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=-7.30269807417 stress="1.1757767259249432 -1.1299309800575785 -0.16084739300304635 -1.1299309800575785 -0.5092148758102173 0.9207251633084276 -0.16084739300304635 0.9207251633084276 1.7706356947684487" pbc="F F F" N 0.02103145 -0.22238644 0.18220204 0.61879754 -0.93265379 3.48023352 N 1.39362841 1.65873007 0.02724172 -0.65014649 3.27121247 1.70878437 N 1.27538150 -0.29703668 1.34887301 -3.53499840 0.38996548 -0.64246028 N 0.22083292 1.28984966 1.48735431 3.56634735 -2.72852416 -4.54655760