 2 52.3892529355399 337.6382004912809 200.2644124730240 -0.234127 -0.345591 0.016429 1888 2 51.2486062813103 347.5523490421488 197.4833908171310 -0.215699 -0.001245 0.424036 1889 2 61.4706860686785 357.0751800229581 195.9575340609931 0.636620 -0.227680 -0.166725 1890 2 61.8677806223000 366.9275582014914 195.7437591709839 -0.107558 -0.665538 -0.486623 1891 2 59.6751146925893 377.2125483712551 197.3364320365711 0.568417 -0.093611 0.248225 1892 2 60.9812272388144 387.2648165773078 197.9469506229904 -1.036240 0.132627 0.002560 1893 2 62.9025589932841 397.9061612054114 197.2416414989546 -0.531056 -0.290014 -0.051608 1894 2 62.6242974723764 8.4971641343072 196.1645410986391 -0.342916 -0.568860 0.543648 1895 2 64.0470453272827 17.8822233359079 200.5759049586499 -0.147112 -0.389333 0.011906 1896 2 65.2110934764732 27.3676348675932 197.8584228111737 -0.159315 -0.378899 -0.410656 1897 2 64.4207680609852 37.5784949452238 195.6827066112274 -0.100347 -0.234536 0.637312 1898 2 64.6586767443195 47.9676737269636 195.0620963349372 -0.100701 -0.054039 0.129743 1899 2 63.4916095947546 57.4206012987153 197.9962710714997 -0.365813 -0.580264 0.230387 1900 2 63.0140913356474 67.1910854545372 199.8445446495806 0.262932 0.201108 0.115705 1901 2 62.9923410349203 77.8344902340636 200.3399320531010 0.665606 -0.022218 0.248331 1902 2 63.1268159545029 88.1815605051421 202.2181628289416 -0.026005 -0.042395 0.334257 1903 2 63.8930713610780 98.4151338161629 202.5321474447297 0.294371 0.056087 0.045163 1904 2 62.7304288833822 109.0786349041312 201.2455709094431 0.014763 0.123527 -0.028970 1905 2 62.2007800032144 117.8581090920224 199.1457461297320 -0.149503 -0.590533 0.392514 1906 2 62.9284917276017 128.0522374279519 199.4784589696929 -0.860805 0.300864 0.382562 1907 2 62.0772991751700 137.6389075554561 204.5367396038484 0.009524 -0.567591 -0.157104 1908 2 62.8932535083177 148.3858810214882 202.3508335698577 0.145615 -0.176855 0.144824 1909 2 62.4925472681420 157.7039526865035 202.2607659682985 0.713146 -0.211443 0.145736 1910 2 61.7014518848411 168.0988900261719 201.2717264434693 0.152337 0.139418 0.019256 1911 2 62.2472637418629 178.5941841878933 198.1067114548007 0.164872 -0.280699 0.338228 1912 2 63.1303351853342 188.9287583792347 196.4608874315501 -0.174608 -0.077033 0.302652 1913 2 63.4375642884695 199.0834912456422 196.4860671582103 -0.194593 0.117333 0.011436 1914 2 61.1082727849033 208.7760499952563 196.9905074311074 0.609909 -0.119593 0.130296 1915 2 61.0531745283835 218.5583047107006 196.3859892111856 0.132863 0.133750 -0.390183 1916 2 59.9621196186625 228.6478145114552 198.8599092452005 -0.123400 -0.237412 0.265325 1917 2 61.0282325593575 237.8826138008051 203.6224405530126 0.336979 -0.276184 -0.419799 1918 2 61.7359066457146 248.3273150179927 201.4159813175498 0.092186 -0.238115 -0.085259 1919 2 62.3864041284010 257.7953257999952 202.1849930073391 -0.264128 0.515527 -0.429885 1920 2 63.6364339055293 268.0441564216830 201.1745501444375 0.132419 0.297844 0.084403 1921 2 65.3292109929792 278.7142234235837 199.4132454356453 0.136141 -0.761511 0.303109 1922 2 63.0956154423682 288.0942817015862 197.2019777600412 0.166573 0.070404 -0.452975 1923 2 63.0766368661896 