108 Lattice="10.6510255229482 0.0 0.0 0.0 10.6510255229482 0.0 0.0 0.0 10.6510255229482" Properties=species:S:1:pos:R:3:forces:R:3 energy=-163.9889377378902 stress="0.0056349481432480105 0.003269494095717697 -0.008565353352333981 0.003269494095717697 -0.009297198656943551 0.0010792326535403345 -0.008565353352333981 0.0010792326535403345 -0.004277677846102364" free_energy=-163.9889377378902 pbc="F F F" Ga 0.06448840 0.05352264 0.02268096 0.04088182 0.15533471 -1.90914058 N 1.79196500 1.76449408 0.00316755 -0.21621904 -2.33677218 2.09954567 Ga 1.73096754 0.01025974 1.73437187 0.34532566 -1.89285918 0.25247283 Ga 0.02177509 1.75042267 1.74064101 -2.29762278 1.56943529 -1.80000747 Ga 3.55751487 0.02195809 0.03415454 1.72754161 0.43616726 -1.35497092 N 5.32935385 1.77237313 0.06304764 0.44960714 -0.71569337 0.37714506 N 5.35361036 0.05360886 1.75197179 -1.77701326 0.02220991 -1.19433924 Ga 3.57179081 1.79507850 1.80655725 1.60789147 -1.01086180 -2.88360010 Ga 7.12812395 0.01747091 0.01306859 -1.97431284 0.71620507 3.12442001 Ga 8.85461135 1.79778640 0.01816964 1.35747694 -1.78641308 1.10827130 N 8.84882421 0.01549694 1.74149735 -0.78674979 0.84917027 -2.29345181 N 7.11293423 1.80030606 1.80371659 0.80754280 1.15349979 -2.17859904 N 0.03502728 3.57116358 0.01441608 1.18470445 0.93117840 2.49327175 Ga 1.79527875 5.31624811 0.01278263 2.63203321 3.02288195 -2.25234942 Ga 1.75751788 3.57975657 1.74438791 1.31646361 -1.67004173 -3.34054271 Ga 0.00589997 5.29570024 1.76094493 -3.46500107 1.35328851 -2.91033269 N 3.56778721 3.50509025 0.00792079 -0.95777458 0.34543723 1.76669436 N 5.30891680 5.34471948 0.00564773 0.90996846 -1.52272415 0.45327701 Ga 5.29320709 3.51534192 1.75271704 2.74988828 3.27819067 0.14065257 N 3.52197830 5.35779296 1.78763996 -1.28124453 -1.43364986 1.28108762 Ga 7.11779918 3.52961622 0.02792103 -1.28926864 2.27429311 -2.44146388 N 8.86880929 5.30860315 0.03249664 -0.79541161 -1.99117284 0.87439879 Ga 8.88729090 3.58351116 1.79323071 -0.22326601 -0.67735520 1.42967137 N 7.09849009 5.35210814 1.75320322 0.79883927 -1.85629534 -0.00290580 N 0.01918449 7.12694545 0.03129832 0.53654529 -0.78948339 1.79915108 N 1.74054467 8.89134063 0.02287499 -0.13026110 0.33481651 2.00025537 N 1.77552738 7.10596305 1.78595484 -0.97461054 0.29910856 1.68596895 Ga 0.00385180 8.89257769 1.78540121 1.01901698 -1.07883980 -3.99349296 N 3.53913371 7.08625462 0.00630133 -0.92791796 -0.13119373 0.54867694 N 5.29234669 8.88791626 0.01889429 0.02631120 0.34512768 2.00818102 N 5.36023026 7.09895063 1.76246913 -0.63204925 2.19409009 1.25334122 Ga 3.57744344 8.89080939 1.79904300 0.03111230 -0.90785603 -6.18210356 N 7.09532755 7.06533729 0.01933764 0.00003240 0.78747646 0.67338344 N 8.89705517 8.83598804 0.03297244 -1.00108009 0.20029891 0.96260881 N 8.89571894 7.13407320 1.74983280 -0.56157817 -0.22717340 1.04018479 Ga 7.10617923 8.89175080 1.75033167 2.65199996 -3.52480008 -2.70298535 Ga 0.03087757 0.00651936 3.57283981 1.06630650 1.09635421 3.73083659 N 1.75880367 1.77833037 3.55827188 0.20205911 -0.32743678 -2.08527514 N 1.75618409 0.06826534 5.34497156 0.43327658 0.17108186 -2.04628318 N 0.00763958 1.79511379 5.34017187 -0.49885152 0.87160721 -1.07934391 Ga 3.57738418 0.02461264 3.53790395 -0.17318680 -2.46183146 -0.10181956 N 5.30963432 1.73332114 3.54145514 -2.28997871 -0.17285750 0.27108713 Ga 5.31744706 0.00052186 5.31825642 4.02760744 -1.50496848 -0.78962946 Ga 3.54101563 1.78327343 5.33483574 -4.52391433 -1.57528672 0.94146808 N 7.06333734 0.03726087 3.52312228 0.14421226 -0.36365196 1.97207195 N 8.86339539 1.80416826 3.55275174 0.60199530 0.87979801 1.03606544 Ga 8.89757938 0.00687593 5.29632208 -2.69761634 0.74689738 -2.42039303 N 7.09452505 1.75481927 5.32895792 0.88717165 -0.18925077 1.86252505 Ga 0.00313240 3.54949989 3.52721549 -0.88875244 -3.17972849 3.47705923 Ga 1.75246326 5.32475238 3.53942773 0.93809721 0.98966485 -0.88037630 N 1.76797130 3.55476794 5.29734531 0.24491711 1.98014850 0.04340400 Ga 0.03161053 