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=2.901111892626675 stress="-0.21020710165550063 -0.10408940808711344 -0.47536857972496166 -0.10408940808711344 -0.798470755418161 -0.20389888185080654 -0.47536857972496166 -0.20389888185080654 -0.5924107643323111" free_energy=2.901111892626675 pbc="F T F"
F       0.07146234       0.09856702       0.23939028      -8.47546344      -4.98660420     -17.23280901 
H       1.30557629       1.68389653       0.22762461      -2.15183691       0.35693075       3.81380877 
C       1.48047546       0.12876381       1.47993658       5.70893575       1.55451189       5.43797349 
C       0.12986364       1.77479266       1.40389038       4.91836460       3.07516156       7.98102675