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:Z:I:1:forces:R:3 energy=310.34702722328956 pbc="T F F" C 0.19178619 0.17895518 0.29140871 6 -283.99100360 -155.88243811 -578.16264884 C 0.86455359 0.78253581 0.14904689 6 191.14492226 187.44843577 -126.20571959 C 0.53091226 0.10609294 0.71603997 6 449.26869147 -272.14901155 492.00024954 C -0.19401975 0.57157598 0.76361598 6 -356.42261013 240.58301388 212.36811889