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=-0.029508026094645014 stress="0.08962413342338241 -0.017393397669406657 -0.04607741977631716 -0.017393397669406657 0.09415260474410249 -0.011816588512755945 -0.04607741977631716 -0.011816588512755945 0.12418437412621003" pbc="F F F"
H      -0.11777505       0.01286236      -0.19316564       0.01845100       0.01051223       0.01348626 
H       1.29463512       1.60749821       0.18525933      -0.05546523      -0.02591977       0.07623526 
H       1.27604667       0.06883296       1.43667498      -0.02700301       0.04852546      -0.02511166 
H       0.29387813       1.68977955       1.54195200       0.06401724      -0.03311792      -0.06460985