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=-1.299211207369618 stress="0.10777336728045232 -0.0016904454031051205 -0.0026238425280608398 -0.0016904454031051205 0.09157779907011508 -0.0013169084554987534 -0.0026238425280608398 -0.0013169084554987534 0.10178153328098657" pbc="T T T" user14 0.16933062 0.27153017 -0.26130023 0.06860885 0.50295173 0.05651401 user14 1.66524946 1.23857216 -0.07766181 -0.12372740 -0.57211624 0.22999500 user14 1.62766123 0.10436194 1.29012883 -0.13777759 0.39951876 -0.14796171 user14 0.29794920 1.49517982 1.22289477 0.19289613 -0.33035425 -0.13854730