32 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=528.4291662946147 pbc="F F F" Zr 0.15488783 0.05988540 -0.29754255 40 -35.62659537 -22.19630737 -32.36916612 Zr 1.66431082 1.31425730 -0.01155935 40 -48.98314422 27.54283112 -59.59103465 Zr 1.34912061 -0.10028026 1.29900377 40 8.72248359 -69.19192119 -3.03291084 Zr -0.03902326 1.28219307 1.71813893 40 -92.47890541 17.13314059 -83.05146011 Zr 2.76716069 0.19410236 -0.16903503 40 37.09311586 -78.72296812 -50.22082814 Zr 4.38201197 1.41866868 -0.27997518 40 47.74967183 6.64369923 -41.98661181 Zr 4.27696427 -0.08338442 1.27955299 40 36.81493131 -36.27391720 8.26492531 Zr 3.22586561 1.79391194 1.22614529 40 38.54910415 -36.11651463 37.81889880 Zr 0.02103145 2.82137526 0.18220204 40 -53.13539951 -10.42537838 -64.24708204 Zr 1.11414370 4.73573857 0.02724172 40 32.96631838 41.62684994 -61.42063945 Zr 1.27538150 2.70296332 1.54161291 40 26.80981474 24.78636173 -20.37777532 Zr 0.22083292 4.28984966 1.29458363 40 -66.25098253 51.82099546 41.47155115 Zr 2.68471817 2.90698366 0.18107110 40 9.74994605 69.33954060 -84.37906389 Zr 4.32825321 4.63102478 0.09995250 40 18.85292554 13.49696413 -22.07574570 Zr 4.76120756 3.01193751 1.75226748 40 53.40883152 18.39279809 -30.28576277 Zr 2.96431997 4.54396501 1.62568346 40 27.80122850 41.59673240 -23.83185925 Zr 0.20379337 0.23854596 2.76922180 40 -44.36240840 -126.46466783 56.81755431 Zr 1.28229695 1.52031036 3.18745344 40 60.43509625 -37.51571222 24.28916831 Zr 1.40452226 -0.12029223 4.77711528 40 5.47955772 -25.39138855 25.77965959 Zr -0.12128882 1.48323766 4.23125112 40 -67.54212994 -7.89708949 77.13688355 Zr 2.71824351 0.13616082 2.76429260 40 23.39061109 -48.45283719 19.42216073 Zr 4.62968218 1.71980528 3.29977655 40 79.04655082 -74.05867997 -39.87796174 Zr 4.68359827 -0.04539058 4.57327937 40 12.33911123 -23.90128112 12.94503151 Zr 3.19989723 1.62961200 4.37425859 40 -18.94586133 -57.85021091 92.61604846 Zr 0.15720406 2.76564846 2.88507600 40 -95.79679685 68.66859630 19.17689164 Zr 1.79768454 4.48273691 2.86065667 40 -39.95567303 56.68812692 19.02881873 Zr 1.67089611 2.97011124 4.20220318 40 -22.85655337 30.45769643 85.50389658 Zr -0.26960839 4.35541431 4.39917148 40 -12.88543763 16.94784112 14.28214266 Zr 3.26235339 2.84838096 3.21005355 40 -16.30349038 47.12472885 -35.79711938 Zr 4.71211731 4.44968690 3.49666013 40 32.09904770 66.78524237 -16.45087449 Zr 4.65710459 2.99042854 4.35687199 40 55.75685587 20.76220018 93.41916723 Zr 2.80522449 4.74122900 4.52201293 40 8.05817581 34.64452868 41.02309715