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=145.91353961266674 stress="-286.7322627582331 17.30732758939262 -12.404665167103687 17.30732758939262 -266.986932868781 -6.77838919240736 -12.404665167103687 -6.77838919240736 -305.858779359505" pbc="F F F" Na -0.14459490 0.11115480 0.11044915 -4.48067646 -6.71474871 -7.76210773 Na 1.74329349 1.31143450 -0.16166483 -5.63957019 12.85693491 -7.06325468 Na 1.28829595 -0.16490224 1.66640352 2.63538992 -6.35730420 0.25929712 Na -0.22187219 1.51878885 1.32834452 -6.07443717 3.17965123 3.52403837 Na 2.60009055 -0.04105180 0.20259391 8.67139758 -14.88333674 -2.43686287 Na 4.56504129 1.17241380 -0.13449789 4.45439733 1.23176447 -6.67460756 Na 4.28802619 0.22277084 1.68584377 4.27504488 -19.14458205 -16.95840065 Na 3.18362810 1.69581920 1.55268552 -12.41043382 -4.40771794 1.19072123 Na 0.26959405 3.17626233 -0.14597521 -6.79712657 -5.37428300 -14.01198383 Na 1.70996341 4.49207130 0.15300231 -2.04557888 11.36935068 -12.50658909 Na 1.29408032 2.95774659 1.41852158 14.78827777 -11.09926644 -3.24951506 Na -0.04210664 4.38825682 1.27041603 -10.23049560 14.77140688 0.64908565 Na 3.19178619 3.17895518 0.29140871 -8.45442016 -9.60522132 -24.27460711 Na 4.61455359 4.53253581 0.14904689 6.97787690 8.15730489 -6.30965320 Na 4.28091226 3.10609294 1.46603997 22.40119609 -5.77484512 6.25494334 Na 2.80598025 4.32157598 1.51361598 0.05406106 16.29884512 9.10736536 Na -0.14801295 -0.02432459 3.06329927 -11.44131936 -6.11962079 -3.42487706 Na 1.43745442 1.27846858 2.99451428 4.42648631 9.14427962 -4.28806829 Na 1.34126820 -0.15859300 4.31668137 5.78088267 -9.69860174 8.16710191 Na -0.08013605 1.24396547 4.59073906 -6.45071349 6.37128372 6.75338698 Na 3.27219963 -0.06618674 3.13132919 -9.00008195 -6.78777415 5.00627680 Na 4.75978669 1.22592512 2.78504734 13.35119548 16.27599876 12.39949200 Na 4.68365717 0.20288723 4.58343331 3.36580219 -1.72312056 7.36080647 Na 2.49763876 1.74684281 4.72094491 4.25060716 -3.24729113 4.77592543 Na 0.23171545 3.18190327 2.59474469 -13.51797747 -4.99625803 16.08898783 Na 1.71219253 4.42485375 3.12990665 -3.23806096 12.62533465 -6.92103488 Na 1.28220450 3.28278197 4.56210000 4.93709579 -18.64263027 6.46096321 Na 0.13362859 4.32702941 4.57034430 -19.31557549 15.46966175 3.75906592 Na 3.04852473 3.05473499 2.91561068 -6.54750700 -9.29270005 1.98811343 Na 4.63661615 4.40480033 2.75809691 7.56966750 10.75400858 2.91017689 Na 4.29869006 3.11041876 4.26735611 11.44873157 -5.85847504 8.29953456 Na 2.83533445 4.24148635 4.58611608 6.25586437 11.22195205 10.92627950