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=-43.8125232707341 stress="-6.08668540384734e-05 -4.676510948417959e-05 -1.526822986028592e-05 -4.676510948417959e-05 4.767336858957882e-05 -2.029638589296769e-05 -1.526822986028592e-05 -2.029638589296769e-05 4.4650907209807156e-05" free_energy=-43.8125232707341 pbc="F F F" Ti 21.25902706 20.80021920 20.70934966 -0.90546366 -0.00663537 0.33028022 Ni 22.51446938 22.36276734 22.25455949 -0.85804660 0.13694788 4.20614488 Ti 23.90018788 21.07643240 21.03849814 2.04868702 -0.96113822 -0.77100304 Ni 25.78751377 22.60455813 22.66320346 -0.85778900 1.24065285 -0.12149681 Ni 21.38581192 23.45771271 20.75680246 -1.26936818 0.95639568 -0.37511276 Ni 22.44345512 25.43261369 22.43405618 0.87191426 -0.79872246 -0.42458863 V 23.79050994 23.78969774 20.88055429 1.95303130 1.40074727 0.37467828 V 25.51580069 25.51932382 22.36575209 -1.18319114 -1.18429220 0.50715469 V 20.83581862 21.41855590 24.27239079 1.01710046 0.10493917 -0.90881193 Ni 22.77144498 22.42499023 25.54062348 -0.40074513 1.10033154 -0.37750994 Ti 24.20159411 21.18055946 23.94550996 -1.99082953 -1.80245849 -1.82912727 V 25.29304268 22.54692357 25.49103011 0.99292266 2.26265475 1.35599696 Ti 20.99687803 24.15976026 24.12845986 0.27935031 -0.97060960 -0.94908452 Ti 22.86497306 25.21743399 25.74342989 -1.54200810 -0.50165627 0.97159839 Ni 23.98916032 24.00047313 23.77516603 -1.19006185 -1.23131873 -1.65987767 V 25.20330445 25.27975412 25.35709026 3.03449716 0.25416219 -0.32924084