64 Lattice="10.0 0.0 0.0 0.0 10.0 0.0 0.0 0.0 10.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=63.8016271162 stress="-0.07443725345931862 0.010299009219929106 0.01639906435970419 0.010299009219929106 -0.06924230938714615 0.004983758285437875 0.01639906435970419 0.004983758285437875 -0.06939432910419077" pbc="F F F" Ti -0.20133076 -0.44354174 0.37263274 0.05415331 -0.13949901 -0.15901352 Ti 1.36005647 1.26155593 1.52502922 -0.89916457 -0.22192950 -1.10267274 Ti 2.87575898 2.38110533 0.77838694 -0.14969718 0.33858727 -0.34069972 Ti 3.74926458 3.82189943 1.16386972 -0.60642122 -0.48624112 -1.07831346 Ti 2.93300590 -0.05554596 2.95239820 -0.26871481 0.62141280 0.63803334 Ti 3.58825563 1.42231423 3.81029856 -0.27230876 -1.63391242 0.26479805 Ti 0.18363838 2.37530328 2.07772538 -0.52422905 -0.49932971 -0.72943579 Ti 1.22837482 3.95798483 4.06405160 -1.37564545 0.11079578 -0.48931125 Ti 5.28435500 0.48616346 -0.05228330 0.90791079 0.20521002 0.14231550 Ti 6.16051063 1.31418477 1.49971651 0.45943737 -1.08685975 -1.21248754 Ti 7.30017949 2.21549094 -0.35420251 0.25221391 -0.41898062 -0.28367005 Ti 8.57461244 3.54989673 1.23551190 0.26297507 0.26467133 -0.35628515 Ti 7.20774313 0.43348244 2.29459957 0.75102442 -0.48623112 -0.36055118 Ti 8.51922259 1.72434521 3.33910862 0.13544997 -0.64348285 -0.27329404 Ti 4.61287416 2.12859478 2.06691485 -0.35696708 0.21615641 -0.79294929 Ti 6.13664823 3.46238529 3.20392680 0.64635336 0.47406611 0.23646421 Ti -0.48432299 5.39356314 -0.45071769 -0.15641030 -0.03148796 -0.39141415 Ti 0.98142533 6.31544699 1.63350073 -0.81265610 0.44807788 -0.64292485 Ti 3.12078958 7.70881637 0.20055288 0.74937478 1.50521747 -0.35843441 Ti 4.04714913 9.10304818 0.90503041 -0.76120109 -0.40954412 -0.25033221 Ti 2.22015038 5.12092295 2.51282842 -0.30018767 0.24869746 -0.07133658 Ti 3.77097969 6.53185564 3.42423500 0.24561373 -0.14619150 0.77488060 Ti 0.30984528 7.42647898 2.17021825 -0.25599041 0.51034980 0.18040791 Ti 0.99469792 8.49920792 3.82895218 -0.72757488 0.20772941 -0.46802141 Ti 5.05397972 5.40674937 -0.21982183 0.05145118 -0.49643176 -0.37137225 Ti 6.46562791 5.84696809 1.40199409 0.34956031 -0.31153109 -1.28022446 Ti 7.16068129 7.85760404 0.08166291 1.72624574 0.14070068 -0.27379415 Ti 8.72500150 8.62395801 0.96963622 -0.01576557 0.24245570 -1.03105451 Ti 7.30539633 4.60320685 2.46850340 0.92276476 0.98923984 -0.30422332 Ti 8.35433959 6.45438499 3.82550802 0.63587789 0.13166180 0.15865814 Ti 4.59963356 7.70988817 2.29652316 -0.08525908 1.26604568 -0.25272351 Ti 6.08168652 8.61354409 3.25203356 -0.32345465 0.40169356 0.87017532 Ti 0.38688112 -0.41175491 4.60112862 -0.83074910 -0.62722803 0.41677230 Ti 1.54785791 1.56841281 6.19751650 -0.70174837 -1.07352756 0.27892953 Ti 2.42139371 1.69580350 4.50121598 0.40481539 -0.23677898 0.56856937 Ti 3.77048984 3.49380690 5.90102920 -0.00822029 0.52794026 0.39027955 Ti 2.43310706 -0.35584119 7.36230136 -0.03985541 -0.23858359 0.71838771 Ti 4.22104951 1.49673192 8.35694090 0.28415552 -0.36729070 0.82553668 Ti 0.63037973 2.56343399 7.62996245 -0.40211200 -0.24149756 0.81590011 Ti 1.69332522 4.04863537 8.84929664 -0.34654962 0.48785222 0.01816816 Ti 5.26987678 -0.00817942 5.05165555 0.39677964 -0.76875152 0.34446181 Ti 6.56743001 1.36944526 6.12647937 0.03693982 -1.29904975 0.09786129 Ti 7.02038785 2.78966064 5.01746817 1.24212506 -0.54189372 -0.53761831 Ti 8.67903594 3.53753670 6.80101748 0.39267979 0.36100743 0.07222466 Ti 7.40095341 0.33401109 7.59411349 1.05428552 -0.29913315 0.37339943 Ti 8.80836878 1.53301330 8.69046025 0.28189985 -0.95257892 0.00042395 Ti 5.03640482 2.75032572 7.72251000 -0.57036488 -0.68117925 0.92312222 Ti 6.13634606 4.14090109 8.80800575 0.64882566 0.01428808 -0.01814542 Ti 0.05517182 4.68842517 4.74120044 -0.52726230 -0.28751050 0.16945560 Ti 1.18450067 6.24880483 6.64927955 -0.20622334 0.66502188 0.06254380 Ti 2.17146881 7.34963249 5.24014761 -0.00393779 1.61236171 0.08332674 Ti 3.70895876 9.09838244 5.90983348 -0.31813056 0.27951887 0.94995022 Ti 2.77109014 4.93124647 7.56754574 -0.99412034 0.56241774 1.20624055 Ti 3.30695144 6.15284988 8.72818023 -0.50280140 -0.65193358 0.02799963 Ti -0.12497993 7.56399505 7.42293429 0.25174940 0.30744632 0.72997306 Ti 0.78900512 8.68963798 8.71969174 -0.90782434 0.16336270 -0.07536381 Ti 5.22405928 5.11196296 4.90208399 -0.57939268 -0.63768712 0.26932388 Ti 6.62458466 5.88213332 6.70906900 0.53025916 -0.10923593 0.38071161 Ti 7.08604388 7.96914856 5.08683335 1.55636615 0.37474118 -0.67583467 Ti 8.76960239 9.18579195 6.26227964 -0.05580211 0.28240978 -0.25691935 Ti 7.50842636 4.55991366 7.79763519 0.40706984 1.42869113 0.57761055 Ti 8.46671364 5.98960379 8.58553029 -0.14776708 -0.78932491 -0.32843710 Ti 4.92006226 7.93518579 7.87054360 0.11375346 0.67738868 1.02124968 Ti 6.21545013 8.28578513 9.07894161 -0.71760138 0.74762032 0.17870306