16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-77.71191188219872 stress="-35.80359446851989 -1.946229287618257 -3.038803257760744 -1.946229287618257 -18.48970796738294 -22.015585576081214 -3.038803257760744 -22.015585576081214 -25.329561600328923" pbc="F F F" Ta -0.08129564 0.04860922 0.20118821 -0.35691843 -0.15457959 0.09148271 Ta 1.70960170 1.31143450 1.33833517 -3.65400695 5.83809809 3.75428396 Ta 2.78829595 -0.16490224 0.14041416 1.47075900 -3.99034607 -3.67579197 Ta 4.27812781 1.51878885 1.32834452 2.61680371 2.42652695 1.55673786 Ta -0.12320595 2.95894820 0.47479353 -2.90905555 -3.30064029 -0.89681368 Ta 1.56504129 4.20865944 1.36550211 -4.01064810 9.96418066 8.84706395 Ta 2.78802619 3.22277084 0.18584377 7.50879652 -5.79362169 -8.61284259 Ta 4.68362810 4.69581920 1.58066335 -1.23939819 -1.23727848 0.80513992 Ta 0.26959405 0.30759152 3.11381148 -6.53215702 -4.67844074 -8.00307564 Ta 1.43588853 1.27711863 4.44885634 7.59877333 5.75459384 8.03222044 Ta 3.03848316 -0.04225341 2.86661612 0.26077172 -1.87531090 1.45782946 Ta 4.67883827 1.38825682 4.50213148 -1.38241581 1.38607771 -1.02950106 Ta 0.19178619 3.17895518 3.29140871 -2.95735395 -1.84578476 -2.38495827 Ta 1.61455359 4.53253581 4.64904689 -0.85745496 2.43197411 2.60257257 Ta 2.78091226 3.10609294 3.14794325 1.74509394 -5.65356248 -3.17173356 Ta 4.12781522 4.53376851 4.43846973 2.69841072 0.72811364 0.62738590