108 Lattice="11.738278162754224 0.0 0.0 0.0 11.738278162754224 0.0 0.0 0.0 11.738278162754224" Properties=species:S:1:pos:R:3:forces:R:3 energy=-727.8345381510647 stress="-0.007513551062241355 -7.986181523004314e-05 0.00012786746231571814 -7.986181523004314e-05 -0.008262887741106086 0.0011725920607723248 0.00012786746231571814 0.0011725920607723248 -0.008289080135017425" pbc="F F F" Ta 0.02127145 0.02820800 0.00365463 0.72534333 0.76365583 0.85067404 Ta 1.98532025 1.92957872 0.00103823 0.21373659 0.71174480 -0.14079555 Ta 1.95605090 0.03139256 1.97294581 0.43661424 -0.44620675 0.37505774 Ta 0.02295018 1.94879139 2.01919677 -0.47389394 0.41624993 -0.15640381 Ta 3.89061247 0.00493595 0.02627131 -0.06779011 0.12544649 0.21920226 Ta 5.86833314 1.93574607 0.02256082 0.17112732 0.49111126 -0.63250927 Ta 5.88070264 0.00056805 1.92689045 0.08739881 -0.56045132 0.54852269 Ta 3.93471060 1.93587446 1.98791302 -0.30281207 -0.15092750 -0.68508236 Ta 7.84688217 0.00064946 0.02001124 -0.65800249 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0.15317683 Ta 1.97878707 1.96739407 3.92765573 -0.75478735 -0.64041989 -0.27836448 Ta 1.95401727 0.00812082 5.83156490 0.41539683 -0.70939348 0.15231894 Ta 0.01356487 1.94056601 5.89875633 -0.52270214 0.58312380 -0.25785670 Ta 3.92029605 0.00900046 3.89587938 -0.06197616 -0.88089438 -0.32196355 Ta 5.92241325 1.97258769 3.92843991 -0.37005808 -0.66291438 -0.74463640 Ta 5.83098916 0.00877264 5.84703416 0.36345038 -0.93174488 0.43939501 Ta 3.90177002 1.92756541 5.84450509 -0.00780991 -0.20672921 0.64679593 Ta 7.79444120 0.02737813 3.88457543 0.02349556 -0.74823471 -0.11324020 Ta 9.77491633 1.94482642 3.94683156 0.39604071 0.48904902 -0.29231081 Ta 9.76017461 0.03332105 5.89981512 -0.05093601 -0.08962892 -0.16193712 Ta 7.79622921 1.91786842 5.85325943 0.62953460 -0.06050763 0.69390175 Ta 0.03326035 3.93028837 3.88831015 -1.08293643 -0.53870700 0.24229578 Ta 1.95298304 5.85650178 3.91976557 -0.35066964 0.49916769 -0.43338262 Ta 1.96982630 3.91272668 5.83956476 -0.64874091 -0.37273013 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5.84142525 9.77803610 3.90938843 0.25364356 0.81182987 -0.43557392 Ta 5.88261185 7.85172816 5.83886207 0.19536861 0.29810729 0.86590684 Ta 3.89683760 9.76279849 5.88212977 -0.18735834 0.73393045 0.23722465 Ta 7.80813584 7.84365214 3.95068325 0.40029252 0.30387252 -0.96956263 Ta 9.74708102 9.77750352 3.91640814 -0.12159631 -0.12245663 -0.17440160 Ta 9.75130741 7.85768262 5.86302184 0.74051355 -0.43545873 0.35159775 Ta 7.81684758 9.75501801 5.88784848 -0.38490953 0.80137572 0.29551187 Ta 0.02636745 0.00818280 7.79343515 0.37926280 0.10498521 -0.47877306 Ta 1.97200868 1.92270473 7.79434639 -0.41734867 0.36303950 0.41443956 Ta 1.98030445 0.01159701 9.76668196 0.39989224 0.20167718 -0.20113684 Ta 0.00354063 1.93467360 9.74821884 0.59467002 0.81394357 -0.48901735 Ta 3.88135953 0.01753079 7.83813301 0.12271052 -0.70856595 -0.51180068 Ta 5.87023402 1.94800212 7.83607774 0.26458615 -0.45785668 0.26188652 Ta 5.85991203 0.01678572 9.81232673 0.20919292 0.45159711 -0.42602154 Ta 3.87640115 1.94870788 9.75759342 -0.01095478 0.30194822 0.71193707 Ta 7.85258211 0.02570277 7.81136872 -1.00917406 -0.50713091 -0.18733152 Ta 9.75128899 1.93153998 7.81421120 0.69817864 0.86908341 -0.41058737 Ta 9.76679471 0.03349889 9.75369122 -0.55031332 0.52759902 -0.56422689 Ta 7.85950264 1.97295081 9.75730624 -0.59335559 0.21047728 0.60281151 Ta 0.00300488 3.93087974 7.81826244 -0.28157122 -0.27009249 -0.19347170 Ta 1.97433141 5.86715379 7.81259689 -0.58339373 0.28300191 0.31250344 Ta 1.99324939 3.93145852 9.76750392 -0.21399013 -0.41858208 0.51841830 Ta 0.03399549 5.89873292 9.76878788 0.31676208 0.02035939 -0.16691017 Ta 3.94720152 3.92889516 7.89773488 -0.53421101 -0.56741421 -0.32946059 Ta 5.88983688 5.86049408 7.84649066 0.24493080 0.33553912 0.44736042 Ta 5.87348375 3.85945025 9.80441885 0.09487704 -0.00381964 0.78179761 Ta 3.88390906 5.88532393 9.75825033 0.23940868 0.26266317 0.99819210 Ta 7.87176759 3.87544784 7.86380134 -0.17195948 -0.08912493 -0.12299250 Ta 9.76100724 5.85878835 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