32 Lattice="63.74032402038574 0.0 0.0 0.0 63.74032402038574 0.0 0.0 0.0 63.74032402038574" Properties=species:S:1:pos:R:3:forces:R:3 energy=-180.59270145956097 stress="0.0001240647309032073 -2.13695230740265e-06 -8.613812825914994e-07 -2.13695230740265e-06 0.00012711369522816444 1.6075063966503108e-06 -8.613812825914994e-07 1.6075063966503108e-06 0.00012683207692862515" pbc="F F F" Zr 31.79557168 31.63921551 31.81897928 1.15155338 1.19372251 1.13065472 Zr 33.82070731 34.27567534 31.90060329 0.16910516 -0.32295101 -0.20762442 Zr 33.89865003 32.20811187 33.99181657 -0.34819255 -0.87069555 -0.45061850 Zr 31.86052922 34.17391643 34.08137938 -0.21501964 -0.08369513 0.08220927 Zr 36.31776010 31.83764262 31.68865624 0.31700704 1.06380518 1.13857388 Zr 38.88126488 33.79952230 32.03191397 -1.12444311 -0.22387890 0.97906020 Zr 38.55861992 31.77183865 34.09077376 -0.44179278 0.73075738 -0.62624585 Zr 36.18972965 33.96073904 34.07711514 1.02627389 -0.04105872 -0.66082374 Zr 31.84109694 36.61126364 32.11508863 0.35400071 -0.60484216 -0.57870363 Zr 33.91838990 38.71700865 31.68483997 0.26941322 -0.82447829 0.74106302 Zr 34.29843719 36.33439930 34.34305096 -0.78956616 0.68788183 -1.35607383 Zr 31.89286344 38.51230036 33.89907159 0.39176177 0.58523015 0.63239712 Zr 36.29710314 36.60706973 31.69503672 0.44144736 0.74556169 0.96731241 Zr 38.68894436 38.63530869 31.79264839 -1.52962848 -1.22132738 1.29013535 Zr 38.85037502 36.27991997 34.25578947 -1.01050098 0.34657723 -0.34590482 Zr 36.50633604 38.91715540 34.15655008 0.66776482 -0.96376901 -0.32212541 Zr 32.08038491 31.84042865 36.45967980 0.77726684 0.65721541 0.50109915 Zr 34.20690334 34.31642996 36.62183059 -0.94755821 -1.40686448 0.33171755 Zr 33.95428699 31.68874281 38.71640774 -0.41353459 1.00357265 -1.05882616 Zr 32.02637321 34.16340009 38.59923892 0.61345833 -0.33200809 -0.46420586 Zr 36.65397170 31.70687333 36.21648461 -0.22404583 0.21507105 0.54571642 Zr 38.47552504 33.91180508 36.52456194 0.16591170 0.16264785 0.17920351 Zr 38.50305961 31.97823049 38.88265350 -0.84114001 0.94777561 -1.06712188 Zr 36.51821531 34.33760195 38.66165696 0.41875619 -0.32528055 0.13931746 Zr 31.93122815 36.58962332 36.53105229 0.04054234 0.21104872 0.38657567 Zr 33.80891372 38.83048583 36.22774935 0.11208747 -0.28330569 0.52874303 Zr 34.05083216 36.67111275 38.68509653 -0.17208398 0.51868486 -0.28373993 Zr 31.75404257 38.84189587 38.67457514 1.05787250 -1.06794314 -1.05801106 Zr 36.17487828 36.18767468 36.30255422 2.02363815 1.45992892 0.77943277 Zr 38.61545868 38.91811026 36.29669310 -1.17649453 -1.12185145 0.32789212 Zr 38.87452706 36.59980672 38.65755486 -1.48658968 0.46965792 -1.00058663 Zr 36.66966457 38.83040294 38.69150622 0.72272963 -1.30518941 -1.20049191