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=4281.67533253433 stress="-16526.01194993095 -7533.50249300342 -5937.756433429513 -7533.50249300342 -18435.858037539732 -6206.955576868968 -5937.756433429513 -6206.955576868968 -20168.045451939233" pbc="F F F" Sm -0.09760344 -0.17293396 -0.17733443 -50.53301195 -44.02383403 -55.75490697 Sm 1.77764040 1.58226593 1.48627071 -1783.40463432 -1169.13498078 -958.28024634 Sm 3.00637909 0.08920280 0.09830243 335.20281865 -924.69279172 -1093.36043581 Sm 4.59003763 1.28910181 1.71267092 1374.26719610 614.38558182 -584.41156598 Sm 0.20788226 3.00921622 0.04267438 -1380.94248036 -1077.98156339 -1913.11371285 Sm 1.24428924 4.25541092 1.60161169 529.64766040 2606.64546648 345.33747920 Sm 3.27365781 3.11511245 0.15400721 -1603.68301401 -1739.41251827 -3070.66589388 Sm 4.42791332 4.33895127 1.52597947 2604.54059684 2649.12165143 1816.46025100 Sm 0.12137777 0.25308090 2.85173916 -464.95897210 -506.42986847 161.88658888 Sm 1.47055620 1.72541440 4.67891243 71.22911314 -224.87718057 594.34169198 Sm 3.08464614 -0.17492774 2.82017602 -954.43670246 -1720.05582645 269.52586022 Sm 4.21800042 1.33334063 4.29274588 720.95617029 434.19251050 1121.46143948 Sm -0.17530215 2.99600325 3.14033502 -1505.52802160 -918.26484001 -218.42009200 Sm 1.15072490 4.61426996 4.23309711 571.19929229 1063.83576255 919.42826939 Sm 2.84840049 3.02169307 2.81319727 1368.97326032 794.95428131 2401.65379318 Sm 4.50891114 4.45626473 4.32395576 167.47072877 161.73814959 263.91148049