32 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=14.071022564548798 stress="-77.47928534057826 -18.378597857727165 -8.362414876337418 -18.378597857727165 -75.46376198609288 -16.9938515169751 -8.362414876337418 -16.9938515169751 -82.82645162147776" pbc="F F F" Kr 0.28624116 0.05210633 -0.12635995 0.01480023 -0.47195672 -0.50050659 Kr 1.62174405 1.75122860 0.13911290 -6.90822217 -8.26627578 -4.18751563 Kr 1.67911552 0.27007423 1.67859595 -10.73428451 -15.02692566 -15.36322464 Kr 0.18700861 1.31730868 1.32248065 -1.81483707 0.89996190 0.55263201 Kr 3.33502217 0.04202221 0.13296753 -5.04875793 -3.66611576 -2.49004975 Kr 4.57665203 1.18462230 0.18097162 4.38697713 6.02935118 -4.47254583 Kr 4.30046648 0.29975156 1.57192302 -1.73789691 -8.95032981 -1.78224021 Kr 2.75630972 1.47813430 1.59665676 13.16810075 2.59293149 -7.72250733 Kr 0.02391618 3.08225074 -0.05624517 -0.10707616 0.11777564 -0.03047275 Kr 2.01048239 4.61547822 0.03039054 -0.32814944 0.29934668 -0.18974218 Kr 1.69578204 2.89884354 1.39794289 -5.83941898 5.40871066 1.19909811 Kr -0.02183200 4.71675520 1.55626225 -3.67221294 0.01568518 -3.15726853 Kr 2.84800899 2.79770429 0.10312579 9.01760900 5.57320819 -2.90327469 Kr 4.53118113 4.53918260 0.43845558 4.05290257 -0.44421114 -3.92315924 Kr 4.35815885 2.76076823 1.55293052 0.32067415 0.27582450 0.00730171 Kr 3.32658871 4.69557011 1.58078666 -4.50289407 0.60056582 3.50653335 Kr 0.06247658 -0.00944752 3.16349815 -0.62209176 -0.37055965 -0.68814912 Kr 1.60545735 1.42255076 2.73056374 -9.26782416 6.65402095 15.10193051 Kr 1.25426557 0.33902596 4.60064222 2.04544305 -2.36087153 1.43139634 Kr 0.39269954 1.78436792 4.14725561 -5.20886479 -3.10441460 0.80041720 Kr 2.79131821 -0.08191386 2.77679775 6.91433426 -3.18209009 7.37646808 Kr 4.76253494 1.21050956 2.79066578 3.17145378 5.99683963 8.40198099 Kr 4.47496329 0.19869541 4.72890977 0.65179293 -0.73958176 0.10078803 Kr 3.20958923 1.57212929 4.54612980 -1.33818141 0.26643730 -0.04193228 Kr 0.03632401 3.24912633 3.13992503 -3.70921574 -1.16155630 -5.40334683 Kr 1.27138911 4.71831260 2.63778592 4.11635349 0.34340936 2.78108404 Kr 1.41657270 3.09605111 4.15606766 6.69995673 3.59427420 2.67676334 Kr 0.16765856 4.47195895 4.35184127 -0.56041513 3.19658736 2.70362933 Kr 2.66913505 2.74026616 2.76973525 5.76931001 5.50604891 5.73798478 Kr 4.59458529 4.52670193 2.99377494 1.46836257 -0.19636061 -0.11777090 Kr 4.74056132 2.69138630 4.33276131 0.57505450 0.51057981 -0.05098708 Kr 3.07936528 4.69543394 4.05431229 -0.97278197 0.05969064 0.64668576