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=-3.605386896127775 stress="-0.6641833223582043 -0.22820342955879402 0.005245848673646152 -0.22820342955879402 -0.7586341656620186 -0.03435246450794569 0.005245848673646152 -0.03435246450794569 -0.5277966833885455" free_energy=-3.605386896127775 pbc="T T T"
H       -0.26124573       0.05709547      -0.06738766      -1.75517051       2.19775103       0.87721949
C        1.61833660       1.31520530       0.24884063      -3.36634691      -2.86831304       4.56432080
O        1.53627219      -0.01076807       1.32323195      -0.19341292       0.28606306      -8.69836342
N        0.29941889       1.42834661       1.68259565       5.31493034       0.38449895       3.25682313