108 Lattice="12.82242260327328 0.0 0.0 0.0 12.82242260327328 0.0 0.0 0.0 12.82242260327328" Properties=species:S:1:pos:R:3:forces:R:3 energy=-232.79859446218694 stress="-3.3629197298945694 0.6729354943619237 0.03385103808740553 0.6729354943619237 -3.386154849699608 0.2554632511637749 0.03385103808740553 0.2554632511637749 -2.1435932092426118" pbc="F F F" Si -0.02355736 0.03378980 0.01876367 1.18953092 1.22892411 1.26279923 Si 2.12298832 2.13989756 0.03590877 -0.21424586 -0.45844017 -1.33885792 Si 2.10841682 0.01542554 2.10119927 -0.09506632 -1.45032061 -0.46746794 Si -0.03265168 2.11069648 2.13447045 -1.15855152 0.30685917 0.17246762 Si 4.28918198 0.01202033 0.01211619 -0.17666324 0.86323628 0.95836522 Si 6.39381432 2.13641056 -0.01657467 0.46980727 -0.58647813 -1.25933373 Si 6.40637635 -0.00763337 2.08990819 0.59027360 -0.81951977 -0.01650203 Si 4.31500365 2.13759553 2.13541107 0.04450388 -0.45608156 0.13765290 Si 8.52307511 -0.03642214 0.01372090 0.52234357 1.58077831 1.71823392 Si 10.65879180 2.17558758 0.00438017 -0.96586138 -1.05187415 0.91057191 Si 10.66750478 -0.01516061 2.15337161 -1.57063498 1.33363900 -0.59651930 Si 8.59497855 2.15004920 2.12532356 -0.02053497 -1.91117213 -0.35661348 Si 0.02241181 4.25459841 0.01393620 1.06732855 0.14581681 1.23175541 Si 2.12224908 6.42565138 0.03363865 -0.61777066 0.00306148 -1.39601114 Si 2.16157015 4.27591565 2.10773428 -1.43087930 -0.35797724 0.41530713 Si 0.00583291 6.43167639 2.16537230 -1.42872723 -0.79619508 -0.45635848 Si 4.29037098 4.28095254 0.03992616 0.19720390 0.18020394 -1.53121801 Si 6.41779320 6.41375176 0.00114451 0.00357558 0.37318993 -1.06995449 Si 6.46300212 4.27026488 2.11865824 -0.81926023 0.35918988 -0.86860577 Si 4.28710629 6.44859578 2.13283764 0.49599147 -0.01133476 -0.96579849 Si 8.54515667 4.24516426 -0.01184542 0.12167208 0.41631091 -2.14390058 Si 10.68399903 6.38217349 -0.00263534 -1.29061651 0.24931851 1.23434296 Si 10.65911017 4.28116952 2.08610525 1.72399312 0.60096121 0.21229551 Si 8.54940043 6.40858397 2.14020279 1.32785754 0.57218857 -0.66109681 Si 0.03689419 8.54040677 -0.03107151 1.06760402 0.44297981 0.90993609 Si 2.08478251 10.67091595 0.02919191 -0.18297674 -1.42851878 1.27832821 Si 2.09906408 8.53493189 2.14229580 0.64493413 1.18689660 -0.35476510 Si -0.00535433 10.65331754 2.16920645 1.24422583 -0.95101411 -0.29265960 Si 4.31151560 8.58206873 0.00623319 -0.47236287 0.34263254 -1.13946465 Si 6.39883473 10.67822810 0.02451872 0.52737601 -1.04659799 0.79364287 Si 6.41616911 8.56759284 2.17899950 0.34981220 -0.24803380 -1.97057448 Si 4.31655843 10.66151574 2.12650317 -1.14889030 1.32976727 -0.42808777 Si 8.56306883 8.52444775 -0.01378290 0.18367603 0.34755201 -0.69106740 Si 10.66459652 10.66399006 -0.03386076 -1.44476376 -1.50142828 1.42111982 Si 10.65885286 8.59914154 2.12587122 0.84258892 -0.01463586 -0.22403540 Si 8.55345591 10.67489799 2.14625341 0.59314033 1.40431585 -0.96898854 Si 0.02222065 -0.01710837 4.25736288 1.30132089 1.55077068 0.43820229 Si 2.17629169 2.07207035 4.24165241 -1.19206527 0.70454412 0.50396144 Si 2.17399360 0.00263564 6.41183029 -1.74864249 -0.84812832 0.04395778 Si -0.01134142 2.17429389 6.43126397 -0.17412139 -1.02549214 -0.37819731 Si 4.30331660 -0.01830367 4.21124298 0.70175593 -0.94778314 0.24719373 Si 6.46052456 2.17687651 4.30880053 -0.81495083 -2.58008022 -0.35823658 Si 6.39094997 -0.02369412 6.42781578 0.10902708 -0.78094059 -0.39088978 Si 4.25350135 2.09700909 6.41143602 0.46262231 -0.76355424 -1.45575195 Si 8.54696353 0.00270449 4.26087930 0.31683979 -0.47740084 0.34410083 Si 10.69177142 2.11175911 4.30140056 0.48646132 -0.53021894 0.62695426 Si 10.69535489 -0.03786921 6.41378335 -1.89361387 1.88166931 -0.10207915 Si 8.52988980 2.16825269 6.44974484 1.22171241 -1.91112126 -0.31556465 Si -0.00172654 4.24190172 4.27856214 0.15444957 -0.37250123 -0.01815190 Si 2.16501986 6.42152892 4.24657368 -0.94155668 -1.17793656 0.35214282 Si 2.17788410 4.27095689 6.44352780 -0.84543538 0.16775651 -1.74452614 Si 0.03299682 6.39726191 6.38118798 -1.00524198 -0.25612464 0.23083985 Si 4.30736440 4.30476241 4.23724770 -0.65701605 -0.37121344 0.23405995 Si 6.45437142 6.44425419 4.29501570 -0.15794248 -1.34460863 -0.08636833 Si 6.38339983 4.25269442 6.38225576 -0.56945068 1.39101383 1.02926345 Si 4.25950551 6.44416562 6.39640326 0.12202904 -0.59677162 1.08893151 Si 8.52187962 4.24357894 4.24259425 2.63188527 0.93025978 0.84861491 Si 10.68236487 6.42182863 4.29860055 0.16040503 -0.24850359 0.21178057 Si 10.71152937 4.25046914 6.44233055 1.22142473 0.54152696 -1.40428642 Si 8.53983315 6.40068154 6.45140820 1.49058462 -0.83650762 -0.39149167 Si 0.01524241 8.53366334 4.30826618 -1.71900433 0.97299877 0.11374818 Si 2.14836602 10.69781341 4.25684544 -0.40911316 0.81942534 -0.07786019 Si 2.13246602 8.57281474 6.38580279 -0.55379672 1.15255182 1.54295609 Si -0.02184033 10.67690351 6.40948072 1.58280040 -1.43681586 0.35880305 Si 4.30569651 8.55431603 4.30594551 -1.39109305 0.97593034 -0.62557613 Si 6.43075225 10.67093268 4.25799170 0.04405404 2.82974603 0.30940431 Si 6.40549459 8.56144757 6.38410014 -0.26669329 0.79355549 1.01239918 Si 4.30594228 10.70068529 6.38870994 -0.57381785 1.10297642 0.90094587 Si 8.51310056 8.56070632 4.28332773 2.21879463 0.33012562 0.36888998 Si 10.68245685 10.70320459 4.26784087 -1.09347204 -1.31350680 0.12230179 Si 10.67240186 8.58932964 6.36420341 0.80396962 0.25803691 0.06177336 Si 8.54452196 10.70052457 6.45368670 0.83303183 1.29184305 0.02717979 Si -0.02760254 -0.00708389 8.57464078 2.27669740 2.22221520 0.35407008 Si 2.15547217 2.17089774 8.52609987 -1.82763899 -1.29564276 1.50638807 Si 2.09783032 -0.00768635 10.70277038 -0.54547697 2.00961307 -1.94150337 Si -0.00746582 2.15817877 10.71614825 1.99211618 -0.59681128 -2.04133577 Si 4.23141149 0.01197436 8.56116503 0.45696219 -0.89911083 1.41065104 Si 6.37944438 2.15576065 8.54053248 -0.11462429 -1.10423835 1.45730085 Si 6.46791408 0.01077595 10.71069956 -0.30018286 1.79997791 -1.68198474 Si 4.23527877 2.13670195 10.72490702 0.13652960 -1.21248272 0.50139785 Si 8.51579504 -0.00657409 8.52007243 0.80371109 -0.54404359 0.31433936 Si 10.68057120 2.15478144 8.55205225 1.32728693 -1.65576912 0.80521628 Si 10.70869022 -0.02302516 10.65053080 -1.81523009 1.82202838 -1.75235086 Si 8.54527550 2.11505653 10.69152651 0.28292559 -0.84673222 0.65485266 Si -0.02267038 4.28897564 8.51634351 -1.15088384 -0.26298416 0.76958809 Si 2.15572568 6.38765556 8.58398217 -0.86823851 1.11312995 -0.37245357 Si 2.12034822 4.27818692 10.68131284 -1.09061672 -0.75043367 1.51562594 Si 0.01496943 6.44615735 10.64462999 0.96933378 0.15645356 -1.10682120 Si 4.28140170 4.25307063 8.55440267 1.14896028 0.55925823 0.47372637 Si 6.45285917 6.45307878 8.57309173 -1.30601711 -0.85340974 0.19333942 Si 6.43944690 4.28391458 10.64336030 0.04993035 -0.24229535 1.32624847 Si 4.23287229 6.34545827 10.68350514 0.53026803 0.41766575 1.24173840 Si 8.60728095 4.25552886 8.52977134 -0.37546432 0.48950212 0.79802673 Si 10.72594236 6.39631492 8.54176261 0.26746417 0.83854356 1.18422763 Si 10.69711476 4.25793518 10.66286395 -1.13514896 0.39154205 -1.10733241 Si 8.51200078 6.35981235 10.70385436 1.52812773 0.37778152 0.79483231 Si -0.02415891 8.51026395 8.53150122 0.25786707 1.01219195 0.46494028 Si 2.16753312 10.72375112 8.55440246 -0.64992848 -0.62919704 0.39750357 Si 2.15834184 8.56628128 10.71082422 -0.66570638 1.09004195 0.03278107 Si -0.00090736 10.68045135 10.66186266 2.04059633 -1.98051663 -2.02419823 Si 4.28501666 8.53818562 8.58857262 -0.50659065 0.82065976 0.50653606 Si 6.41816858 10.70338981 8.50929654 -0.29206294 1.00991456 0.80917454 Si 6.43319395 8.58349274 10.66461608 -0.12031840 1.12228221 1.02596102 Si 4.29736249 10.72677938 10.69818104 -0.15700270 -1.57416181 -1.65215373 Si 8.52325588 8.53197696 8.52990709 1.95322055 0.30804543 1.18106693 Si 10.66618023 10.66241297 8.57111588 -1.38017582 -1.42292463 0.51581108 Si 10.70119873 8.55560840 10.70363972 -2.06121252 0.01330595 -2.14314146 Si 8.58099842 10.67240431 10.71050099 0.31474926 -1.75712028 -1.54043120