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=-0.9260266686017606 stress="0.07377224682223617 0.0009261235739994287 0.008773915373670569 0.0009261235739994287 0.04974567587718956 0.008118869885721094 0.008773915373670569 0.008118869885721094 0.08598240088725714" pbc="T F T" user13 0.22979430 0.11660754 0.29293626 0.47225719 0.47841296 0.42664602 user13 1.40648813 1.53023517 -0.19541446 -0.11980560 -0.46953269 -0.13555460 user13 1.27599802 0.07376805 1.57715882 -0.44131530 0.45846102 -0.26355295 user13 -0.11039766 1.52831380 1.44961108 0.08886371 -0.46734129 -0.02753847