256 Lattice="14.379114781484677 0.0 0.0 0.0 14.379114781484677 0.0 0.0 0.0 14.379114781484677" Properties=species:S:1:pos:R:3:forces:R:3 energy=-900.444403382316 stress="-0.006829762671020201 -0.00030882577067633366 0.00015756154821784448 -0.00030882577067633366 -0.006782648358769385 0.00016944182406482202 0.00015756154821784448 0.00016944182406482202 -0.006795886513642665" free_energy=-900.444403382316 pbc="F F F" Fe 0.02882862 0.02331993 0.00542439 0.25455391 0.23412089 0.29083362 Fe 1.82488662 1.74482253 0.00807128 -0.13200886 0.17910675 -0.19055380 Fe 1.77162725 0.00695823 1.82294371 0.11933341 -0.13320545 -0.13334181 Fe 0.00917696 1.79515869 1.76234203 -0.20394995 -0.09765125 0.08618447 Fe 3.62018186 0.01646153 0.04080733 -0.02458399 -0.00670890 0.04961595 Fe 5.40378933 1.82321794 0.01639936 -0.12202630 -0.34076337 -0.29447431 Fe 5.39246925 0.00078034 1.80369312 0.08233534 -0.11957857 -0.07938426 Fe 3.60164060 1.79394010 1.77590111 -0.11948509 -0.04375040 0.21506245 Fe 7.20889411 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