32 Lattice="9.672657174803863 0.0 0.0 0.0 9.672657174803863 0.0 0.0 0.0 9.672657174803863" Properties=species:S:1:pos:R:3:forces:R:3 energy=-25.493816814778533 stress="-6.000740139381447 2.0264565735491518 -4.1739899935713325 2.0264565735491518 -10.920248837609071 -0.12147771370880989 -4.1739899935713325 -0.12147771370880989 -6.936719287426355" pbc="F F F" Cd 0.08250748 -0.07163085 -0.08003711 0.03946336 0.06879296 0.32841983 Ca 2.27838596 2.19357763 0.10030025 -0.49664622 0.44415166 -0.60762058 Cd 2.38175803 0.20703266 2.61443351 -0.29978526 -0.34479655 -0.20133554 Ca -0.19980423 2.62524548 2.63409671 -0.50493044 -0.43612641 -0.61386744 Ca 4.82516361 0.16564762 0.09067761 0.53790921 -0.85684153 -0.49642929 Cd 7.36491168 2.50175722 0.04535483 -0.39941868 0.08662000 0.39995971 Cd 7.31189381 0.04937787 2.40846265 -0.01912822 -0.14738584 -0.22725730 Ca 4.88459134 2.19639342 2.64311820 -0.55465889 1.57059454 -0.91780006 Cd 0.05502824 4.70192466 0.04021277 0.15062384 0.16364464 0.10655301 Cd 2.60633161 7.19504555 -0.04103693 -0.30145205 0.04424064 0.15576314 Ca 2.41779658 4.87227830 2.37509915 0.17960931 -0.26188577 0.85717242 Ca 0.21650295 7.22671990 2.64436339 -0.45700846 0.79172024 -0.52188374 Ca 4.75545640 4.92248570 0.20632639 1.08489917 -0.53956230 -0.96585020 Cd 7.34631207 7.19214452 -0.21113731 -0.28196268 -0.22519379 0.32105162 Cd 7.24368029 4.79347763 2.57519009 -0.27168920 0.08888690 -0.18476403 Ca 4.97850609 7.49757461 2.39202264 -0.06432106 0.38439527 0.42125717 Ca -0.04474469 0.03209238 4.96118684 -0.27704647 -0.64983278 -0.56895497 Cd 2.20812585 2.27590976 4.65922733 0.33899420 0.52606189 0.40896549 Ca 2.33047051 -0.10005163 7.45938176 0.42398958 -0.25960066 0.07148899 Ca -0.04393594 2.63490551 7.15179267 -0.13280617 -0.27346642 0.91880038 Cd 4.68824913 0.23717260 4.63088290 -0.35751358 -1.22708179 1.05511951 Ca 7.06092996 2.23246168 4.61978601 1.48889037 0.66761104 1.04612657 Cd 7.19781700 -0.14380735 7.08404523 -0.28231658 0.20915034 -0.12331767 Ca 4.59416709 2.51728048 7.06688804 0.55967672 -0.21524126 0.03947254 Ca -0.13428734 4.86905208 5.02807895 -0.44765500 0.30315484 -0.57210158 Cd 2.49788670 7.31895112 4.93660503 0.11935015 -0.03948391 -0.27596404 Ca 2.56673886 5.01285268 7.08200809 0.33870166 0.15254031 0.32133737 Ca -0.11803937 7.31495436 7.26390314 -0.02250716 0.53750035 0.23182761 Cd 4.71349100 4.89309967 4.60521813 0.27098992 -0.01078291 0.06236648 Cd 7.35754078 7.21773237 4.54815797 -0.14840005 -0.32376714 0.25343561 Cd 7.12684184 4.92055330 7.29396897 -0.39303962 -0.07155178 -0.43565896 Cd 4.65744099 7.45786757 7.14458196 0.17918829 -0.15646476 -0.28631204