297.7287851340615 201.5982593315107 -0.412800 0.006696 0.101971 1924 2 63.1362293686109 308.5873747362094 201.4528496518913 -0.517031 -0.365252 -0.448039 1925 2 63.3888251372278 319.4410683965073 201.3631214910700 -0.761064 -0.255555 -0.678103 1926 2 62.6780392758394 328.0655769094008 203.8838224083273 0.196989 0.197526 0.165298 1927 2 61.5203815571465 336.5133846116652 199.8243720199471 -0.344720 0.200357 -0.409967 1928 2 61.0621102494292 346.4311329125166 195.2083422446989 0.887059 -0.338633 0.434666 1929 2 71.0714883341343 356.7400910756450 194.6075394204640 0.049211 0.243867 -0.334727 1930 2 71.8338327954418 367.4970282337987 193.8815933524430 -0.332870 0.280905 -0.503207 1931 2 70.0758237499612 376.9920579472163 196.7981863306880 -0.118666 0.422581 0.348203 1932 2 70.8098083086058 387.4535723303687 196.4813508535216 -0.499317 -0.162589 -0.470733 1933 2 72.3475270379446 398.1911382318017 196.8103767343526 -0.290399 -0.438279 0.317427 1934 2 72.4943418291877 8.1260227124965 198.3713828970724 -0.577087 -0.329406 0.051557 1935 2 73.1936357947824 18.8290193456969 198.9013913403354 0.131372 0.230592 -0.268957 1936 2 74.6937718433014 28.4386176811652 195.4612749200397 0.162073 0.466594 0.515272 1937 2 75.2559180454258 38.4612713718557 196.2666957246939 -0.320001 0.033496 -0.098649 1938 2 74.6395526717301 47.6308239308441 198.8210043075300 0.092900 -0.227046 -0.292003 1939 2 74.4514941392248 57.6632173951091 198.7893271893814 -0.186785 0.918740 -0.202442 1940 2 73.1353427799366 67.0392299498294 196.5664510904676 0.092963 0.225954 -0.093094 1941 2 73.0254336827413 76.3892710464562 197.8882858778942 0.248179 0.195239 -0.184967 1942 2 73.5590247758199 87.1576757480946 199.0477904605767 0.135358 -0.129283 -0.538404 1943 2 72.7942381016677 97.4883043078616 198.2188958448453 -0.055600 -0.281063 0.488536 1944 2 70.8357020540375 107.3082888435699 195.5070645166882 0.445439 0.549251 0.181196 1945 2 72.4640662716241 117.5886713289978 198.0359395567859 -0.352658 0.348403 0.351873 1946 2 71.7277826994991 127.5996851070564 201.9334886459760 -0.198163 0.447824 -0.235232 1947 2 72.3665762888035 136.5732877109258 203.9551293118916 -0.066197 0.461145 0.185180 1948 2 72.6081079510184 147.1115637680829 203.1379794155953 0.075344 -0.614098 -0.186686 1949 2 72.3562940516451 157.0469117250584 199.9655462067840 0.199509 0.237974 -0.586602 1950 2 72.4270424429177 166.9680849318138 201.2173863773750 0.119493 0.007938 0.065686 1951 2 72.6388531920132 176.3808394891141 200.0573112268513 -0.222679 0.480328 0.438994 1952 2 72.6229402878604 187.2520591611641 199.3336929062808 0.153868 0.028801 0.363581 1953 2 74.1630131805368 197.7896549626275 198.0870635574757 0.404557 0.145867 -0.242212 1954 2 71.9510859291830 207.7009097879781 198.1307650902313 0.187851 -0.055422 -0.316468 1955 2 71.4370762586698 217.9978954668544 198.0537661250431 0.675411 -0.330938 0.019453 1956 2 69.6418257616386 228.8312255610251 197.4720405747738 0.384113 -0.227329 -0.015161 1957 2 71.1322711630366 239.1121045716681 200.0692940126000 0.327511 0.257003 -0.028359 1958 2 72.2852671130770 248.0935263481138 204.1575462126447 0.098506 0.208740 -0.187526 1959 2 72.8072797015528 258.9549636200404 202.9856708893841 