32 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-66.25877105548952 stress="-0.0015245330289151277 -5.523507427762732e-05 6.906443129897546e-05 -5.523507427762732e-05 -0.0016279471740780634 9.977268677379675e-05 6.906443129897546e-05 9.977268677379675e-05 -0.0014583035229826058" free_energy=-66.25877105548952 pbc="F F F" Ni 21.18843096 21.17061300 21.29169807 -2.84928217 -3.90324525 -3.69377725 Ni 22.52820800 22.60823244 21.03851086 -1.10378130 -1.48316593 -5.78408956 Ni 22.64982991 20.74795387 22.32929456 -2.30092497 -4.67587202 1.96682615 Ni 20.78747849 22.38985981 22.37993804 -3.52033398 0.33401011 4.07876574 Ni 24.28095696 20.82464588 21.26008946 -2.81621141 -4.13664040 -6.54955506 Ni 25.37675974 22.32230465 21.28460712 5.69320782 3.19027867 -3.59729805 Ni 25.25346517 20.76772449 22.27715687 5.59875731 -4.26592059 3.16612423 Ni 23.74014891 22.46298227 22.32743118 1.79255112 -0.92370976 4.32057121 Ni 20.79546282 23.70940621 21.11893942 -2.31905304 3.06961721 -2.06747371 Ni 22.42002739 25.33885520 21.03926819 -2.57188873 3.24118755 -5.20549607 Ni 22.73010044 24.16733404 22.55117744 -6.33319932 -0.09212764 1.33498052 Ni 21.12033173 25.67828948 22.71182891 -2.96998894 3.58588390 -3.12223078 Ni 23.79301824 23.73241985 21.07255377 3.06315690 1.15260177 -8.44436529 Ni 25.51129231 25.51258782 21.16911338 2.98999397 2.27286218 -3.22539819 Ni 25.30454100 24.12365747 22.45588739 6.61432460 -2.75835965 2.90103647 Ni 23.95297513 25.34681875 22.08117370 0.07089989 8.68810261 1.67904411 Ni 21.04737131 21.03238783 24.24404962 -1.91776621 -3.03761701 -2.51252473 Ni 22.36810690 22.62937675 23.75818085 -1.39709266 -2.53805899 0.91765101 Ni 22.59119645 20.79640878 25.71456242 1.10545347 -3.62176509 1.32963932 Ni 21.27913633 22.35263676 25.68492541 -2.69568757 2.80737235 2.76252262 Ni 24.00557811 20.88323780 23.76192411 -1.27447091 -3.98268696 3.15445564 Ni 25.46490969 22.26260376 24.12263099 3.21776087 3.26174142 -2.70258895 Ni 25.44941539 20.95206007 25.62593290 0.80400787 -2.22124299 1.99854684 Ni 23.79742865 22.27153393 25.41812645 0.60997895 1.89671196 2.52241424 Ni 20.70122014 24.23212867 23.78615654 -3.07395178 -4.62830721 0.60787957 Ni 22.26067717 25.67871475 24.13161973 3.73226767 4.72528998 1.01446231 Ni 22.66891656 23.95283623 25.28353165 -1.33131778 1.92464470 4.49636022 Ni 20.70072959 25.51229390 25.34628414 -1.62899353 0.86588848 2.96850202 Ni 23.79061752 24.24339277 23.71156333 3.31096902 -0.74207257 4.55210537 Ni 25.41738082 25.65093924 24.14803915 2.25106350 2.69031633 -2.74891485 Ni 25.26416454 24.14526935 25.53806039 1.68360590 -3.13785969 1.75825894 Ni 24.07797747 25.76599513 25.67918122 -2.43405454 2.44214249 2.12356597