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=-19.45136270842445 stress="-0.6973855701558347 0.10772377030618024 0.04052348841201526 0.10772377030618024 -0.7357604734493953 0.04278128359208591 0.04052348841201526 0.04278128359208591 -1.4480493104741885" pbc="F F T" Mn 0.01821382 0.15586213 -0.09604453 -7.41285651 -4.62150578 2.27127843 Mn 1.33226600 1.23049600 0.12036030 8.00889651 9.05433667 2.14298719 Mn 1.45631248 0.24843919 1.64432661 6.98994498 -11.41367154 -2.39572951 Mn 0.24849743 1.75911890 1.69019325 -7.58598497 6.98084065 -2.01853610