0.082572 -0.053527 0.296155 1960 2 73.9093619008353 268.9293694642449 203.9792284855880 0.545241 0.127700 -0.061801 1961 2 74.3662162223986 278.2572876228181 199.9659017428781 -0.390285 0.618596 0.447424 1962 2 72.0603532893096 286.5266565539926 202.9370061821627 0.397580 0.326142 -0.435235 1963 2 72.5216150777363 297.1381329204141 205.4985647993079 -0.054258 0.247976 0.021416 1964 2 72.0271672442615 306.5425752704347 202.6335626730649 0.096092 -0.015413 -0.348975 1965 2 74.0204794926333 316.9350622832167 200.7094428889087 0.173342 0.177658 -0.382293 1966 2 72.3164454614695 327.0093446222563 199.4106717575050 -0.160484 0.095742 -0.023568 1967 2 70.0156817175064 337.0211151094177 196.0621819391689 -0.143405 0.361913 -0.125195 1968 2 71.1062252127238 346.5868455835052 191.9057111875758 -0.002319 0.582637 -0.013561 1969 2 81.7113102676911 355.9854595628266 197.1212565133446 -0.033815 -0.164034 -0.167585 1970 2 81.1891673666896 365.6373845358858 194.6200619360131 0.671863 0.330633 0.358433 1971 2 80.5981763225073 375.8952397864484 196.5749350135563 0.385753 -0.627675 0.229243 1972 2 81.2753784634961 385.7528227748302 199.0524469765838 0.820424 -0.216617 -0.549868 1973 2 82.3099984020268 395.8106746633654 197.7145096894472 -0.314392 -0.432988 0.844965 1974 2 82.9844278569498 6.6182535059750 198.6461520834742 0.419225 0.130683 0.294589 1975 2 83.4705925150151 17.1338191868748 198.9997199702919 -0.317328 -0.388053 -0.028636 1976 2 85.3309178607781 26.0929615463967 193.9701880434242 0.109099 -0.160732 -0.183617 1977 2 85.7899149247593 36.7982135227136 194.4460774472682 -0.289544 0.274510 -0.227311 1978 2 83.8267256327232 46.9102606588088 195.4505252802721 -0.133057 0.162684 -0.074814 1979 2 83.4584903716204 56.9492539112512 197.0817829074470 0.100399 -0.064537 -0.250440 1980 2 83.2370599596668 67.8183955777762 197.5965826171891 -0.211996 0.718565 -0.157027 1981 2 83.8980945474887 77.1022270616917 198.3245077277745 -0.253518 0.031219 0.107199 1982 2 82.5615039379285 87.5332190054872 196.8666259792804 0.224329 0.443878 -0.423149 1983 2 82.3259423246867 96.4505350694041 200.1892227119915 -0.096724 -0.369258 0.219331 1984 2 81.2551512665761 106.2929395593909 198.1463158302061 0.231319 -0.517394 0.162907 1985 2 82.1007864392393 116.7854947641064 200.5146361311673 0.168395 -0.318710 -0.112112 1986 2 82.2384164252814 127.1481287733504 199.3630913178559 -0.085931 -0.337695 -0.068993 1987 2 82.4373455121082 137.5341414766843 200.6044740341097 -0.110627 0.418560 0.309675 1988 2 82.7787326311820 147.3507518324804 199.5951660965452 0.416358 0.130507 -0.066267 1989 2 83.1545165520128 157.2942507624324 199.0489339608998 -0.095013 -0.064637 -0.326955 1990 2 82.0425644984868 168.1848241882724 199.2102169634106 0.301775 0.035027 -0.729453 1991 2 82.5920317587787 177.5121421976926 196.4985338137619 -0.481558 -0.076674 -0.129629 1992 2 82.5325803264171 188.1100727684966 195.6971846667989 -0.070649 0.262170 -0.290247 1993 2 84.2874349017750 198.4197105796420 197.4236140203893 0.075910 0.236045 0.169338 1994 2 82.6880254298482 208.4372916298605 198.7085389803050 0.081477 0.597927 -0.018135 1995 2 79.9780488828174 218.2915071493682 195.0718306255229 -0.136590 -0.146586 0.010518 1996 2 80.5731946428815 228.2556560641025 197.2297160887140 -0.901959 0.542233 -0.268334 1997 2 82.0606481424011 238.4794171802821 200.8559081028640 -0.237270 0.421182 0.483778 1998 2 83.1385755759410 247.8289182474221 203.8540649699682 -0.180665 -0.256426 -0.150589 1999 2 83.4834273744487 258.1553147910016 202.5983267750083 -0.138559 -0.118091 -0.132610 2000 2 84.3106452640625 267.2697259626578 202.7637254750228 -0.104847 -0.000463 -0.014917 2001 2 84.1753226319318 277.4584877024993 200.3399268393601 0.554920 -0.417838 0.022316 2002 2 82.3068787715260 287.3788874159928 201.0977585907112 0.313522 0.074775 -0.128526 2003 2 81.0932704986420 298.2301581140848 200.6840388296616 0.129268 -0.006761 0.109834 2004 2 81.6534571710739 306.8090160944741 203.4602063321129 0.090123 -0.228619 0.400686 2005 2 83.6438168733351 314.4598458414090 197.9675281891241 0.313188 0.367172 0.365400 2006 2 82.3998958398295 325.2904663504459 197.9239358322787 0.255260 -0.075815 0.241982 2007 2 78.8122252195035 334.4946801198776 197.7015785693268 -0.108572 -0.045777 -0.019518 2008 2 80.4722727724474 345.2210473834099 197.1182403615425 0.162389 0.398141 -0.140858 2009 2 91.8619542988333 356.4276724673908 199.5045659219109 -0.384492 -0.208148 -0.052627 2010 2 91.8303722846798 366.6168671924430 196.3897956192805 -0.109870 -0.260468 -0.023350 2011 2 89.9972100924718 377.3915973687488 197.2591128756611 -0.104153 0.111975 0.121652 2012 2 91.2054631340777 386.3730767089289 200.5902214325961 0.124887 -0.323456 0.315872 2013 2 92.5343173288931 397.2186169284272 199.6277133745792 -0.195001 -0.120868 -0.015257 2014 2 92.8435099546335 6.6612109416865 201.2660667910490 -0.003373 0.258857 -0.489072 2015 2 93.4561549991070 15.8205179606761 196.1286013665572 0.395388 -0.368690 0.070568 2016 2 94.8727922759129 26.2579501398638 195.4813169739301 0.055612 0.440690 0.049064 2017 2 96.0649761498224 36.5633776296078 198.2395564966236 0.376822 0.135854 0.330268 2018 2 93.3345174754375 45.7714912650850 200.1079196968281 0.320673 0.246226 0.356418 2019 2 93.2593229532558 56.4295081645856 200.5202390722248 -0.049230 -0.017891 0.041772 2020 2 92.7707307040953 66.7624410184684 198.8694960927405 0.334927 -0.481835 -0.430960 2021 2 93.1106567345306 77.2046792475244 197.4317381077871 -0.685044 -0.013770 0.077318 2022 2 92.4583475060042 87.7795486069169 198.3767632150016 0.445167 0.473385 -0.236960 2023 2 93.0491149119866 97.8249211555092 200.6017689084805 -0.202085 0.020423 -0.245832 2024 2 92.0755619750349 107.7874231778242 199.3480360410863 -0.242113 -0.230125 -0.218848 2025 2 91.0657499596201 118.6673666518245 198.6988173811378 0.853524 0.153799 0.254673 2026 2 92.2211183206543 128.4219418209982 197.5609522405047 -0.318905 0.141469 -0.114689 2027 2 92.7038570420153 139.0937322465499 198.9417302138217 -0.021154 -0.203525 0.020426 2028 2 92.3153771155352 148.5234752229069 194.2729260012281 0.070630 -0.121997 0.096602 2029 2 93.0929844792278 159.0851095120544 196.9767709026122 0.280861 0.407351 0.184695 2030 2 92.1812292795949 168.7409082707318 198.1552203846729 -0.217419 0.262915 -0.377867 2031 2 92.9007204455261 178.3332457161723 199.9961838620005 0.706599 -0.114403 -0.349048 2032 