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=0.6495013276427414 stress="-0.050591850162373 0.0006348271940715098 0.0008036523693489053 0.0006348271940715098 -0.05329733743037358 0.00026141662821597066 0.0008036523693489053 0.00026141662821597066 -0.03363953592744678" pbc="T T F"
H       0.35559622       0.10352445       0.22277084      -0.01011077      -0.01401823      -0.31436452 
H       1.64359035       1.60214968       0.19581920       0.01991094       0.01530535      -0.34198956 
H       1.64685009       0.22748741       1.67626233      -0.04735639      -0.02721094       0.35799655 
H      -0.14597521       1.59822023       1.49207130       0.03755622       0.02592382       0.29835753