Cl H Na O 1.0000000000000000 2.6433070448809319 0.4033857111602034 -1.2313696467774269 -3.4753713125412964 6.6062464871232303 -2.2786263734918535 3.9881263739545827 -4.1099147312369269 4.8490464903019266 Cl H Na O 2 8 2 12 Selective dynamics Cartesian 1.7403281468571696 1.7872890389402065 1.5199955795627225 T T T 1.4157339594370337 1.1124284281063028 -0.1809451095300927 T T T -0.7231042341521071 6.9148258835548289 -3.7999154045557475 T T T 3.8791663404463281 -4.0151084165083208 5.1389658745883784 T T T 0.7505247114652362 0.8962864513850108 1.7355595169485292 T T T 2.4055373948289631 2.0034310156615152 -0.3965090469159002 T T T 0.5536418249887280 -0.0634615781606963 1.2794997896792464 T T T 2.6024202813054913 2.9631790452072155 0.0595506803533835 T T T 4.2058654771614190 -3.6405658038159938 4.7892973072501261 T T T -1.0498033708672241 6.5402832708625125 -3.4502468372174930 T T T -1.3250016308231487 4.7068210075998165 -1.3880218510169002 T T T 4.4810637371173474 -1.8071035405533180 2.7270723210495302 T T T 1.7244205653808662 2.6463745194667379 -0.0251500081908880 T T T 1.4316415409133485 0.2533429475797726 1.3642004782235124 T T T 2.8376181421042559 2.1227779117697692 0.4578724522061172 T T T 0.3184439641899421 0.7769395552767498 0.8811780178265199 T T T 1.2978520033137639 2.2494884868171092 2.9279134678822794 T T T 1.8582101029804459 0.6502289802294060 -1.5888629978496600 T T T 0.7471268977197183 3.0024759455802608 1.5393849496981735 T T T 2.4089352085744999 -0.1027584785337407 -0.2003344796655479 T T T -0.8872509836065181 6.7412352489687111 -5.5390203714257966 T T T 4.0433130899007264 -3.8415177819221591 6.8780708414584275 T T T 3.7814892771155444 -2.7606324683765147 4.7364059643153871 T T T -0.6254271708213373 5.6603499354230360 -3.3973554942827779 T T T