16 Lattice="5.302629939999999 0.0 0.0 -2.6513149700251275 6.233148832674501 0.0 4.927380428372401e-16 -2.790369020751538 7.547742612109878" Properties=species:S:1:pos:R:3 energy=-77.86209867745816 magmom=0.0 pbc="T T T" O 1.46776266 0.16645850 3.68083028 O -1.18355231 4.67150583 0.09304102 O 1.18355231 3.27632132 3.86691233 O 3.83486728 -1.22872601 7.45470159 O 1.50516477 1.11874485 1.12278710 O -1.14615020 3.71921947 2.65108421 O 0.45375665 -2.09277677 5.66080696 O 4.84887329 -0.69759226 1.88693565 O 3.79746517 -0.27643966 4.89665840 O 1.14615020 2.32403496 6.42495552 Cu 2.65131497 0.00000000 0.00000000 Cu 2.65131497 -1.39518451 3.77387131 Se 0.48384642 0.80834803 2.44202684 Se 3.13516139 4.02961629 1.33184447 Se 2.16746855 2.63443178 5.10571578 Se -0.48384642 -0.58683648 6.21589814