32 Lattice="6.5 0.0 0.0 0.0 6.5 0.0 0.0 0.0 6.5" Properties=species:S:1:pos:R:3:forces:R:3 energy=139.37299972276173 stress="-830.1055190876032 26.415655920310456 -22.83187314689792 26.415655920310456 -822.7108452241555 -38.39870106397245 -22.83187314689792 -38.39870106397245 -863.4396637187981" pbc="F F F" U 0.17089611 -0.02988876 -0.29779682 -10.04832560 -14.98203517 -3.66657030 U 1.34255886 1.66884527 0.06978448 39.43271329 -31.62099410 -9.15667707 U 2.17905146 -0.15161904 1.83505355 -32.94033483 -20.34619355 -31.48017543 U 0.21211731 1.57468690 1.92094673 -48.12556654 -21.99431775 -51.73933614 U 3.40710459 -0.00957146 -0.14312801 -5.75967058 -11.44961465 -24.25055102 U 4.85164413 1.86622900 0.02201293 16.81883888 -18.76811018 -36.83131803 U 4.69134348 -0.07465759 1.61066276 16.81185126 -7.89764419 10.09613301 U 3.06443107 1.63739173 1.34551529 3.75928845 8.41499799 9.17687058 U 0.19273990 3.05722932 -0.23827333 -43.80996245 39.66070102 -17.02372694 U 1.67832204 4.75936473 0.23110688 -15.62220807 27.05790295 -5.31604948 U 1.62316022 3.20913913 1.82571341 32.32165387 3.21012351 -36.59867404 U -0.17141964 5.02220807 1.71442344 -9.57670951 14.39112844 -6.53887019 U 3.20706424 3.52559981 -0.28678287 8.53428137 -16.81204841 -19.62250171 U 5.09236445 4.66104778 0.20384132 19.42136095 11.79231945 -13.71691370 U 4.66724623 2.98214964 1.62541025 20.87428962 10.73100488 25.37579121 U 3.50551247 4.72944624 1.65539967 -9.71739594 38.39517664 -10.12279125 U 0.06482696 -0.15379940 3.26821382 -37.79861216 -22.63809037 -18.56363356 U 1.33075425 1.59463223 3.40586213 51.91419717 6.30451593 27.38694711 U 1.52895547 -0.16773400 4.60549600 -4.89059231 -15.86104636 53.88449595 U 0.12036030 1.73114239 5.12343919 -15.01058525 2.60714400 19.42470029 U 3.14228048 -0.23976508 3.49849743 49.05069389 -22.08646138 7.33179929 U 5.13411890 1.81519325 3.44877714 16.88440883 -32.67596900 -36.40941707 U 4.98381314 0.13250256 4.97531152 12.47371123 -13.46016016 9.63303703 U 3.30442580 1.47931870 4.65511711 -12.66079418 18.88908227 17.28821600 U 0.13572127 3.30791531 2.98387496 -55.45832322 18.85349205 45.03229699 U 1.71001927 4.94103388 3.25693356 -20.82309934 37.33100616 -26.49146707 U 1.79001753 3.47580078 4.80366320 -31.13124169 -57.37888500 24.84552369 U 0.18883157 4.87455875 4.91813966 -18.65444998 11.95484872 9.20497598 U 3.19832183 3.50980354 3.21667242 19.02322049 -38.74231300 10.37514446 U 5.14643892 4.77795338 3.35338854 11.98486286 15.40915417 -3.03693178 U 4.95188623 3.14766152 4.80018197 1.43351198 28.11184707 46.76171136 U 2.99663523 4.86202489 4.82357885 51.28898750 53.59943800 34.74796184