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=-4.361605852101208 stress="0.22757866002524443 0.11452477357963992 -0.024992443885245345 0.11452477357963992 0.11815036390279733 -0.05912917072423894 -0.024992443885245345 -0.05912917072423894 0.12345662266293493" free_energy=-4.361605852101208 pbc="F F T"
C       0.22995133       0.14749966       2.93227989       4.28500126       2.10030464      -0.33759447 
O       1.29432760       1.59235979       0.27283800      -2.71864725      -2.83161001       1.51306499 
N       1.63226117       0.15855461       1.44824288      -2.23876493       0.02743065      -0.72098886 
H       0.06410228       1.42743913       1.60089068       0.67241092       0.70387472      -0.45448166