16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-58.5377394968 stress="-0.13168726803367561 0.12905200234840566 0.1769096895445798 0.12905200234840566 0.008136045844396025 -0.03271885547627117 0.1769096895445798 -0.03271885547627117 -0.07839764802655359" pbc="F F F" Mo -0.14459490 0.11115480 0.11044915 1.67849664 1.33555357 1.71404960 Mo 1.70960170 1.16342156 1.33833517 -6.34798222 7.40505655 3.26841428 Mo 2.78829595 -0.10160297 0.14041416 4.21171353 -4.88123082 -6.06687832 Mo 4.27812781 1.45624327 1.10681310 1.71031611 0.04410094 1.48620203 Mo -0.12320595 2.95894820 0.20259391 1.76229081 -1.24512010 1.54823647 Mo 1.56504129 4.20865944 1.36550211 -7.22763228 8.56956252 3.09490850 Mo 2.78802619 3.22277084 0.18584377 6.20872248 -4.94424569 -8.40877734 Mo 4.68362810 4.69581920 1.64136437 -1.44117276 -1.24012161 0.37988591 Mo 0.26959405 0.17626233 2.69529298 -1.95049309 0.22160114 2.10276182 Mo 1.55137041 1.30875267 4.65300231 0.55038683 0.39102781 -3.73983173 Mo 3.03848316 -0.12238947 2.91852158 1.43022375 0.47661600 2.86716169 Mo 4.45789336 1.13222229 4.27041603 -2.24884379 0.65061886 -1.90865492 Mo 0.28252525 3.45115481 3.29140871 -4.58574291 -3.95940485 -0.52499286 Mo 1.54836685 4.53253581 4.64904689 2.17537975 1.06134933 1.07232968 Mo 2.78091226 3.10609294 2.96603997 4.80986487 -2.96742381 4.17913493 Mo 4.30598025 4.32157598 4.51361598 -0.73552772 -0.91793984 -1.06394974