256 Lattice="15.868091583251953 0.0 0.0 0.0 15.868091583251953 0.0 0.0 0.0 15.868091583251953" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-1128.558889012212 pbc="F F F" Ti -0.02747213 -0.03541894 0.00005425 22 1.26183094 1.23875435 1.23738721 Ti 2.01729890 1.96426428 -0.00107258 22 -0.56042202 -0.53502806 0.24395666 Ti 1.99208378 -0.02033752 1.98591994 22 -0.53959082 0.22235803 -0.60726342 Ti -0.03890931 1.97949579 2.00412173 22 0.30004331 -0.50803042 -0.60175779 Ti 3.92324011 -0.02218015 -0.03563761 22 0.01219646 0.83058820 0.90439849 Ti 5.93418378 1.97773447 0.01325561 22 -0.01189701 -0.54736147 0.04366509 Ti 5.95937243 -0.03170511 2.01637127 22 -0.05638641 0.16376965 -0.49225964 Ti 4.00128724 2.00866147 2.00979656 22 -0.15083863 -0.85080730 -0.74468328 Ti 7.94718665 0.01752135 0.01326460 22 0.01753262 0.74372945 0.76241129 Ti 9.96078059 1.96424742 -0.02907601 22 -0.06832563 -0.38140001 0.14052342 Ti 9.90767929 0.01929115 1.94832065 22 0.01971834 0.04636304 -0.39876371 Ti 7.94556153 1.99224338 1.98442830 22 -0.04191378 -0.83077286 -0.76721053 Ti 11.92288963 0.02985855 -0.00943316 22 0.30401690 0.92620151 0.95516599 Ti 13.90955010 1.98345310 0.00570453 22 -0.98218033 -0.28957130 0.94213264 Ti 13.87774652 0.03435488 1.97910441 22 -0.89756573 0.90470765 -0.31119958 Ti 11.93696216 1.97067858 1.99718293 22 0.72782648 -0.77870300 -0.86410525 Ti 0.03274005 3.95192183 -0.00989349 22 0.77131975 -0.00886852 0.84644407 Ti 1.95000799 5.98817936 -0.00679963 22 -0.34630359 -0.10028531 0.16273103 Ti 2.00842844 3.98958375 2.02208387 22 -0.76220874 -0.16887594 -0.81555829 Ti 0.02882894 5.93120422 1.98860390 22 0.04866818 0.08276671 -0.55190866 Ti 4.01621857 3.92979404 -0.00881211 22 -0.14225692 0.13638088 0.06992029 Ti 5.95638340 5.94765864 -0.02689606 22 -0.00491985 -0.10409392 0.02917620 Ti 5.98768642 3.90832938 2.01790413 22 -0.11478016 0.17895789 -0.78366008 Ti 3.94806262 5.93327066 2.02114620 22 0.03097351 0.04049532 -0.73558705 Ti 7.88341451 3.94238168 -0.03093564 22 0.13735524 0.03073038 0.02414840 Ti 9.88177219 5.95788849 -0.00435813 22 0.02657498 -0.08075049 0.06372133 Ti 9.89051046 3.92859650 1.99923929 22 0.17617098 0.13880815 -0.77457258 Ti 7.89828565 5.91204611 1.98870404 22 0.16166461 0.11868731 -0.67737193 Ti 11.93149580 3.95192887 0.02626696 22 0.37395400 0.07498141 0.09551002 Ti 13.90049209 5.96221181 0.02801100 22 -0.79639063 0.00337755 0.72653732 Ti 13.86427909 3.96886569 1.99310553 22 0.03819264 -0.05804132 -0.49052475 Ti 11.90256192 5.98955498 2.00587400 22 0.52480478 -0.12656012 -0.81837491 Ti -0.02584634 7.97350171 -0.00583319 22 0.82205661 0.00774883 0.79418519 Ti 1.97729316 9.93481832 -0.01733047 22 -0.47034727 -0.08958996 0.15516673 Ti 1.98977555 7.96157493 2.01578312 22 -0.70588610 -0.11212257 -0.80230195 Ti -0.01744076 9.92354428 1.95153472 22 0.13448893 0.00431781 -0.42456613 Ti 4.01343327 7.87744723 0.00528955 22 -0.16092638 0.12327882 -0.03659411 Ti 5.98789139 9.86819068 0.03265209 22 -0.13730055 0.09081021 -0.12748996 Ti 5.93189495 7.89549605 1.95202971 22 0.10647366 0.06575352 -0.41921583 Ti 3.98169464 9.88616537 1.99972744 22 -0.02723482 0.15794592 -0.63894138 Ti 7.90699352 7.92678875 -0.00123744 22 0.10051712 -0.03200004 -0.04989199 Ti 9.93113499 9.87600624 -0.02030982 22 -0.05259556 0.07939300 0.00945183 Ti 9.87804836 7.98166973 1.95084263 22 0.06410966 -0.10105098 -0.46781305 Ti 7.88678188 9.96718760 2.00877446 22 0.15914380 -0.22513750 -0.52358603 Ti 11.89690462 7.89711747 -0.02862449 22 0.38989491 0.03857375 0.08100003 Ti 13.84500639 9.88552194 -0.02032647 22 -0.70751840 