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=-7.292371947921652 stress="-0.8845485353552986 -0.2697688844621107 0.022408508040911938 -0.2697688844621107 -0.8025275374431423 -0.11625342902110745 0.022408508040911938 -0.11625342902110745 -0.7147481553906476" free_energy=-7.292371947921652 pbc="T T F"
B        0.06504129      -0.29134056       0.22277084       6.64535392      -2.09359886      -7.11162921
B        1.68584377       1.68362810       0.19581920      -6.14776934      -0.28737780      -7.37584220
B        1.64685009       0.42259636       1.67626233      -0.75539977       0.59135795       3.85717485
B       -0.14597521       1.70996341       1.49207130       0.25781518       1.78961870      10.63029656