Al Ca O 1.0000000000000000 9.0892264450894587 0.0000000000000000 0.0000000000000000 0.0000000000000000 9.2642045535680637 0.0000000000000000 0.0000000000000000 0.0000000000000000 9.9140837520939407 Al Ca O 24 20 56 Selective dynamics Cartesian 0.0000000000000000 5.2698822010694713 -6.2435950481877676 T T T 0.0000000000000000 3.9943223524986160 -1.2865531721407872 T T T 4.5446132225447213 9.9019844778534960 -6.2435950481877640 T T T 4.5446132225447213 -0.6377799242854241 -1.2865531721407921 T T T -0.0000000000000000 10.2238772387760868 -4.2285790663550715 T T T 0.0000000000000000 -0.9596726852079899 0.7284628096919205 T T T 4.5446132225447213 5.5917749619920256 -4.2285790663550644 T T T 4.5446132225447213 3.6724295915760448 0.7284628096919189 T T T 2.4418656728261778 1.0720364112053267 -4.1832394324183024 T T T 6.6473607722632773 8.1921681423627923 -9.1402813084652834 T T T 2.4418656728261783 8.1921681423627923 -9.1402813084652799 T T T 6.6473607722632808 1.0720364112053271 -4.1832394324183042 T T T 6.9864788953708894 5.7041386879893663 -4.1832394324183042 T T T 2.1027475497185293 3.5600658655787019 -9.1402813084652799 T T T 6.9864788953708894 3.5600658655787036 -9.1402813084652799 T T T 2.1027475497185297 5.7041386879893663 -4.1832394324183024 T T T 5.7145102776279684 6.6358378677205963 -2.4239580745829792 T T T 3.3747161674614663 2.6283666858474715 2.5330838014639099 T T T 5.7145102776279657 2.6283666858474750 2.5330838014639072 T T T 3.3747161674614663 6.6358378677205963 -2.4239580745829827 T T T 1.1698970550832650 2.0037355909365444 -2.4239580745829818 T T T 7.9193293900061770 7.2604689626315242 2.5330838014639108 T T T 1.1698970550832652 7.2604689626315260 2.5330838014639081 T T T 7.9193293900061743 2.0037355909365506 -2.4239580745829836 T T T -0.0000000000000000 2.8987450699764077 -7.6587922444686463 T T T -0.0000000000000000 6.3654594835916596 -2.7017503684216608 T T T 4.5446132225447213 -1.7333572068076224 -7.6587922444686498 T T T 4.5446132225447213 10.9975617603756923 -2.7017503684216644 T T T 1.3701857594498255 3.3129173181182683 -4.9927534974623171 T T T 7.7190406856396105 5.9512872354498079 -0.0357116214153608 T T T 1.3701857594498263 5.9512872354498096 -0.0357116214153612 T T T 7.7190406856396114 3.3129173181182692 -4.9927534974623171 T T T 5.9147989819945472 7.9450195949023161 -4.9927534974623136 T T T 3.1744274630948994 1.3191849586657729 -0.0357116214153610 T T T 5.9147989819945472 1.3191849586657751 -0.0357116214153577 T T T 3.1744274630948994 7.9450195949023144 -4.9927534974623144 T T T 2.9300300197955722 5.2572413255008872 -6.7066547561438563 T T T 6.1591964252938594 4.0069632280672067 -1.7496128800969162 T T T 2.9300300197955722 4.0069632280672085 -1.7496128800969162 T T T 6.1591964252938576 5.2572413255008890 -6.7066547561438581 T T T 7.4746432423403188 9.8893436022849333 -6.7066547561438536 T T T 1.6145832027491462 -0.6251390487168375 -1.7496128800969164 T T T 7.4746432423403197 -0.6251390487168377 -1.7496128800969180 T T T 1.6145832027491458 9.8893436022849297 -6.7066547561438581 T T T 0.0000000000000000 7.6218167195289910 -4.9272556268611734 T T T -0.0000000000000000 1.6423878340390812 -9.8842975029081508 T T T 4.5446132225447213 2.9897144427449405 -4.9272556268611698 T T T 4.5446132225447213 6.2744901108230984 -9.8842975029081472 T T T 