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=-4.076188345971074 stress="-0.2747830411438465 0.5489559234539898 0.14528229382093114 0.5489559234539898 -0.8775322884148992 0.4681574484643747 0.14528229382093114 0.4681574484643747 -0.8188092711380288" free_energy=-4.076188345971074 pbc="F T F" Si 0.28805281 2.72956938 0.03926819 -5.61379027 19.82462842 -14.03324040 C 1.53464144 1.71932436 0.08117721 8.20606493 -11.75175557 -0.95457877 C 1.57330686 0.17828948 1.71182891 -2.24492445 -1.27396201 0.33130391 Si 0.07255377 1.51129231 1.51258782 -0.34735021 -6.79891085 14.65651526