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=6992.919048725371 pbc="F F T" Bi 0.25974725 0.22691099 0.19215431 83 -18932.53324178 -7650.14800736 -14960.69805974 Bi 1.37939208 1.54844216 0.21396696 83 14430.02131566 9316.14238039 -10804.71022151 Bi 1.43471108 0.05131367 1.31527622 83 14988.92341951 -6658.72652444 14111.76407080 Bi 0.26458329 1.54352492 1.46996298 83 -10486.41149340 4992.73215141 11653.64421045