32 Lattice="42.74942970275879 0.0 0.0 0.0 42.74942970275879 0.0 0.0 0.0 42.74942970275879" Properties=species:S:1:pos:R:3:forces:R:3 energy=41.91096763118808 stress="0.0013098810398084173 9.057178761439586e-05 0.00017550103980400452 9.057178761439586e-05 0.0007203109624261233 -0.00015186420425973695 0.00017550103980400452 -0.00015186420425973695 0.001247141816721621" free_energy=41.91096763118808 pbc="F F F" N 21.19379104 21.27835213 21.43301658 -3.98007595 -5.40774785 -3.51748259 N 22.89994705 22.91217416 21.54197602 6.92942486 4.59901343 6.99690144 N 22.75863050 21.53011174 22.97599973 5.14496276 2.14942067 4.16303222 N 21.33893505 23.13114670 22.85424484 1.50558850 12.48109228 4.84422155 N 24.60938258 21.27614374 21.64899080 5.19503480 -0.88131863 0.05314018 N 25.88215919 22.67827156 21.52363129 3.09963088 -4.66456458 0.98111059 N 26.16793795 21.42994414 22.72223608 -2.92976208 1.64567431 -4.75504251 N 24.48226801 22.77331403 22.91665838 -12.28865000 18.64345777 15.95753301 N 21.18997153 24.41234933 21.50459996 -0.26937011 -0.87690026 3.62423133 N 22.82144309 25.82572240 21.15012818 -1.72633704 0.10861674 -3.37718545 N 23.00178045 24.39183928 23.10851285 13.54255048 -16.71531305 10.16756503 N 21.63591485 25.59232416 23.10856139 -2.57515965 2.61408261 10.43703150 N 24.64417796 24.58673992 21.54036247 -4.22998444 -4.14661214 11.60347281 N 26.14873640 26.06542969 21.45830778 3.61309207 6.36995977 -4.91014390 N 26.00036572 24.30684446 22.71824446 -3.37309124 -17.30774155 1.12012721 N 24.54134660 25.96651314 22.67970933 -5.62905846 1.51783721 3.76579581 N 21.44556424 21.39055569 24.30637247 3.30002096 -0.32542526 0.28248286 N 23.03899481 23.08964751 24.36879821 4.35261105 9.10948136 -8.88216995 N 23.05883984 21.26513130 26.03043670 -5.85961627 -1.90418045 0.12193299 N 21.33164971 23.11798315 25.92723791 5.86168961 4.05841313 -2.93476471 N 24.68143450 21.49721735 24.51440266 -0.79501099 1.30897278 -5.29409006 N 26.16133728 22.99329939 24.36589718 -4.43119510 9.30087247 -9.73801502 N 25.63396266 21.36390226 26.01997389 -0.67639514 -1.49208470 1.97466192 N 24.58527134 23.04365770 26.19809262 -1.18577313 6.17597566 3.45961319 N 21.34857320 24.38350086 24.46033793 8.84783149 -4.55003103 -12.49995056 N 23.02633845 25.74497245 24.28599101 1.08447075 -11.78048921 -1.11491483 N 22.72437894 24.13903581 25.85495926 4.38751084 -2.21161133 -9.25660809 N 21.60884565 25.80888245 26.00209275 1.51236208 0.32028485 -0.16144544 N 24.32554533 24.28016609 24.66541815 -12.18722118 -8.89302976 -19.27591931 N 25.92836722 25.99406158 24.24254293 -1.26988524 1.96046378 -1.74123837 N 25.61566561 24.37156966 25.81120354 -4.95568915 -4.81807765 5.44859733 N 24.41190241 25.57266751 25.95682524 -0.01450597 3.61150864 2.45751980