216 Lattice="15.0 0.0 0.0 0.0 15.0 0.0 0.0 0.0 15.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=18094122.707687117 stress="-89823271.59314905 32509052.63502735 20086541.582918763 32509052.63502735 -94091403.3347466 -12133085.7604599 20086541.582918763 -12133085.7604599 -33555981.49543169" pbc="F F F" Pa -0.29624014 -0.19636383 -0.07122744 -19.62625591 -16.43268116 -18.08785127 Sb 1.55428783 1.28638493 1.55630051 -115.02454601 -105.39795112 40.15095408 Ge 2.53562396 2.79145997 0.44731045 -2946726.97978444 -3369670.74173773 -2743021.38864691 La 3.19946440 3.55058634 1.06523140 2953392.80959519 3363100.26528295 2734725.89657379 Sb 2.79497004 -0.38441542 2.55681689 -300.86551238 -128.25923793 -305.60559346 Db 3.47348180 1.33519998 4.39425498 -11737.42480348 19366.43087898 1662.04244576 In 0.45517154 2.88697925 2.85518112 -3044.04539585 -4593.10818730 -4096.12956096 Cr 1.15529429 3.96032225 3.81553965 2568.36225887 4159.92660251 4757.79317586 Lv 4.22229020 -0.04738524 0.04800209 -84.29311477 -61.08588613 -51.32208940 U 6.24716732 1.51956544 1.15994681 -14160.26551467 -1068.55018150 13230.26033988 Nh 7.28449198 1.66373602 -0.09113084 14307.15344225 2024.72319577 -17337.95409955 Rf 8.86478872 3.78385176 1.03158064 -3489.74720973 2679.12217709 -3548.88302944 Cn 6.71353994 0.29742119 2.15045062 994.69129556 -2605.28905549 2112.12290955 B 8.39473002 1.55125676 2.93231077 -28.27609946 -19.96827756 11.90686952 Rh 5.45621244 2.74073291 2.60979409 -1058.02686467 1707.88945121 2102.61030677 Cu 7.16310854 3.57357049 4.61256335 1.06340721 5.45686310 -5.47471793 Gd 9.71161503 0.78988493 -0.21326229 -2247.84276425 -1083.09601203 -2654.85351654 Rb 11.22038272 1.47161381 1.51349380 -149216.84100782 95585.94216281 -75587.40458775 Al 12.24337627 2.19686554 -0.10327453 1450.97725893 1032.31526731 -2274.12710485 He 13.78758621 3.73645174 1.09184833 0.47611209 -0.42080866 -0.29899488 Br 12.35151227 0.73183726 2.06017289 157715.06881373 -103168.39905261 76210.61353018 Ac 14.02209578 1.77589201 4.16715705 99.72373425 -731.93739982 -725.02189286 Tc 9.90538560 2.77026583 2.24672123 -4948.71735202 4153.20124155 7533.15475775 Hf 11.24264668 4.27056585 3.46236297 -22091.30612131 -12805.17302308 31781.16010107 Rb 0.46186966 5.88055558 -0.01276151 -5245.90326037 -8152.46224896 -12439.52803066 Pr 1.10726044 6.90624402 1.75589453 5403.10397247 -7645.27984949 20839.14689634 Lr 1.83859543 7.76726050 0.20613470 7352.61588415 8766.99844791 -13913.19135399 Mn 4.47917420 9.22906104 1.10952901 -2721.03164187 -2647.79332497 3299.36674100 I 2.14514939 4.55649986 2.33561782 -6370.12167537 6853.30022489 7632.31104194 Bk 3.66799763 6.94152950 4.01904505 -2227.55470097 -2141.45605526 4746.22469459 Be 0.05780335 7.85702878 2.49734633 -7630.88748710 6894.45998696 5383.31418235 Rg 1.46435309 9.04383805 3.38127073 -764160.68564380 -1316600.10418693 1689610.34240097 Pu 5.42212227 4.31123285 -0.25093682 328.57221850 106.52838361 -229.98385061 Mg 