4
Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=1713.4010232556966 stress="-4874.182028990261 1040.1082446427379 704.4807371682809 1040.1082446427379 -8860.710898184427 2930.2624016681752 704.4807371682809 2930.2624016681752 -7613.7827486609785" pbc="F F F"
Md      -0.05942006       0.22264861      -0.24317026    -725.48078625   -1177.11523430   -1938.38672868 
Md       1.72790838       1.49045384       0.13209164    1185.61196559    4459.63875760   -3607.53611964 
Md       1.60175884       0.05304784       1.29531946    1776.85098330   -5544.05543466    3340.76241102 
Md       0.02844980       1.22483720       1.49267850   -2236.98216264    2261.53191136    2205.16043730