108 Lattice="11.336411930795986 0.0 0.0 0.0 11.336411930795986 0.0 0.0 0.0 11.336411930795986" Properties=species:S:1:pos:R:3:forces:R:3 energy=-534.6937688076488 stress="-0.008758714238035549 -0.00028417745384532735 -0.0001677331465151148 -0.00028417745384532735 -0.009150314855719455 -0.00033515034398546136 -0.0001677331465151148 -0.00033515034398546136 -0.009089477564783264" pbc="F F F" Pt 0.03146881 0.01392631 0.01308360 1.38574213 1.38544029 1.40951961 Pt 1.88836341 1.90101147 0.02589251 -0.59612582 -0.57514447 -0.41750503 Pt 1.86316972 0.02206933 1.87038232 -0.42049705 -0.39946423 -0.56522702 Pt 0.00400418 1.90268628 1.90931875 -0.30731978 -0.48135572 -0.62676514 Pt 3.76379675 0.00398595 0.02302329 -0.03862201 0.85067735 0.90796229 Pt 5.60951685 1.86476613 0.02649790 0.26315246 -0.57759576 -0.60565255 Pt 5.73178463 0.00590524 1.91211654 -0.23626996 -0.46409105 -0.60426637 Pt 3.76760552 1.91288643 1.87900620 0.16135886 -1.04350483 -0.58432639 Pt 7.53313996 0.03239233 0.01468149 0.38229958 1.06790756 1.08063445 Pt 9.46351743 1.85186395 0.01135179 -1.12982832 -0.32405223 1.17351149 Pt 9.47974084 0.00321294 1.88701369 -1.31589198 1.28319102 -0.26219746 Pt 7.59043671 1.87817862 1.88845587 0.64249424 -1.00861971 -0.87051690 Pt 0.01542965 3.79897144 0.03167058 0.77872881 -0.09171257 0.75669072 Pt 1.90861451 5.66624394 0.01389134 -0.67396323 0.18236512 -0.61824830 Pt 1.91083585 3.78930933 1.91131729 -0.97361033 -0.15650445 -0.93227013 Pt 0.01292894 5.65053930 1.85256934 -0.46997641 0.29942701 -0.42000712 Pt 3.77578942 3.79022819 0.00442249 -0.09379084 -0.18673128 -1.01527671 Pt 5.65336875 5.65213030 0.03722275 0.36943617 0.21240226 -1.16824106 Pt 5.70526383 3.78646244 1.86841750 -0.12604244 -0.37527089 -0.65834870 Pt 3.81229906 5.65076127 1.85451924 -0.47944064 0.31699939 -0.39738346 Pt 7.57622795 3.75161590 0.03449552 0.55586370 -0.10266654 -0.88377937 Pt 9.45295519 5.63583045 0.03043902 -0.93200838 0.19144586 0.87944254 Pt 9.42545076 3.75545296 1.86464554 0.90508812 0.02544215 -0.56366926 Pt 7.58138731 5.66223669 1.87907908 0.79922916 0.47048168 -0.88265091 Pt 0.02878155 7.57140291 0.00862634 1.18913316 0.26373504 1.16330037 Pt 1.88298173 9.46281571 0.02516094 -0.23621567 -1.23207039 1.16903135 Pt 1.89461537 7.58544333 1.87864429 -0.82380620 0.59066662 -0.72963706 Pt 0.03426308 9.43860895 1.92361319 1.03960083 -1.03282699 -0.33272514 Pt 3.80737153 7.54100683 0.01268181 -0.15597014 0.86371289 -0.59973872 Pt 5.70542422 9.48414542 0.00445128 0.00839960 -1.01169255 0.98847850 Pt 5.63953873 7.57157191 1.91025935 0.13983426 0.77180180 -1.09847004 Pt 3.78170797 9.46319407 1.87935727 -0.07885668 0.44225059 -0.59481512 Pt 7.52067341 