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=71504.74456324229 stress="-12050.7276642938 1602.1281477148445 -2861.7798464863004 1602.1281477148445 -9618.119887967427 100.26512101995576 -2861.7798464863004 100.26512101995576 -10414.208518763564" pbc="T T F"
Sm       0.26816931      -0.24607484       0.10286858 -134701.62837564  -34010.90824026 -154216.02879693 
Sm       1.53186298       1.25093747       0.06149080   63347.24917225   35921.85415379  -88678.83920512 
Sm       1.40882787      -0.07165776       1.24128028  179445.77936515  -78835.68161452  162321.06293377 
Sm       0.25938502       1.17981486       1.25369048 -108091.40016176   76924.73570098   80573.80506828