2 93.2843685415906 188.1868064489206 197.9640817630222 -0.370773 0.080400 0.045174 2033 2 93.1502197259336 198.7237013693669 195.1280078873199 -0.253078 -0.486251 0.320995 2034 2 91.3809797132978 208.8449004484032 191.9982006815172 -0.077712 -0.262932 0.567098 2035 2 90.8842400196069 219.2711532899629 194.7368335274876 0.105029 -0.196233 0.765333 2036 2 90.9720510185257 228.6455322999861 198.9581936804443 0.480222 0.100402 0.075377 2037 2 91.9010310779387 236.7832077508608 204.7921974857679 0.144084 -0.257451 -0.423714 2038 2 93.3128060970678 245.8695135012848 205.3289850738764 0.257575 0.210645 -0.172034 2039 2 93.2542512404658 256.1454608631521 206.2722796925572 -0.049419 -0.239956 -0.584843 2040 2 92.9890537351167 266.5632545159496 206.3657541534057 -0.046850 0.161334 -0.232479 2041 2 94.1872382011099 275.3711546681442 203.5584850393992 0.569529 0.364202 0.689228 2042 2 92.9020099768278 285.0031761247101 200.1328083194094 0.111256 -0.216324 -0.077949 2043 2 91.7644692270765 295.8760569530275 200.9182421451684 -0.315932 0.070688 -0.062668 2044 2 92.3339484218390 306.4066941122115 201.0458134983735 -0.021744 -0.260978 0.446368 2045 2 93.6641680966562 316.2915455912377 199.2123063173321 0.166452 0.628232 0.068997 2046 2 92.4662347777716 326.2838892308100 197.9604651472503 0.179561 -0.008029 -0.462331 2047 2 88.8635064780624 335.1782182675226 199.8421228455082 0.771445 -0.014191 0.105079 2048 2 90.6853007268748 345.5976993467858 198.4555224951960 -0.400089 0.211874 0.179580 2049 2 100.8288545847002 354.9756427986935 201.4487039259791 0.565370 -0.008582 0.067408 2050 2 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3267 3307 3268 3269 3268 3308 3269 3270 3269 3309 3270 3271 3270 3310 3271 3272 3271 3311 3272 3273 3272 3312 3273 3274 3273 3313 3274 3275 3274 3314 3275 3276 3275 3315 3276 3277 3276 3316 3277 3278 3277 3317 3278 3279 3278 3318 3279 3280 3279 3319 3280 3281 3280 3320 3281 3282 3281 3321 3282 3283 3282 3322 3283 3284 3283 3323 3284 3285 3284 3324 3285 3286 3285 3325 3286 3287 3286 3326 3287 3288 3287 3327 3288 3328 3289 3290 3289 3328 3290 3291 3291 3292 3292 3293 3293 3294 3294 3295 3295 3296 3296 3297 3297 3298 3298 3299 3299 3300 3300 3301 3301 3302 3302 3303 3303 3304 3304 3305 3305 3306 3306 3307 3307 3308 3308 3309 3309 3310 3310 3311 3311 3312 3312 3313 3313 3314 3314 3315 3315 3316 3316 3317 3317 3318 3318 3319 3319 3320 3320 3321 3321 3322 3322 3323 3323 3324 3324 3325 3325 3326 3326 3327 3327 3328 3329 3330 3330 3331 3331 3332 3332 3333 3333 3334 3334 3335 3335 3336 3336 3337 3337 3338 3338 3339 3339 3340 3340 3341 3341 3342 3342 3343 3343 3344 3344 3345 3345 3346 3346 3347 3347 3348 3348 3349 3349 3350 3350 3351 3351 3352 3352 3353 3353 3354 3354 3355 3355 3356 3356 3357 3357 3358 3358 3359 3359 3360 3360 3361 3361 3362 3362 3363 3363 3364 3364 3365 3365 3366 3366 3367 3367 3368 3368 3369 3369 3370 3370 3371 3371 3372 3372 3373 3373 3374 3374 3375 3375 3376 3376 3377 3377 3378 3378 3379 3379 3380 3380 3381 3381 3382 3382 3383 3383 3384 3384 3385 3385 3386 3386 3387 3387 3388 3388 3389 3389 3390 3390 3391 3391 3392 K.LIST OF PARAMETERS Temperature Number of Atoms Volume Potential Energy No. of type3 No. of type8