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=-5.76989774034754 stress="-48.48520790645708 3.919090080152232 -8.833453664105159 3.919090080152232 -76.4751335890316 -35.517596679802615 -8.833453664105159 -35.517596679802615 -70.41590205134659" pbc="F F F" Nb -0.14459490 0.11115480 0.11044915 -17.76521213 -41.53543201 -45.35578718 Nb 1.70960170 1.31143450 0.04092907 13.69999035 8.84744907 -7.48726489 Nb 1.28829595 -0.16490224 1.64041416 15.49289848 -11.78541725 17.74629031 Nb -0.22187219 1.51878885 1.32834452 -11.42767670 44.47340019 35.09676176