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=-7.6441844768 stress="1.3536679248908976 0.06127755504123725 0.2258432509494521 0.06127755504123725 1.3084365634561934 -0.1350019015593109 0.2258432509494521 -0.1350019015593109 1.5967334246010665" pbc="F F F" C 0.25978669 -0.27407488 -0.21495266 2.63990313 1.67207629 3.15322988 C 1.68365717 1.70288723 0.08343331 -3.17035337 -1.94397654 1.98083159 C 1.29585403 -0.05190546 1.72094491 -2.81995247 2.28799356 -3.96643616 C 0.23171545 1.68190327 1.32183498 3.35040271 -2.01609331 -1.16762531