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=6.175055099260163 stress="-0.8089761824481339 -0.055922872619419424 0.3168763265460085 -0.055922872619419424 -1.141080924143426 -0.09530154760595629 0.3168763265460085 -0.09530154760595629 -1.361242794365926" pbc="F T T"
H       0.27711528      -0.12128882      -0.24786923     -13.48889234      -2.67219077      11.67594139 
H       1.23125112       1.21824351       0.20944019       8.00961568       6.10084056       0.01158740 
H       1.26429260       0.32957941       1.71980528      14.59377279      -4.38916027      -8.60728290 
H       0.29977655       1.68543805       1.58422142      -9.11449613       0.96051048      -3.08024589