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=-12.159802283706233 stress="-28.629840318936093 -3.8580357139796098 11.545802341050159 -3.8580357139796098 -27.688345258192765 -4.086975028459928 11.545802341050159 -4.086975028459928 -31.79498277564102" pbc="F F F" Ta -0.07700850 -0.09301634 0.18107110 -6.20815594 -12.31073703 -7.21547496 Ta 1.32825321 1.63102478 0.09995250 14.30974333 8.31350977 -14.25883348 Ta 1.76120756 0.01193751 1.75226748 4.92837294 -4.44647770 4.23181177 Ta -0.03568003 1.54396501 1.57236142 -13.02996033 8.44370496 17.24249666