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:Z:I:1:forces:R:3 energy=21964.813004943444 pbc="T F T"
Nb      -0.01737195      -0.16140724      -0.19000212       41    4675.38606843  -27825.83299953   24099.58684278 
Nb       1.79563403       1.75992344       0.20887594       41  -26026.49856181   17432.00980462   -4828.81238106 
Nb       1.51104098       0.06646670       1.44479990       41  -18202.72171434  -25054.51735582   -9753.04324355 
Nb      -0.13502975       1.32869027       1.69641704       41   39553.83420772   35448.34055074   -9517.73121817