32 Lattice="13.134969759850843 0.0 0.0 0.0 13.134969759850843 0.0 0.0 0.0 13.134969759850843" Properties=species:S:1:pos:R:3:forces:R:3 energy=-23.03671388797046 stress="-0.0003894421902256894 4.174794776287335e-05 6.499492519184059e-05 4.174794776287335e-05 -0.00039389931426666273 4.819044974062853e-07 6.499492519184059e-05 4.819044974062853e-07 -0.00041365945851866507" free_energy=-23.03671388797046 pbc="F F F" Sr 0.11106768 0.03821339 0.00734423 -0.02852755 -0.04075722 -0.04656266 Sr 3.32894653 3.31988918 0.00945406 0.10381064 0.06713397 -0.07801079 Sr 3.31747062 0.00757688 3.27983019 0.12854575 -0.08502264 0.11390426 Sr 0.06311209 3.22600622 3.24152779 -0.09102208 0.16789286 0.12836488 Sr 6.62752867 0.04106139 0.05338375 -0.11127756 -0.06086812 -0.09271255 Sr 9.87799028 3.32467391 0.02579098 0.05550918 0.06935202 -0.05996392 Sr 9.81902728 0.05761779 3.27491393 0.09813238 -0.06956501 0.10763075 Sr 6.57847391 3.21972261 3.30182101 -0.13686792 0.21486892 0.14359823 Sr 0.05769697 6.56618016 0.01935904 -0.06206081 -0.10469715 -0.06657648 Sr 3.27089453 9.86011981 0.00901833 0.13708096 0.02646171 -0.03292566 Sr 3.28668552 6.52082874 3.29977446 0.16732165 -0.10725977 0.11972537 Sr 0.03348106 9.79680143 3.23344113 -0.05994742 0.06779603 0.11457904 Sr 6.57767487 6.50365638 0.06087779 -0.09646537 -0.04527791 -0.05490254 Sr 9.80692648 9.86017218 0.00356498 0.01560620 -0.00430136 -0.01623898 Sr 9.91626131 6.53175963 3.29863557 0.04651988 -0.05145847 0.10464220 Sr 6.63080029 9.80596316 3.30006159 -0.12696798 0.04967973 0.07716448 Sr 0.05108510 0.06044512 6.52741728 -0.04837846 -0.07820153 -0.05763463 Sr 3.30251606 3.29040125 6.54501993 0.13795866 0.15455513 -0.08660334 Sr 3.34757565 0.02059075 9.85524674 0.05669202 -0.05694898 0.03137713 Sr 0.02417738 3.22718394 9.84835091 -0.03364999 0.11400565 0.03631305 Sr 6.62921094 0.02337355 6.60303907 -0.12790359 -0.08984905 -0.12055953 Sr 9.83633371 3.33037023 6.56466724 0.09350957 0.07627246 -0.08975853 Sr 9.91260877 0.06207614 9.83584328 0.02304190 -0.01483550 0.01899859 Sr 6.57965543 3.26404956 9.81258743 -0.10410205 0.16859863 0.08423676 Sr 0.03367220 6.60756090 6.57735761 -0.07760628 -0.16075193 -0.11473435 Sr 3.34127517 9.78959152 6.50868453 0.08404060 0.08405638 -0.06345297 Sr 3.23331213 6.62943266 9.88753785 0.18025327 -0.16478583 0.03420203 Sr 0.03184496 9.81580676 9.87164241 -0.02479934 0.05250583 0.00387073 Sr 6.61885261 6.55267817 6.56086785 -0.17162752 -0.12228552 -0.10909005 Sr 9.82737015 9.91458038 6.62915757 0.06174003 0.03220286 -0.12683525 Sr 9.88485764 6.62545862 9.83633186 0.03389901 -0.11150946 0.05227189 Sr 6.60440771 9.88852215 9.84936906 -0.12245780 0.02299327 0.04568284