7.57823792 0.01110535 0.71144742 0.58182489 -0.01223745 Pt 9.46464110 9.45261246 0.02035064 -1.54820402 -1.48294304 1.53768481 Pt 9.45110835 7.58519727 1.92382753 0.17993830 0.48244023 -0.83556758 Pt 7.53141019 9.47842139 1.90822746 0.70899003 0.32420347 -0.97863372 Pt 0.03689632 0.02916538 3.75040227 0.65413549 0.66307270 -0.02565757 Pt 1.90370305 1.87325803 3.78086171 -0.79669787 -0.62070035 -0.15190222 Pt 1.89883715 0.00915778 5.65285645 -0.58933774 -0.53520442 0.23276228 Pt 0.02903710 1.90645007 5.64280552 -0.67361377 -0.73950114 0.11080105 Pt 3.79412354 0.01630524 3.76837461 -0.02651984 -0.82737117 -0.19430676 Pt 5.67110140 1.92663300 3.79243222 0.18553726 -0.97600264 -0.45144429 Pt 5.68662145 0.03624647 5.64885705 -0.21655671 -1.04530777 0.19985454 Pt 3.78171346 1.89804884 5.65192525 -0.35862463 -1.04684234 0.22382043 Pt 7.52878361 0.02524953 3.80988840 0.91911484 -0.61859861 -0.12254560 Pt 9.41546024 1.91394756 3.76199961 0.65764527 -0.81085388 0.12741779 Pt 9.47319427 0.01256456 5.70429714 -0.95971881 0.94575684 -0.00307063 Pt 7.55402817 1.86882240 5.71936424 1.06726744 -0.61698655 -0.44331571 Pt 0.01846979 3.79942161 3.77811096 -0.99998930 -0.17162218 -0.13605965 Pt 1.89395820 5.63859712 3.79185841 -1.07867586 0.47016085 -0.74730806 Pt 1.89045686 3.80256349 5.66427542 -0.99151408 -0.47576059 0.01576165 Pt 0.00381288 5.68683168 5.64641358 -1.03530263 -0.07226606 0.21960035 Pt 3.80343829 3.81388599 3.81418001 -0.19795622 -0.51411042 -0.62214375 Pt 5.64997406 5.64983931 3.78306685 0.35982194 0.43488894 -0.06161252 Pt 5.65264185 3.74492435 5.68992684 0.36636799 0.50319142 0.12021096 Pt 3.74291795 5.67110693 5.63982649 0.70664325 0.33759295 0.68956202 Pt 7.57165580 3.80776113 3.76307056 0.74292084 -0.37700705 0.28129868 Pt 9.43803915 5.64656399 3.78896061 0.80148942 0.19146608 -0.05885214 Pt 9.45074613 3.74387129 5.68608176 0.74232546 0.05790639 -0.01637996 Pt 7.53196034 5.65474776 5.65743976 0.93424423 0.18468430 0.26659927 Pt 0.00871167 7.57066620 3.81088718 -0.52870702 0.48903389 -0.40560242 Pt 1.89408372 9.48194388 3.77256340 -0.52621945 0.48909374 -0.11946081 Pt 1.88251787 7.54041282 5.63206040 -0.94160245 1.17421783 0.42827517 Pt 0.03619761 9.43666574 5.64014111 0.69684678 -0.71868299 0.09779032 Pt 3.73835510 7.54860297 3.80538122 0.35518132 1.04039053 -0.49532408 Pt 5.70373988 9.43274261 3.73447522 -0.26638298 0.99661839 0.27894051 Pt 5.70901069 7.57243941 5.67727167 -0.32490934 0.71123013 0.09506128 Pt 3.77875754 9.42900884 5.63836593 0.09331241 0.82046585 0.20061016 Pt 7.53688059 7.59124663 3.72203137 1.08807360 0.42397127 0.46575136 Pt 9.41062406 9.45215132 3.71300157 -0.77643179 -0.77688477 0.07632355 