16 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-33.48220753678469 stress="0.0012992859551923346 0.00018053139279244394 0.0002038829386893677 0.00018053139279244394 0.0015915651698229373 0.00018297880116276036 0.0002038829386893677 0.00018297880116276036 0.0012844330059408257" pbc="F F F" Mn 21.13362859 20.82702941 21.07034430 2.79606711 4.39101552 2.40372801 Mn 22.46186356 22.55473499 22.41561068 -0.21084678 0.71819095 -2.62828073 Mn 23.98317105 20.90480033 20.87719504 -0.62510636 7.78367890 5.86029711 Mn 25.29869006 22.48283112 22.08966455 -9.70042139 -0.85068771 -2.23047283 Mn 20.83533445 23.65197795 21.08611608 6.36735275 -0.21156636 6.42894943 Mn 22.53369179 25.52598936 21.94616070 1.04027237 -8.86884608 0.27380314 Mn 23.90233509 23.65788963 20.75559716 -0.35559679 -2.65276112 9.17205360 Mn 25.20178472 25.79874826 22.42779754 -4.65664488 -3.72391474 0.12621864 Mn 20.88090187 20.86136659 24.11824075 5.97080891 4.45338743 0.56106240 Mn 22.24645637 22.48193431 25.42001865 0.05026091 -0.05268635 -8.62357056 Mn 23.90315948 20.70342959 23.90085166 -1.90062702 7.61640546 -1.03112319 Mn 25.49793547 22.78187239 25.51001192 -4.36249060 5.29057734 -4.47694108 Mn 20.98453339 24.26601203 23.69219095 7.44198085 -0.86067306 -1.83905946 Mn 22.21904386 25.50082602 25.74624097 -1.90705237 -4.34660043 -3.14884391 Mn 24.14302402 23.85498893 24.11042859 3.01856136 -2.05291950 2.70760517 Mn 25.70947124 25.35512851 25.55280714 -2.96651807 -6.63260025 -3.55542574