!BIOSYM archive 3 PBC=ON !DATE Oct 26 12:10:21 2020 PBC 3.25180 3.25180 5.19690 90.00000 90.00000 120.00000 Zn1 -0.00001626 1.87743699 0.00000000 XXXX 1 xx Zn 0.000 Zn2 1.62586748 0.93873258 2.59845000 XXXX 1 xx Zn 0.000 O3 -0.00001626 1.87743699 1.97778423 XXXX 1 xx O 0.000 O4 1.62586748 0.93873258 4.57623423 XXXX 1 xx O 0.000 end end