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=-8.496661314566325 stress="0.5302204799404838 -0.11983685256238334 -0.36792771647293854 -0.11983685256238334 0.3315366691443806 -0.0572852077375878 -0.36792771647293854 -0.0572852077375878 0.38994931077103456" free_energy=-8.496661314566325 pbc="T F F"
N       -0.13732961       0.22725014       0.23446333      -5.27758406       6.12774995       3.17630947
B        1.26566576       1.41891241       0.07146234      -2.84719568      -6.66805698       5.32714581
H        1.59856702       0.23939028       1.30557629       3.73712729       1.22029300      -5.34654335
O        0.04165967       1.72762461       1.48047546       4.38765245      -0.67998598      -3.15691193