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:Z:I:1:forces:R:3 energy=364366.5389237127 pbc="T T F" Th 0.08473037 0.23759071 0.18557497 90 -983226.40246358 -600582.78187830 -455436.87776340 Th 1.33972733 1.33089127 0.09871241 90 659587.98144114 902247.97554695 -524002.78373549 Th 1.26257508 0.24213323 1.43768607 90 463430.72611837 -378756.98293862 837477.54091952 Th -0.00614423 1.67928038 1.61666789 90 -139792.30509593 77091.78926997 141962.12057936