6.37096061 5.74992083 1.41920703 -430.15771333 122.18799003 -140.11117745 Ho 7.62779268 8.15947073 -0.11117508 -5803.77339004 -3706.88047189 -4272.30780177 P 8.87542943 8.95119318 0.81219636 -9125.57320818 -22809.15606910 14953.27655241 B 7.74485064 5.43180104 1.92909956 437.75695800 -82.01231380 178.53963240 Os 9.23195013 6.60684067 3.79953679 38864.32335503 1040894.76733411 -491991.75321660 Yb 4.39319445 7.64054456 2.45009811 1823.78761598 1302.51123689 -4914.88495284 Y 5.67617992 9.47750168 3.19262513 3952.53819374 -1143.24584108 -5481.12754759 Nb 10.55279867 5.85818172 -0.26952095 -2387396.67009843 2473880.27688703 -5270977.00744745 Ra 11.07295720 5.31903172 0.87905103 1782117.37050879 -2286240.01481597 4771302.48718155 Pa 12.57151740 7.10181770 0.84349114 6245.70089535 9174.77031532 -1648.59432431 Br 14.02330510 8.74473890 1.62741688 595.45620781 -4.02003875 -206.79367782 Ce 12.35020888 4.90507534 1.94060410 621361.43711363 -185389.58051604 467593.92235688 Mc 13.41024565 6.31088482 3.50819536 972.86142823 1181.34531541 1415.44292818 Sr 10.35178903 7.44562510 2.14732442 -6018.91396748 -6298.85011449 -6643.40389497 Th 11.42771168 8.72340872 3.30176000 -14302540.70741904 -16011293.24522730 5853199.35556657 Ru -0.33392418 9.71500234 -0.38562408 3.91547648 2.08786319 4.48078855 Se 1.47437817 11.99329531 1.38284583 -15641.96389984 8709.10399505 29948.89735964 Ir 2.12275823 11.63754980 0.14397921 15792.37898525 -8642.82735913 -30184.59040969 N 4.10237585 13.56683032 1.07867561 -0.05673278 -6.85490888 5.12961003 Pm 1.88013493 9.75868269 2.46261392 765573.63476069 1315529.24874427 -1691203.52811517 Na 3.09626935 11.71158819 3.89535918 62968.66566658 -55190.85652396 -93933.17445831 Es -0.02360054 13.08881512 2.39558146 -4276.80983895 -1938.30791822 -5646.39850185 Cs 1.15845839 13.68278447 4.05591720 -4755.62392253 11869.62243693 -747.15300970 Rg 5.22178603 10.03959431 0.06162088 -57643.62318555 -42081.40872782 -44604.85095030 S 6.04271215 10.65184664 0.61886223 60284.80449476 44964.40163097 40905.63260107 Re 7.83350743 12.64566191 0.04950712 -10415.48979095 -4478.89547704 -16141.97787983 Ts 8.75335363 13.04148925 1.47710480 8400.81472077 6420.59990027 14787.51116528 K 8.35507570 9.73586796 2.79592736 -24121.13191732 -123886.15519974 -21304.96433265 Pd 8.64007199 11.19338336 3.05187138 20304.84136470 122057.75641489 24022.04266792 Au 5.35108734 11.98073971 2.85629340 -6290.05380390 -16849.89072610 -4490.65230518 Dy 5.93409096 13.55512799 3.26719687 5514.87833426 17334.13104117 3810.24655627 Lv 9.58981434 10.20478890 0.28062240 15071.83106546 26317.91344049 -11274.83049965 Og 11.84548318 11.41220244 1.16316425 -103.05809727 -110.96539185 105.04238355 Cs 12.85995051 12.83043000 -0.40445817 -15717.65180785 -9128.50336335 -20190.07446281 La 14.15344730 13.58956707 1.22988688 15835.11064744 9296.85271019 20006.05674294 Ac 12.27801079 9.67556078 2.95391588 14304620.65248624 16018448.91082403 -5853060.02024260 