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=28783.496203555154 stress="-5299.851189646877 -689.3489633582045 -1316.9633755119032 -689.3489633582045 -3804.764285589351 -615.9056027276664 -1316.9633755119032 -615.9056027276664 -4244.127642812829" pbc="T F F"
Nb       0.23038191       0.13809176       0.07992523  -10082.20170797  -32002.13724406  -55959.29216681 
Nb       1.74584499       1.65888634       0.10255525  -14805.40941106   25674.41997687  -31196.57002125 
Nb       1.61968205       0.14970500       1.30870958  -10447.11704287  -48708.10591738   32594.83933171 
Nb      -0.00415465       1.30549096       1.45903056   35334.72816190   55035.82318457   54561.02285636