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=-4.7444411341 stress="-3.22836391707131 -0.870040601407861 -0.3960966727664761 -0.870040601407861 -3.157225917558945 0.8921697952791704 -0.3960966727664761 0.8921697952791704 -3.0335098621254413" pbc="F F F" Ti -0.03509031 -0.23739624 0.12263099 -6.64326156 -4.06375388 -5.24774306 V 1.54530481 1.45206007 0.12593290 5.60028661 7.09645572 -6.11610983 Ni 1.34000708 -0.10098809 1.41812645 4.04633684 -4.83082865 8.86518771 Ni -0.29877986 1.73212867 1.25294705 -3.00336188 1.79812681 2.49866518