5.36538160 5.30827872 -1.98050153 -0.07383129 -0.02988650 Ga 3.55654202 3.51538525 3.54676149 1.88147459 0.87126222 1.41326965 N 5.32523728 5.34601757 3.55842913 -1.88573008 -0.04282241 0.63477965 N 5.33287947 3.56236755 5.34545101 -1.85869546 -0.76056758 1.22634915 Ga 3.55025034 5.31792039 5.28298198 2.16605078 -1.63914157 0.67344522 N 7.13393354 3.57607805 3.54607399 1.49954224 0.55772884 -0.67456909 Ga 8.85621281 5.32146590 3.54633230 -3.16054681 5.03013335 0.20201495 Ga 8.90461124 3.49166217 5.30981349 -0.47654595 -0.26511318 -2.26789497 N 7.13581019 5.33113565 5.32191694 0.69706345 0.03812337 0.69210516 Ga 0.02335948 7.07857332 3.48727166 -1.84003474 0.74986533 0.36283719 Ga 1.75096024 8.90142202 3.51589356 -0.00823014 1.61465482 0.30214833 N 1.82259494 7.16373306 5.34357733 -0.68452523 0.39530622 -0.14461412 Ga 0.01379246 8.88873716 5.29097583 -0.72520022 0.58342649 -0.11375245 Ga 3.57942404 7.09518093 3.53869116 0.96565187 -2.61063221 -4.17404249 Ga 5.36900937 8.85831174 3.56144795 0.52896908 0.88725804 -0.73243715 Ga 5.29640660 7.07113256 5.33649767 4.36833412 -3.42071493 -1.62046955 Ga 3.55257652 8.84084990 5.32852436 -0.35995484 2.44370400 -0.41981733 N 7.09434349 7.11114587 3.57009978 -0.52316498 1.59006798 0.68942508 N 8.90208235 8.88581165 3.59640197 -1.97457939 0.32279476 0.03457435 N 8.87225836 7.16135208 5.38622447 -1.20612965 -0.23237141 -0.35721413 Ga 7.13088370 8.87901986 5.32594899 5.13592573 0.72026611 -1.58432706 N 0.02653865 0.01835356 7.07780932 0.95920363 -0.18919297 1.14700227 N 1.79817036 1.79784798 7.06706670 0.35749660 0.59594511 0.24568560 Ga 1.71717787 0.01187903 8.90987601 -0.32248853 3.22457045 -3.29398936 N 0.03115366 1.83192374 8.88996049 0.79031856 -0.20410729 -0.80320416 N 3.54521623 0.03167999 7.08308513 1.73147158 0.75767662 0.42381981 Ga 5.33986874 1.78790862 7.13550962 0.55582207 -1.73564096 -1.46492372 Ga 5.35787762 0.00579994 8.88096582 -1.76445073 -1.32340817 -0.19486688 N 3.57998286 1.75344368 8.84247802 1.68606642 -0.43264909 -0.63331878 N 7.07621699 0.00663178 7.07739008 0.40802459 1.21645320 1.20016112 Ga 8.84698774 1.78492674 7.08849892 1.70403954 -0.58167001 0.60147390 Ga 8.89525664 0.00410330 8.87363512 -0.34064923 -1.22801515 -0.34849047 Ga 7.12278761 1.81244127 8.89711564 1.45656315 0.18025824 3.09678416 Ga 0.01554868 3.52852559 7.10616333 0.41160691 -4.67517762 2.07338142 Ga 1.75100146 5.31967802 7.09818672 -1.35659599 -0.24175010 2.54647428 N 1.74450717 3.51654249 8.90763737 0.87866244 1.55637497 -1.71457349 N 0.03677061 5.28766296 8.84543977 0.25272243 0.08150956 -2.58884963 Ga 3.57932573 3.51840078 7.10573925 -2.83062504 -1.34392606 1.28755474 N 5.29017042 5.31340791 7.12846094 -1.30704334 0.01000329 0.16995323 Ga 5.29448280 3.57577398 8.87001472 0.95849520 1.27122470 3.46742522 Ga 3.54052949 5.36070164 8.90242523 0.15904578 1.36338473 3.60541071 Ga 7.11550024 3.57466730 7.09840399 -0.05438464 6.24422204 -1.22514014 N 8.89378082 5.34036481 7.15258247 -0.97728061 0.03601640 0.06672431 N 8.84509334 3.57740937 8.88101462 -1.53573119 -2.18664812 -1.51417272 N 7.08513535 5.33319321 8.89520442 0.07998303 -0.02489098 -0.95449136 Ga 0.00340990 7.12495851 7.10504124 -2.30323245 0.29170873 3.77998804 Ga 1.77292236 8.85730551 7.11888269 -0.45212780 2.49859464 3.93617312 N 1.75945501 7.07548280 8.90391096 0.90680299 -0.81290878 -2.24823263 N 0.01879398 8.90104800 8.87413885 0.84049912 -0.88658761 -1.99901346 Ga 3.53590055 7.10089671 7.11678604 0.84485254 0.59758691 3.38002050 Ga 5.31976823 8.89945720 7.13617582 -0.01665114 2.58400125 4.24606913 N 5.29543434 7.08004220 8.85512257 -0.91430718 -0.10687891 -1.67553242 N 3.53352531 8.88007910 8.84547211 0.03925904 -0.34633120 -2.69508716 Ga 7.09918810 7.11319067 7.12497089 1.45177089 -3.90751895 1.30660671 N 8.88552155 8.84548516 7.16278543 -1.35927297 -1.40820513 0.05211684 Ga 8.84679456 7.10101294 8.86861920 0.16038525 0.17467594 0.10390150 N 7.14571466 8.89381585 8.85656991 -0.03256836 -1.48366171 -1.35853543