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=0.2895400404708275 stress="-0.5659872771226058 0.009834637745803954 -0.005080991555477088 0.009834637745803954 -0.4951564514594887 0.012201082764959875 -0.005080991555477088 0.012201082764959875 -0.4936638661354567" pbc="F F F" H 0.26959405 0.17626233 -0.14597521 -0.15488408 -0.16623673 -0.22660548 H 1.70996341 1.49207130 0.15300231 0.21212266 0.19631209 -0.12922039 H 1.53848316 -0.04225341 1.41852158 0.15349397 -0.19104961 0.19114210 H -0.04210664 1.38825682 1.27041603 -0.21073255 0.16097425 0.16468377