0.03615410 0.75294556 Ti 13.81824963 7.97068274 1.94537029 22 0.09906482 -0.12996163 -0.44832660 Ti 11.89014362 9.93751655 2.00308727 22 0.59409986 -0.06622815 -0.75513448 Ti -0.03118548 11.92027824 0.00503288 22 1.05626884 0.29717239 0.99796893 Ti 1.99382273 13.91975375 0.02369386 22 -0.30412928 -1.04390763 0.97435232 Ti 1.99138969 11.92248083 1.98286249 22 -0.86778312 0.67048567 -0.82484523 Ti 0.00409837 13.90976517 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0.74568774 -0.01747689 Ti 1.97739702 1.94693591 3.98282695 22 -0.69473223 -0.62197348 -0.08804808 Ti 1.97925533 -0.01815911 5.96014666 22 -0.44668888 0.12111039 0.02167592 Ti -0.03376859 2.01323116 5.93582873 22 0.09061755 -0.47307001 0.01110088 Ti 3.97611859 -0.02771241 3.99067865 22 -0.03166330 -0.00271228 -0.06697629 Ti 5.95599462 1.97936525 4.00159882 22 0.04156911 -0.62437235 -0.10682826 Ti 5.98722098 0.00252088 5.91561770 22 -0.10633293 -0.12635071 0.14928853 Ti 3.99063740 1.99455613 5.92987439 22 -0.20961285 -0.68296707 0.06415640 Ti 7.90339468 0.03131214 4.01904654 22 0.16603824 -0.10159366 -0.13800556 Ti 9.92526969 1.98077025 3.93019188 22 0.01413787 -0.58985114 0.19945988 Ti 9.92405054 0.00153940 5.99081190 22 0.01606231 0.02389775 -0.05087929 Ti 7.90573877 2.02029904 5.94715508 22 0.19658237 -0.63359923 0.01714413 Ti 11.92436992 0.00143775 3.93404916 22 0.39451258 0.03926292 0.08014330 Ti 13.92087520 1.96723254 4.01570417 22 -0.07854804 -0.38890670 -0.04204793 Ti 13.92118343 0.01317982 5.92422785 22 -0.83234545 0.77026726 0.01870901 Ti 11.90930022 1.96356471 5.91961462 22 0.67691947 -0.68263113 0.05989883 Ti -0.02205313 4.02143081 3.94472839 22 -0.01043998 -0.13370963 0.08195858 Ti 1.98565263 5.94596527 3.99759131 22 -0.57732194 0.00484206 -0.09835588 Ti 1.94833063 3.92755265 5.95059947 22 -0.44353854 0.07952927 -0.02345298 Ti 0.04105954 5.99092186 5.99507371 22 -0.17627501 -0.05939922 -0.10182437 Ti 4.00634944 3.97811936 3.97451421 22 -0.22479403 -0.08753237 0.00285776 Ti 5.94900526 5.92477780 3.93844944 22 0.03872930 0.13922562 0.08246556 Ti 5.90047729 3.97558846 5.95867044 22 0.21809275 0.06450701 0.00379479 Ti 3.96910305 5.95674761 5.91701360 22 0.03366684 -0.06043488 0.16898548 Ti 7.96977953 3.98237654 3.94080756 22 -0.08570353 -0.06926496 0.22627890 Ti 9.92377130 5.94233927 3.96199578 22 -0.03122012 0.06930121 -0.11382499 Ti 9.94651842 4.00148997 5.94699635 22 -0.15972241 -0.17606359 -0.05570566 Ti 7.90891920 5.95738295 5.92490982 22 0.05834609 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3.95508464 0.00226102 7.91907121 22 0.01539170 -0.02563226 0.00703029 Ti 5.93023684 1.95889291 7.89736936 22 0.06348914 -0.56953764 0.14903856 Ti 5.89320084 0.02994570 9.94673421 22 0.07845121 -0.07115626 -0.12134749 Ti 3.96482794 1.97729727 9.93493404 22 0.00209100 -0.61515890 -0.09623195 Ti 7.93899189 -0.02969441 7.92808556 22 -0.02623505 0.07040228 0.05635615 Ti 9.91598596 1.99863152 7.93945381 22 0.06602788 -0.66560475 -0.01373238 Ti 9.88338457 0.00479511 9.94460901 22 0.10026402 -0.00986996 -0.10350407 Ti 7.93030658 2.00969689 9.89198874 22 -0.08064282 -0.63928406 0.05112780 Ti 11.91102482 -0.01145160 7.96729799 22 0.37843742 0.17131743 -0.00738370 Ti 13.89049736 1.98482421 7.95082786 22 -0.12066922 -0.44785072 -0.06145945 Ti 13.85343466 -0.02272178 9.97121128 22 -0.65731615 0.75949766 -0.02206736 Ti 11.93495717 2.00832801 9.94615738 22 0.54855861 -0.72568209 -0.13871469 Ti 0.00279801 4.00286808 7.90240721 22 -0.05390090 -0.07024612 0.11150338 Ti 2.01111665 5.96826341 7.89994188 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