4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=47.159425867064904 stress="-2.362463565164122 0.0014949761876548852 -0.007365395944290655 0.0014949761876548852 -0.8232953318572136 0.08067279962414341 -0.007365395944290655 0.08067279962414341 -0.8064006341155215" free_energy=47.159425867064904 pbc="T F F" Cs 0.21545919 0.09073906 0.27219963 -1.31163961 -8.94296565 -8.70801193 Cs 1.25564823 1.63132919 0.25978669 1.54288725 9.06082931 -7.76461624 Cs 1.22592512 0.18365717 1.70288723 1.92289810 -7.56339932 9.05189139 Cs 0.08343331 1.29585403 1.44809454 -2.15414574 7.44553565 7.42073678