Al 13.57495175 11.29538208 3.19653149 2475.18975749 3089.08921329 470.43731186 Ag 10.00155607 11.86741331 2.29735990 5966.70841239 158.26930082 -829.01012486 Rn 10.89538730 13.91829268 4.12205031 -3.71415510 0.81412556 -3.03335547 Co -0.23215683 0.35873753 5.16075648 -1269.90149133 -2639.50498961 -1666.11459650 Ba 0.55008022 1.98233897 6.18418712 61.90852042 2291.19493965 2164.88873572 Cl 2.30911524 2.38938113 4.99918212 -985.67067551 2244.20630556 332.50794439 Ar 3.67475321 4.41350195 5.96560088 -46.44023726 -44.61344433 21.01187238 Xe 3.15348488 0.13411117 7.59260775 -140.69365428 -1308.37748207 -1471.59317967 Cf 3.26913788 1.20781424 8.79979774 -447.44921935 1622.69598295 653.67752265 Cn 0.59595767 2.16535101 8.36532175 -307.92012723 -966.05302751 -68.07906418 Fr 1.19508087 4.05268950 8.97231791 15366122.48450855 -16694974.12429887 -11430769.57534186 Lu 4.45448190 -0.16660656 4.19808830 14268.45668036 -21266.94765227 -2445.05265699 Pr 6.99639517 1.54298463 6.86497752 -2818875.79718144 30950911.51747646 1266316.22088993 Ne 7.77935407 1.86212162 4.49367710 0.17949203 -0.18224724 -0.24613210 O 8.34959891 2.88620289 6.12627824 166.28260594 228.95443027 -143.64987999 Li 7.08537845 0.56690509 6.82499688 2821862.45544933 -30953669.00535518 -1267876.05558827 Bh 8.36077600 1.98550592 8.79790887 183.76223286 395.86574258 320.11997872 Pu 5.23544033 2.71079680 7.40024279 -3643.90854036 2376.60402296 1055.05218205 Co 6.56967797 4.27987360 8.66797898 -23.26430143 -27.26823347 50.59642569 As 10.42439030 0.38102356 4.94000906 -9.59411426 -34.00398011 -61.26760690 Na 10.73143134 1.70290403 6.83160094 3167565.87931866 -3335644.47405429 -665120.24014371 Cd 12.27327792 3.11757424 5.10385966 -215.40483065 8.18159331 69.82731406 Er 14.13835682 3.57821531 6.07679191 176.19300863 685.07361625 760.16002526 Bi 11.68107132 -0.05616795 7.21357766 -89.74867738 -1468.60937753 -284.34031456 Fl 13.05582661 0.79126637 8.28658832 670.72893822 399.41670252 506.34257708 No 10.01427546 2.45822505 6.98211892 -3168082.98430304 3336710.73421812 664887.42422836 At 11.27538802 3.59288666 8.70828976 -289.96473177 635.17709720 -658.48680084 Mg 0.49051007 5.29711484 4.97815573 -238.06986318 -361.62697197 -383.03527060 K 0.92483232 6.68475137 6.36733551 -157933.48878469 -132804.20003613 84715.01891559 Db 2.00506067 7.61031018 5.77964572 156830.90806841 134025.52253178 -85534.33873792 C 3.86165126 8.98005317 6.34740852 -119.70610567 -179.48853693 253.06637256 Np 2.42422919 5.34003424 7.70995433 20149.14386067 18540.57126695 -18561.99656409 Mo 3.80514198 6.98812720 9.40192007 61299635.39811800 -38029502.41746384 -9348123.49937361 Ne 0.38283309 7.62584129 7.76465619 -8.42589158 15.66131542 22.99020324 H 1.14101429 8.25495459 8.18329343 5.26783356 -0.71757762 -3.38880544 Fl 4.88873482 5.33016795 5.26011465 23.02285324 -126.19135788 -33.46525458 Cm 6.32146913 6.94499018 6.22666590 -18774.60834940 -22717.15161099 22698.90210604 Am 7.27786704 7.82708412 