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=-6.655225836158172 stress="0.10690040892547309 -0.08098752313065138 -0.02221919827582609 -0.08098752313065138 0.4679918138352355 -0.07884644900251439 -0.02221919827582609 -0.07884644900251439 -0.06568919156011215" free_energy=-6.655225836158172 pbc="T F T"
N        0.25501948       0.15075815      -0.23589800       0.02700020       6.10546442      -3.18323391
O        1.46545771       1.34107598       0.10260142       9.34799544      -0.60424949       6.15623838
H        1.38979218       0.13185401       1.43192522      -1.98342081       4.24369078       1.28734965
B       -0.16941539       1.36537308       1.52278034      -7.39157483      -9.74490571      -4.26035412