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=9878846.743494429 pbc="T T T" Db -0.16176752 0.25692312 0.13062290 105 -14495479.93024383 -59570596.48146599 -54258311.25579956 Db 1.03155509 0.64494088 0.10819190 105 9851785.37780599 28809628.19516842 -30376337.09155165 Db 0.85410126 -0.00139251 0.77929917 105 -6114513.12944375 -29654908.51851910 30580144.34173269 Db -0.02468269 0.91970377 0.72687381 105 10758207.68188159 60415876.80481658 54054504.00561858