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=142847.93281398344 pbc="T F T" Pr 0.23986781 0.09959755 -0.22739580 59 -349092.77648239 -132319.31654469 463127.59890850 Pr 1.33148992 1.60375715 -0.10137204 59 106586.51541226 100779.15107329 63121.55421042 Pr 1.37537659 -0.27744070 1.64217002 59 332786.28220410 -137141.61438820 -327411.84395124 Pr 0.01140844 1.35264213 1.58029288 59 -90280.02113397 168681.77985960 -198837.30916769