5.18045231 21963.69011227 21410.32201283 -27411.75424915 Tl 8.86459605 8.48316994 5.86238454 -42741.63681837 -36726.88442910 29432.25605487 N 7.27974169 5.38026084 7.06933708 -17855.58672050 -21198.67549528 -24121.56024630 Nd 7.99563470 6.22321541 8.03543474 18184.05166649 21018.72922280 24381.12628899 Ds 4.81045020 7.12887205 7.15674383 -5675.92189428 707.16567976 3458.99331845 Cf 6.23863262 9.51180656 8.30927053 -160892.74549769 -86762.77573577 60450.41192612 Fm 9.19011721 5.49830701 4.32398984 -39460.94589320 -1041158.20258545 492691.41274262 Mn 11.26656686 5.50214104 6.11332705 -5605.00449522 -2652.55865266 -15148.63778610 Mt 11.77339783 7.91966218 5.12028563 -4805.27012216 -6290.73045548 1540.64113319 Mc 13.00814732 8.64278045 6.09598151 6451.22167237 1928.31026464 3452.20126959 Hg 11.69569614 5.70537979 7.27301415 5609.44389586 2654.90860113 15154.11995052 Cl 13.59553800 6.09008137 8.52364346 -6.20740466 0.72715222 0.24623388 Sg 10.38279571 7.87300792 7.33778648 -1642281.28877086 -3882943.19876207 -4268681.60780092 Ba 10.73868693 8.71435793 8.26275808 4233045.38794483 896047.70780567 -316684.40360984 Zr 0.33595485 10.00043669 4.67612869 -16951.21483348 -20095.93360085 -23153.39422908 Tb 1.15372073 11.11359058 5.98565820 7384.86019830 28712.64906864 20171.63866600 Bi 2.38106582 12.34085438 4.96594082 -50650.22719190 49118.50755451 97587.85742468 Ge 3.84370328 13.67258661 6.43998561 -1343.30981729 1152.05124823 -482.51619031 Mo 1.82755702 9.55564938 6.96323731 5053.90639362 -11237.79000822 7663.16941680 Hs 3.20211871 11.25703054 8.61428940 15976.51991100 -20215.68371910 -17823.43887332 Rn 0.00940831 12.58685668 6.68889407 -407.07262542 513.67886625 246.82453408 Si 1.30635142 13.00631535 8.43991599 -163.47744176 125.09788854 -120.55331850 Bk 4.59261876 9.93014911 4.90212964 -3609.27796931 1683.70281329 5778.28594380 Rh 6.27320321 11.71877094 6.86882188 47438.24005685 -35450.56433776 -1644.66874426 In 7.49635981 12.93604636 4.52484509 572.39957490 -376.64764731 327.09887055 Ca 8.62299929 13.28608839 6.18336234 -11.97440375 333.10809579 154.89329019 Md 7.41199601 10.14376555 7.86642171 160636.44793733 86214.24454618 -61048.13440494 Sn 9.00055586 10.70261969 9.03084300 -328.46512059 1285.93174685 391.19065507 Pt 5.12096547 12.58357245 6.90373195 -46309.90813644 34611.83980698 1936.53207979 W 6.65225818 13.68270121 9.60333124 -11268.29323176 30199.36897241 -6220.19521771 Se 9.75877433 9.23531175 5.29147160 44763.22313874 37737.53976056 -28543.00285823 Lr 11.89528395 11.54715429 6.14686938 -13679.50782585 24612.81347599 -33324.52118734 Hg 12.48295704 13.34497495 5.37462633 -239.87839883 46.53560130 -65.25608085 Li 14.13657700 13.55979786 5.57094654 268.92901772 31.93409269 32.16916511 Ra 12.49107263 10.47849739 7.58522198 -213807.12473966 -166746.66401066 -35267.25310400 Ti 13.82259495 11.32654165 7.98214990 230227.11515222 146607.89670439 68638.43793438 Pd 9.83056678 11.84669311 7.01963614 