Pt 9.42429988 7.53538153 5.63488767 0.32483239 0.66917753 0.10352267 Pt 7.54242112 9.45596053 5.71799703 0.76791917 0.48329200 -0.15363697 Pt 0.02487529 0.03177069 7.57223098 1.25675627 1.23362529 0.28328711 Pt 1.88358757 1.92627033 7.56123223 -0.80723010 -1.35041422 0.76077993 Pt 1.92669589 0.02089599 9.46921796 -0.35177422 1.19069128 -1.21142905 Pt 0.02938755 1.88797798 9.46362659 1.11971663 -0.34236686 -1.12632490 Pt 3.75774677 0.03414076 7.56701422 0.00678830 -0.53818955 0.63952108 Pt 5.62172912 1.92453487 7.54737258 0.14026134 -1.25119723 1.39069038 Pt 5.71153129 0.01630221 9.45936446 -0.02260136 1.03467582 -1.03446250 Pt 3.72982703 1.89729146 9.47167809 0.22805161 -0.67311714 0.49200509 Pt 7.55156510 0.01065601 7.52389098 0.51059445 -0.35719582 0.85058681 Pt 9.43982506 1.87889672 7.57241335 0.46031724 -0.63819747 0.66480722 Pt 9.41495363 0.02260077 9.42177028 -1.43640337 1.38691357 -1.41914225 Pt 7.53058722 1.89580185 9.45026259 0.60374037 -0.66959971 0.20706589 Pt 0.01618859 3.72649020 7.53833923 -0.68559771 0.24624879 0.75292843 Pt 1.89471352 5.64970179 7.52652594 -1.15582884 0.32543115 1.38951279 Pt 1.88826737 3.73847994 9.46254435 -0.73004365 0.24772238 0.62764168 Pt 0.03411704 5.66071406 9.46821374 0.98792853 0.02644958 -1.05592233 Pt 3.74451916 3.79864779 7.57186066 0.20495834 -0.15813801 0.94771121 Pt 5.63520165 5.65855136 7.59084314 0.39371665 0.24452051 0.58529982 Pt 5.68960262 3.77383734 9.45866439 -0.09871533 -0.02634865 0.74903621 Pt 3.76588614 5.67254286 9.44605395 -0.16926147 0.10401326 0.82350499 Pt 7.57397572 3.74304232 7.56119093 0.63693527 0.35360203 0.97050051 Pt 9.41001460 5.63224137 7.55822001 0.51645959 0.35631707 0.58573217 Pt 9.47057545 3.81446023 9.41519876 -0.88898070 -0.10598547 -0.75791904 Pt 7.56748386 5.64212715 9.47726201 0.55296713 0.26542434 0.19900724 Pt 0.00086731 7.53496223 7.53589342 -0.20570482 0.55740871 0.68173564 Pt 1.87545370 9.41598201 7.55096852 -0.52464963 0.38736229 0.61373821 Pt 1.86520631 7.56707358 9.43198875 -0.50895246 0.52187019 0.24194235 Pt 0.01366468 9.43946692 9.42468378 1.42997827 -1.45088138 -1.41165170 Pt 3.74445025 7.58728314 7.55280479 0.32724672 0.79967932 0.91345204 Pt 5.70426938 9.45809041 7.58699607 -0.22710424 0.33062092 0.65741353 Pt 5.64788947 7.52316861 9.45676081 0.14441560 0.76475745 0.29860277 Pt 3.79138680 9.47100283 9.47083239 -0.04972990 -1.13037700 -1.09259423 Pt 7.56945840 7.58426692 7.55348150 0.92313638 0.42979694 1.19161838 Pt 9.46143158 9.44051760 7.56043942 -1.26991784 -1.27425241 0.32975265 Pt 9.44810910 7.58824331 9.47829197 -1.37328360 0.20814815 -1.39541364 Pt 7.58012779 9.44723438 9.42824823 0.30259501 -1.25169534 -1.17645475