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=27.823809723029616 stress="-2.2293579588742642 0.20643303314644776 0.14920611060487532 0.20643303314644776 -2.2469998960291826 0.22645174437737153 0.14920611060487532 0.22645174437737153 -1.5685943402882316" free_energy=27.823809723029616 pbc="T T F"
O       2.87679405       2.95894820       0.20259391       5.53222746      -3.80632238     -13.53192427 
O       1.56504129       1.20865944       0.22277084      -2.82079576       8.04132592     -15.19591905 
O       1.68584377       0.18362810       1.69581920       1.23235409      -1.81296047      16.53340962 
O       0.35681350       1.76959405       1.67626233      -3.94378579      -2.42204307      12.19443370