48.33780763 -227.09362785 200.63924514 Ga 11.60683547 14.05141680 8.62369770 0.88724331 -4.01924318 -0.50393113 Ni 0.46327567 0.17338626 10.24321743 6.42067047 5.76145844 1.22639437 H 1.57936870 1.12544367 11.05504915 -6.86236417 4.79918920 -15.66876071 Be 2.05180352 2.92621034 10.73398443 -882.58124473 -601.12676284 -162.83769315 Nd 3.62120845 3.40848727 11.57446296 -11530.61749750 4863.12839468 -2335.17293067 Eu 2.46254610 0.38132921 12.74989960 -915896.60687494 -9018.51963393 -232226.68260330 Mt 3.69471751 0.39344543 13.06239368 915857.03383379 9007.70596142 232319.96426900 Kr 0.31585740 2.31130007 12.70278416 -205.73221679 -475.19332947 -353.17572235 Sm 0.89532885 3.65062746 13.69633983 184.03778065 457.93392724 371.68000564 Hf 4.49540876 0.49940588 10.55818940 -12371.38781239 -868.59173927 -6295.21358547 Nb 6.24735726 0.55126708 11.49744660 -189895.37228930 121374.08287845 -106740.62344475 Nh 7.06398287 2.75890269 10.30936790 -65.77371269 63.73245578 93.97019691 C 8.55875011 3.56428880 11.79421002 -269.39077266 307.30742233 -293.86906630 Fr 7.64387982 -0.28344333 12.27913687 202253.93828189 -123313.30530881 112298.56329519 Hs 8.33854440 1.56388479 13.61734719 -106572.03447149 -53990.01190454 49572.55333201 I 5.17654423 2.53375292 11.74124278 13720.64186546 -7309.40727274 1623.12476693 Ga 6.80254039 3.61850493 13.78241093 -8.35377276 -47.43312256 25.97719357 At 9.66339932 0.55399205 9.68956829 264.70182967 -335.23468268 164.21233971 Os 11.39672403 2.01100100 10.80352864 -3433134.65247486 -1611979.89848083 4615576.91781999 No 11.99359139 2.29124405 10.00110154 3433586.98436844 1611345.07996564 -4614981.97977662 Sc 14.17724207 3.99519694 11.10655857 72.10484036 -41.46782621 -98.20945631 S 12.40497791 -0.23763561 13.22063722 -9.13666481 -4.96919671 -5.33262679 Bh 13.63014403 1.62263366 13.91639096 0.74012861 13.77319438 -1.47301608 Pm 9.68541315 2.26499774 13.01151747 107131.71505398 55151.11990101 -47901.77948065 Md 11.26557201 4.17674637 13.27293898 -46939.85135664 -23382.11166478 6505.55249294 Sg 0.45691835 4.85281835 9.52168982 -15385032.40462163 16676307.62001175 11449969.15559272 Pt 0.50577609 5.74334949 11.55596889 17091.67090253 -40854.59269119 -15930.33646250 Rf 3.00662097 7.48352142 9.52369547 -61299562.64718297 38029681.46985815 9348288.05992897 Fm 3.70494784 8.77839398 12.02938543 1855937.81950481 -810320.09791162 -247125.61331559 Ir 2.93012984 5.19812634 12.36980803 -1313.99961801 2762.31668787 878.03219711 Am 3.09809023 6.63233835 13.95793080 -65.08927026 395.53320021 781.17460925 Cm -0.06672862 7.11609407 12.09863185 -17095.73495191 40990.37976913 16199.44169873 Po 1.90944769 8.92912305 13.03152409 -312440.92285766 -142125.69945145 350798.85170187 Kr 4.40233653 4.87326936 9.84661603 0.81935169 -3.59589128 -14.79604284 Gd 6.02405404 5.70900706 11.53804157 -778341.87400679 38342.01777138 -588642.74426179 As 7.10135078 8.10942958 9.73926770 58.15625443 -94.15118975 148.84570550 Og 8.64811046 