Ar 1.0000000000000000 3.7235044060918598 0.0000000000000000 0.0000000000000000 -1.8617522030459299 3.2246494067788376 0.0000000000000000 -0.0000000000000000 0.0000000000000000 6.0837218614677733 Ar 2 Selective dynamics Cartesian -0.0000000186175225 2.1497662819347236 1.5209304653669433 T T T 1.8617521844284075 1.0748831463417776 4.5627913961008311 T T T