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=145.99103360366226 stress="-0.0036936460359833687 -0.00010946049717289889 -0.00019713600190966954 -0.00010946049717289889 -0.0033912661010483494 -0.00030561654431810473 -0.00019713600190966954 -0.00030561654431810473 -0.0034480618379090725" free_energy=145.99103360366226 pbc="F F F" Sr 20.85540510 21.11115480 21.11044915 -10.78362288 -7.76472794 -9.00136503 Sr 22.70960170 22.16342156 22.31401058 -8.61237607 2.21938877 -1.27436079 Sr 23.78829595 20.83509776 21.14041416 7.73316703 -17.05018348 -16.54736453 Sr 25.27812781 22.58208812 22.32834452 22.83800518 -2.44773434 -4.53878082 Sr 20.87679405 23.95894820 21.20259391 -13.94156718 2.73856491 -9.19801610 Sr 22.56504129 25.20865944 22.30295653 -6.91199243 23.87009703 -0.31164296 Sr 23.78802619 24.00123941 21.18584377 8.88031181 4.30769374 -23.98084832 Sr 25.68362810 25.69581920 22.64685009 8.08564226 7.81118636 -3.42474341 Sr 21.26959405 21.17626233 23.85402479 -14.34122890 -10.72699061 7.81386575 Sr 22.70996341 22.49207130 25.65300231 -4.84973225 -5.50282975 18.63533694 Sr 24.03848316 20.95774659 23.91852158 5.33901068 -20.27956392 6.39985996 Sr 25.45789336 22.38825682 25.27041603 14.24832993 -2.92596255 10.66203400 Sr 21.19178619 24.17346946 24.29140871 -19.25214292 1.82274602 2.18725300 Sr 22.61455359 25.53253581 25.64904689 -3.33257818 12.64198679 11.28016516 Sr 23.78091226 23.94736114 23.96603997 5.66933789 4.46189813 3.23854618 Sr 25.30598025 25.32157598 25.51361598 9.23143605 6.82443085 8.06006099