8.49989326 11.62919204 -15.82627900 12.94505294 -25.66677657 Ho 7.20814712 5.65045229 12.43321158 777466.94598521 -38808.45219700 587917.20256809 Fe 8.90284994 6.19869077 13.41921246 -1711.03813666 -3404.44112799 850.04330907 Es 4.23710566 7.47354937 12.11609339 58530.94636790 -143246.94369228 9396.49184105 Ce 6.23860540 9.49570075 13.48227657 -25456.45637815 -19891.58789825 16699.49960585 Np 10.14808934 5.57595692 10.20590232 -11221.95461359 -12855.07280398 -9161.17449389 Si 11.13044501 6.70485783 11.01642420 11107.18950297 12824.06950633 9325.67396915 Ag 12.68713283 7.72993748 10.18328939 157.92808182 53.35475698 -16.70122607 He 13.71821135 8.89833904 11.97504201 -0.04816887 0.02020924 0.01003393 Sc 12.69914966 4.89980749 13.07799510 47132.88509467 23774.11423225 -6413.14499891 Ni 14.11085821 6.48078768 13.77715249 135.99417716 155.87676175 66.54931443 Re 9.95061409 7.59981826 13.33909045 -285.57986878 1893.36993055 -17.33734662 Cr 11.53446935 8.54004486 13.24711488 -272.00477605 -5902.72811076 821.41956961 Pb 0.18826942 10.31723551 10.60679784 -1268.61410465 -1216.60892135 -582.72312102 Ar 1.10728075 11.19075632 11.02528963 1282.90445627 1186.43550440 561.11881024 Cd 2.49902366 12.11137358 9.29627286 -17070.76517068 20821.45753504 16844.29589652 Ds 3.33860103 13.95137677 11.75885533 9.61725270 -5.44711917 -7.04554120 Ru 2.68905418 9.28461367 12.15531676 -1602167.66150459 1095707.31785267 -113314.65635391 Te 3.03044205 11.26514210 12.95430735 53.10986537 255.26841198 96.52930298 Ca 0.54389785 12.58723063 12.14488262 -405.94826473 -251.67382188 -464.68629193 Po 1.69937074 13.40172099 13.55833376 387.20681597 283.26977546 492.96200284 Er 4.64135300 10.43402412 9.86190288 374.33145358 -816.47492557 239.53610824 Dy 5.88278220 10.85397451 11.78688856 -41.43469439 4111.10921064 -5876.00655353 Au 7.21929338 12.16098076 9.91617779 11268.59116317 -30177.09522433 6176.77177390 Eu 9.62162954 13.60334161 11.07850960 -67.10318521 172.26736798 -189.88953171 Zn 7.54212156 10.22051303 12.97264883 24812.55295512 12745.48253473 -11852.88656945 V 8.55341648 11.22993108 13.70768606 2149.77142991 2123.97169979 1507.33967838 O 5.03084234 12.16688756 12.50915035 -749.32364220 1144.72550271 630.93616629 P 6.93532833 14.02917187 14.09738564 1.14869577 -4.53970501 -2.84990444 Pb 10.21888429 9.31234569 9.18198846 -2592750.04908942 2982749.35333377 4586760.32203117 F 10.91459635 11.27112512 10.82876979 0.16099643 -1.32479939 -0.74437721 Fe 13.27323345 12.68320692 10.15168259 -13722.49344483 -18628.06602571 -16469.76558815 Cu 13.94550165 13.59631466 10.95925661 13715.04625221 18630.59644119 16479.03903900 Lu 12.26905420 10.22066758 13.02873108 -191146.46469278 -150582.78633357 -26895.21743882 Tm 13.47626723 11.20325239 13.18935716 194527.77475387 158329.81422272 25880.37135001 F 10.13701512 12.43606312 12.37698369 77.23106482 -174.77882008 196.09702492 Ta 11.64003297 13.99379571 13.96142781 -2.51849921 -3.51524254 -3.05658704