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:Z:I:1:forces:R:3 energy=1722.998722501877 pbc="T T F" At -0.11081103 -0.24809902 -0.21181706 85 -540.23746677 1551.60206842 -1078.41372565 At 1.33922355 1.59078618 0.25742332 85 -361.86682264 -3262.32414885 -3417.07544409 At 1.35528985 -0.12413556 1.55215589 85 -902.49242389 1218.00123735 2820.07388228 At -0.28213978 1.25343351 1.54415581 85 1804.59671330 492.72084307 1675.41528746