16 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-52.01767453077684 stress="0.0001251465417090563 6.795026664381468e-05 -4.814396861400174e-05 6.795026664381468e-05 8.887613873897939e-05 8.05807536205131e-06 -4.814396861400174e-05 8.05807536205131e-06 9.40778329302944e-05" pbc="F F F" V 20.99451428 20.84126820 20.84140700 1.49866815 1.68489342 1.47550801 V 22.31668137 22.41986395 22.24396547 0.43248363 -1.00784247 0.14363975 V 24.09073906 21.27219963 20.93381326 -0.69398392 0.78386849 1.20972442 V 25.63132919 22.75978669 22.22592512 -1.16348414 -0.79566976 1.18226395 V 20.78504734 24.18365717 21.20288723 0.55278185 -1.15588281 0.23082005 V 22.58343331 25.05145119 22.44809454 -1.37575655 1.17976780 0.92530154 V 24.22094491 24.23171545 21.18190327 -0.56135960 -1.42920417 -2.40363233 V 25.32183498 25.71219253 22.42485375 0.69462056 0.23552976 1.15555648 V 21.12990665 20.78220450 24.28278197 0.93540335 1.31158388 -0.90677273 V 22.26388473 22.63362859 25.32702941 1.38105159 -1.45651699 0.11504625 V 24.07034430 21.04852473 24.05473499 -0.59185651 0.90098541 -1.10324231 V 25.18852040 22.63661615 25.40480033 0.57115395 -0.65153261 0.34432107 V 20.87719504 23.79869006 24.11041876 -0.90051703 0.29266191 -1.61258467 V 22.26735611 25.33533445 25.24148635 0.78163916 0.24277940 0.37814104 V 24.08611608 24.03369179 24.02598936 -1.62880941 -0.84985175 -1.34861802 V 25.22329650 25.34465623 25.40583543 0.06796490 0.71443050 0.21452751