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=-1.94470398871 stress="-5.686237775975197 -0.38214494582269726 0.3808344716201175 -0.38214494582269726 -5.6924801321245555 -0.019728906929015532 0.3808344716201175 -0.019728906929015532 -4.475251816591014" pbc="F F F" Ta -0.24440284 -0.29821528 0.29874826 -12.13701645 -12.24796157 -6.61865422 Ta 1.27290972 1.38090187 -0.13863341 11.77936127 6.99890239 -13.19083948 Ta 1.55835534 -0.25354363 1.48193431 9.34373378 -5.64516518 8.86953284 Ta -0.07998135 1.70070203 1.20342959 -8.98607860 10.89422436 10.93996086