0.0000000000000000 2.2663306107408583 -1.0715897344829672 T T T 0.0000000000000000 6.9978739428272183 3.8854521415640679 T T T 4.5446132225447213 6.8984328875249226 -1.0715897344829672 T T T 4.5446132225447213 2.3657716660431554 3.8854521415640679 T T T -0.0000000000000000 -0.8635121008132793 -3.9202222184095445 T T T 0.0000000000000000 10.1277166543813344 -8.8772640944564998 T T T 4.5446132225447213 3.7685901759707461 -3.9202222184095472 T T T 4.5446132225447213 5.4956143775973505 -8.8772640944564998 T T T 0.0000000000000000 0.9917484281185150 -1.1228834859599732 T T T -0.0000000000000000 8.2724561254495796 -6.0799253620069038 T T T 4.5446132225447213 5.6238507049025550 -1.1228834859599688 T T T 4.5446132225447213 3.6403538486655247 -6.0799253620069056 T T T 3.8844447234646555 4.0774237775853246 -5.0332668256104203 T T T 5.2047817216247942 5.1867807759827329 -9.9903087016573657 T T T 3.8844447234646573 5.1867807759827329 -9.9903087016573657 T T T 5.2047817216247925 4.0774237775853246 -5.0332668256104149 T T T 8.4290579460093831 8.7095260543694000 -5.0332668256104185 T T T 0.6601684990800650 0.5546784991986974 -9.9903087016573622 T T T 8.4290579460093795 0.5546784991986969 -9.9903087016573622 T T T 0.6601684990800644 8.7095260543694000 -5.0332668256104149 T T T 3.4677286161477254 -2.9914007691069413 -0.6579398927484469 T T T 5.6214978289417132 12.2556053226750166 -5.6149817687954284 T T T 3.4677286161477245 12.2556053226750201 -5.6149817687954267 T T T 5.6214978289417168 -2.9914007691069431 -0.6579398927484365 T T T 8.0123418386924747 1.6407015076770890 -0.6579398927484397 T T T 1.0768846063970043 7.6235030458909767 -5.6149817687954293 T T T 8.0123418386924765 7.6235030458909767 -5.6149817687954302 T T T 1.0768846063970026 1.6407015076770886 -0.6579398927484419 T T T 7.8512717576925288 8.8939585516247313 -3.9004098774078595 T T T 1.2379546873969094 0.3702460019433187 1.0566319986391186 T T T 7.8512717576925288 0.3702460019433186 1.0566319986391128 T T T 1.2379546873969109 8.8939585516247313 -3.9004098774078506 T T T 3.3066585351478150 4.2618562748407305 -3.9004098774078533 T T T 5.7825679099416254 5.0023482787273643 1.0566319986391155 T T T 3.3066585351478159 5.0023482787273643 1.0566319986391102 T T T 5.7825679099416254 4.2618562748407287 -3.9004098774078502 T T T 3.4576572686060261 3.0151824918192078 -4.2884945459136024 T T T 5.6315691764834188 6.2490220617488541 0.6685473301333552 T T T 3.4576572686060278 6.2490220617488488 0.6685473301333538 T T T 5.6315691764834179 3.0151824918192092 -4.2884945459136032 T T T 8.0022704911507621 7.6472847686032566 -4.2884945459136006 T T T 1.0869559539386895 1.6169197849648325 0.6685473301333600 T T T 8.0022704911507692 1.6169197849648271 0.6685473301333563 T T T 1.0869559539386890 7.6472847686032601 -4.2884945459135979 T T T 5.2167904017426716 11.1692487485873304 -4.9977153365516171 T T T 3.8724360433467706 -1.9050441950192374 -0.0406734605046637 T T T 5.2167904017426716 -1.9050441950192347 -0.0406734605046601 T T T 3.8724360433467706 11.1692487485873340 -4.9977153365516180 T T T 0.6721771791979440 6.5371464718032621 -4.9977153365516225 T T T 8.4170492658915084 2.7270580817648247 -0.0406734605046617 T T T 0.6721771791979451 2.7270580817648247 -0.0406734605046636 T T T 8.4170492658915013 6.5371464718032639 -4.9977153365516171 T T T