16 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=7.569290247269066 stress="-0.001436985256424071 8.59869758239835e-05 -4.9525227645207444e-05 8.59869758239835e-05 -0.0014567012109355996 5.008470545306447e-05 -4.9525227645207444e-05 5.008470545306447e-05 -0.0015404491663073255" free_energy=7.569290247269066 pbc="F F F" Se 20.89755523 20.82602819 20.93998877 -0.03347744 -0.12338252 0.64962416 Se 22.73171545 22.68190327 22.32183498 -10.83742092 -5.29311974 -5.19607353 Se 24.21301855 20.92485375 21.12990665 0.32872418 -4.94053495 -3.94104319 Se 25.28220450 22.78278197 22.56210000 20.49335403 -9.28218020 -8.79711135 Se 21.13362859 24.07327039 21.07034430 -4.76262400 0.74458970 -4.16407524 Se 22.69154875 25.55473499 22.27059962 -1.82203754 7.43082422 0.00025538 Se 24.24704474 23.90480033 20.87719504 1.51459948 3.81853892 -12.23311808 Se 25.29869006 25.61041876 22.47682735 3.95447348 6.09580090 0.01415609 Se 20.88814158 20.89637418 24.14600149 -2.65242864 -2.17584525 -1.13821997 Se 22.53369179 22.52598936 25.22329650 -5.74494009 -1.80630428 9.69309718 Se 23.66621181 20.90583543 23.75559716 1.28349726 -11.13728415 1.77593186 Se 25.20178472 22.79874826 25.27290972 11.59599446 -6.63067126 15.05453885 Se 20.88090187 24.02567742 23.87261264 -5.30492317 1.59651520 1.37284158 Se 22.23489702 25.48193431 25.45279578 0.35441003 2.19020199 1.37089478 Se 24.20070203 23.70342959 23.90085166 -8.61414140 17.63665695 4.66620447 Se 25.39765521 25.65553375 25.47098866 0.24694027 1.87619446 0.87209700