16 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-20.624310012276286 stress="0.0005105629837770782 6.24840145045896e-05 1.7559614219564986e-05 6.24840145045896e-05 0.0005255970814457072 7.655402260176012e-06 1.7559614219564986e-05 7.655402260176012e-06 0.0005672711651925726" pbc="F F F" B 20.78818294 20.83922355 21.09078618 0.70946344 0.91756221 0.87771913 B 22.75742332 22.55771257 22.37586444 0.56013780 0.70081785 0.74776861 B 24.11354657 20.71786022 20.75343351 -0.32975337 1.12310326 0.96526785 B 25.54415581 22.47882658 22.63451653 -2.80792493 0.70180580 0.84239562 B 20.94917887 23.72844792 20.85587493 1.64793985 -0.08010791 1.73034079 B 22.25534816 25.34324059 22.24192238 -0.41630544 -3.17295175 0.98328123 B 24.07953224 23.70975770 20.94867012 -1.08065899 -1.21607471 3.38132223 B 25.30315192 25.32206028 22.65571493 -2.28199792 -2.72746421 1.95033861 B 21.27666978 21.27925960 23.76018431 3.19197704 3.09983344 0.38962065 B 22.31684347 22.45903020 25.24802762 -0.68199798 -0.35051359 -4.45628415 B 23.95375095 21.06683225 23.93927127 -0.86770798 3.12235200 -0.76315754 B 25.67093812 22.46777718 25.37633299 -1.51153138 0.74050961 -1.74656496 B 21.23720612 24.04213952 23.85313536 3.21202998 -0.92136034 -0.89259552 B 22.74257962 25.48785390 25.56179810 1.29758585 -1.70003524 -1.70922109 B 24.23488730 24.21531963 24.17052461 1.33409495 1.40424352 -0.34124203 B 25.46542365 25.41918787 25.66333169 -1.97535094 -1.64171993 -1.95898942