32 Lattice="53.8970947265625 0.0 0.0 0.0 53.8970947265625 0.0 0.0 0.0 53.8970947265625" Properties=species:S:1:pos:R:3:forces:R:3 energy=-74.66622942409853 stress="0.0003656416544647132 1.4433526557632509e-05 1.946093833883538e-05 1.4433526557632509e-05 0.0003666021040949118 2.2201085260348813e-05 1.946093833883538e-05 2.2201085260348813e-05 0.0004076593346092173" free_energy=-74.66622942409853 pbc="F F F" B 26.82805161 27.04117636 27.04058832 2.90540131 3.17584018 3.57236225 B 29.07618818 28.71630569 26.81382667 -0.37446660 -1.61932086 2.44879073 B 28.69702356 26.81112883 28.99045540 -1.68026038 2.51964116 -0.76634236 B 26.76365387 28.88910098 28.73039737 2.30534372 -1.62774658 -2.17139901 B 30.71732602 26.91433753 27.11737562 -0.31148673 3.80682784 1.57585068 B 32.77743716 28.63065980 26.83646579 -2.19176318 -1.68507170 2.06024663 B 32.54659124 27.13418973 29.02831341 -0.81723976 1.02999772 -1.45062816 B 30.95136326 29.03662627 28.99581868 -0.71611483 -2.47221530 -1.12002492 B 27.17320907 30.71463887 26.82690135 1.68947772 -0.09304156 3.56594338 B 29.04841311 32.71662883 27.07604929 -2.34897243 0.23270417 1.21831237 B 28.90551290 30.76312867 28.77534022 -5.27900047 -1.70028853 -0.43939405 B 26.91345850 32.63011677 28.68212363 1.97913647 -2.70926653 -0.89084265 B 30.95816167 30.86899869 27.19138796 1.32582241 -1.68383200 -2.02921255 B 32.81869741 32.75034926 27.07275311 -0.25238480 -0.62269242 0.73942876 B 32.54066296 30.88675063 28.64147455 2.81348637 0.80398680 -0.01064876 B 30.63665672 32.57454940 28.63627752 -1.01762804 3.87594050 -0.43055119 B 26.82520324 26.92827688 30.85108923 3.33387369 2.70931420 1.21100661 B 29.07027917 28.68883408 30.60452651 -0.41639656 -0.93211871 0.02492714 B 28.74116710 26.81638653 32.57047056 -1.05615840 3.45685558 -1.64928657 B 26.88176732 28.66008149 32.79885197 2.99539828 -1.95828399 -2.80700900 B 30.92592442 26.89339174 30.90778084 0.15313220 0.56958007 2.33602294 B 32.93972499 28.64504787 30.61921263 0.27464981 -1.58817835 2.59690368 B 32.87628372 27.11762005 32.79276384 -2.76015761 2.48894931 -3.74210307 B 30.51269036 28.83018906 32.90735684 -1.09577017 -0.87891958 -2.59028214 B 27.14164358 30.94992590 30.64986899 1.00801702 1.12413348 -0.61672040 B 29.05027071 32.66061421 30.90659539 0.13938348 -0.05751133 0.04940433 B 28.74057681 30.82270513 32.77498609 -1.03941864 -1.18449984 -0.04903032 B 27.05990452 32.57909393 32.76680159 1.72520722 -2.01428775 -1.51465076 B 30.83877712 30.84395234 30.72801541 1.44095232 -1.08589335 2.05877747 B 32.83708287 32.64390303 30.62935125 -0.96035993 -2.42844898 -0.01786987 B 32.55547780 30.89035548 32.52936617 -1.56314809 0.64233615 -1.74476875 B 30.82837024 32.50780805 32.54785747 -0.20855540 -0.09448979 0.58278753