32 Lattice="45.516075134277344 0.0 0.0 0.0 45.516075134277344 0.0 0.0 0.0 45.516075134277344" Properties=species:S:1:pos:R:3:forces:R:3 energy=-62.608952863482884 stress="0.00037314851504083486 8.486503101265098e-05 -2.988227325739106e-05 8.486503101265098e-05 0.0005276574509101976 -4.595885164598238e-05 -2.988227325739106e-05 -4.595885164598238e-05 0.0003280133489458425" free_energy=-62.608952863482884 pbc="F F F" Be 22.66561831 22.87232436 22.81987383 0.41571316 -0.48292376 -0.65683716 Be 24.55827976 24.22647377 22.62331687 -2.07197817 3.81875463 5.58171415 Be 24.12872116 22.62061903 24.50062348 1.04432577 1.65891262 -2.43817065 Be 22.57314408 24.19560002 24.24056544 5.90902389 6.25155038 1.00799322 Be 25.65800144 22.72382773 22.92686582 5.22069548 2.45989226 2.27821946 Be 27.68896098 24.14082788 22.64595599 -5.69797272 1.71760523 3.42812056 Be 27.70707195 22.94367993 24.53848148 -1.62011783 -1.62018945 -3.05365495 Be 26.16220921 24.54679435 24.50598676 -1.13546039 -4.23468720 -3.56888957 Be 22.98269928 26.15607107 22.68502101 0.82914666 -5.84982283 0.04714831 Be 24.55858119 27.41686629 22.87048475 -0.23306406 1.16098998 -1.35674059 Be 24.41568098 25.97397461 24.24906187 -0.64558677 -3.42034604 2.46770851 Be 22.89020039 27.29449857 24.10966809 -0.30750973 2.08249329 1.81880881 Be 26.16900761 26.15831511 23.00087816 -0.23254700 -4.94077625 -2.78972082 Be 27.73022123 27.66015264 22.88224331 -1.02562809 -0.08280807 0.83322415 Be 27.45218678 26.09759657 24.35531166 2.29745237 -3.29930438 0.68507838 Be 25.84750266 27.48607322 24.39495833 1.83209494 1.56231529 0.23456587 Be 22.86958710 22.73776708 26.06193518 -1.50898399 -0.35225463 -0.87920865 Be 24.33983363 24.19900216 26.00461436 1.71651584 3.52275909 -2.19248614 Be 24.25133518 22.71062774 27.38027242 1.37765597 -0.24544057 1.07175077 Be 22.69125752 24.17024957 27.47624567 1.46266110 2.64510120 0.51624854 Be 26.23601881 22.70288195 26.11931513 -1.60126070 2.12868211 -0.97096191 Be 27.85124881 24.15521595 25.83005857 -1.33622837 5.91894307 1.80059673 Be 27.78780754 22.92711026 27.58344510 -0.13439096 0.20029405 0.17005399 Be 25.93108798 24.34035713 27.81888066 -2.00359857 2.63190371 -2.90771924 Be 23.12569315 26.16077185 25.73998869 -1.34182892 -2.86646447 -0.01984758 Be 24.56043879 27.61614397 26.11744134 -0.98209572 -0.73184013 -2.07518203 Be 24.20211543 26.24483744 27.68650990 2.20983198 -6.14903388 -1.75956865 Be 22.86939473 27.49061775 27.62116251 -1.22206101 1.08436328 -0.45187479 Be 26.04962307 26.05479828 25.93886136 -2.99860589 -3.54534726 3.02209261 Be 27.74860669 27.42755594 25.80052529 -0.10715726 0.57871976 0.52945285 Be 27.31892532 26.10120143 27.44088999 1.72910490 -2.53037174 -0.68677691 Be 25.87196450 27.34474153 27.70652331 0.16185413 0.92833071 0.31486273