5
Lattice="5.057949 -0.023879 -0.059682 0.006618 4.888737 -1.35739 0.049341 -1.22618 5.014248" Properties=species:S:1:pos:R:3 energy=-547.141424208 pbc="T T T"
Bi       5.06633000       3.26577900       2.21861100
Ag       2.54059600       2.51803000      -0.38055900
S        2.57526200       1.88019400       2.12636600
S        2.57308400      -0.47497900       2.75327900
S        0.01637500       2.55730800      -0.27739100