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=-0.08508790292921063 stress="0.04094565368090995 -0.05422592923047572 -0.0034136815369591035 -0.05422592923047572 0.054991052392759955 -0.022129764405363756 -0.0034136815369591035 -0.022129764405363756 0.004383894206801541" free_energy=-0.08508790292921063 pbc="T T T"
H       2.85540510       0.11115480       0.11044915      -0.58442099       0.73655492      -0.14753327 
H       1.70960170       1.31143450       2.83833517       0.51959622      -0.16963569      -0.22461920 
H       1.47192405       2.68912255       1.85037757       0.49824217      -0.88664083       0.08290526 
H       2.77019911       1.67179116       1.36682768      -0.43341740       0.31972159       0.28924721