256 Lattice="19.35749289647069 0.0 0.0 0.0 19.35749289647069 0.0 0.0 0.0 19.35749289647069" Properties=species:S:1:pos:R:3:forces:R:3 energy=-271.5731243719966 stress="-0.0021007605864475586 -6.561926605304943e-05 -2.791814414333379e-05 -6.561926605304943e-05 -0.0004032738130723173 0.0005598786972182031 -2.791814414333379e-05 0.0005598786972182031 -0.003040386861827527" free_energy=-271.5731243719966 pbc="F F F" Ca 0.04624468 0.03500502 0.04885609 -0.21856780 0.11536674 -0.22263542 Cd 2.47063243 2.37922173 0.04612683 -0.08873925 0.27345369 0.01844981 Ca 2.43239046 0.04403079 2.45482833 -0.17713056 -0.37249095 0.15145895 Cd 0.04995933 2.37328149 2.47641380 0.11796562 0.32832600 0.04538029 Ca 4.84638381 0.04738277 0.00807007 0.02704758 -0.27596006 -0.84871670 Cd 7.22901447 2.43424935 0.02336133 -0.02713265 0.17198555 0.15809713 Ca 7.28573825 0.03241353 2.41182209 -0.23731221 -0.98047189 -0.20558338 Ca 4.80268279 2.40424874 2.40501522 0.01532588 1.18370945 -0.39155419 Ca 9.65404929 0.00334507 0.03822034 0.08012292 -0.17211544 -0.98862842 Cd 12.14415908 2.44245277 0.00469233 0.03724664 0.20227591 0.14262254 Ca 12.14226017 0.03579434 2.36978907 -0.07817090 -0.63140954 0.22164725 Ca 9.69508184 2.43150588 2.34439077 0.32988833 1.01937165 0.13047340 Ca 14.55174384 0.02984841 0.02904325 -0.62005024 -0.67517740 -1.03280552 Ca 16.89222603 2.43472326 0.00081053 0.67555705 0.56317927 -1.05173936 Ca 16.95152585 0.02044912 2.40134954 0.98835883 -0.57450068 0.60547097 Ca 14.56449285 2.41225987 2.42380456 -1.04154114 1.54239047 0.52799884 Cd 0.05162514 4.87913659 0.02588094 0.09131621 -0.22323641 0.07281876 Ca 2.45274283 7.20967506 0.03454835 0.50864441 -0.02260175 -0.57749422 Ca 2.37089641 4.84436019 2.38307042 0.09879060 -0.67892129 0.50597416 Ca 0.03473491 7.24221656 2.41486300 -0.58638885 -0.06530115 0.68199611 Cd 4.80351356 4.84573642 0.00442681 0.18003281 -0.12320581 0.23107658 Cd 7.28804509 7.19912247 0.00171059 -0.08736653 0.10103608 0.28747920 Cd 7.19650558 4.84452326 2.39618608 0.06969081 -0.03011761 0.05792062 Cd 4.90852292 7.17401946 2.45568435 -0.13221099 0.12505000 -0.05217355 Ca 9.63597923 4.83967041 0.00044249 -0.30717024 -0.38808988 -0.44985804 Ca 12.11665512 7.23000786 0.01731554 0.32862366 0.35292974 -0.46304286 Cd 12.06515304 4.84110323 2.44169288 0.17727386 -0.18750076 -0.02432315 Ca 9.72970697 7.25857232 2.45911939 -0.23177609 0.26803008 -0.34415118 Cd 14.53336709 4.86172263 0.02714529 -0.14901530 -0.10385671 0.19343625 Cd 16.90187094 7.27969973 0.00129046 -0.19707893 -0.02643890 0.14000881 Ca 16.98215711 4.81549885 2.41790395 0.45716033 0.40314326 0.49461107 Ca 14.54516375 7.29036381 2.38291825 -0.20082709 -0.15922880 0.33483014 Ca 0.04460234 9.69153430 0.01281164 -0.44763118 -0.15742209 -0.44885020 Ca 2.41942702 12.07620521 0.03067154 0.25659229 0.91129560 -0.56210299 Cd 2.46679442 9.71810930 2.47914467 0.00710504 -0.28497505 -0.03610993 Ca 0.01601094 12.09079928 2.41458919 -0.59428903 0.44069903 -0.15750678 Ca 4.82937725 9.63540849 0.01163778 0.02006116 -0.68685166 -0.45397173 Ca 7.27114947 12.12396908 0.04479664 0.26582550 0.26703871 -0.35416742 Ca 7.21264644 9.63729880 2.42417221 0.91323128 -0.31608761 -0.31979498 Ca 4.80309611 12.07067935 2.41481175 -0.35937362 1.23568476 0.33919203 Cd 9.70774226 9.65941512 0.02387205 -0.03613007 0.05074943 0.26242634 Cd 12.07210474 12.07521701 0.02335499 0.00377202 -0.07542399 0.24514937 Cd 12.06184568 9.63604437 2.41837656 0.08641343 0.23407643 -0.01784056 Cd 9.75354622 12.09119183 2.40961337 -0.16673186 -0.10280925 0.09558997 Cd 14.48413895 9.69998667 0.06652879 -0.08629240 0.09035497 0.04481136 Ca 16.96696682 12.12337414 0.03120718 0.59327621 -0.53627841 -0.95886415 Ca 16.91001021 9.66866248 2.44320819 0.59777678 -0.28415860 0.46664957 Ca 14.53896520 12.12258498 2.40086432 -0.77158426 -0.82479080 0.65386758 Cd 0.00176960 14.49075812 0.03805338 0.21017776 -0.02127706 0.25543377 Ca 2.38580012 16.94366938 0.03484744 -0.21677372 -0.26793913 -0.26993818 Cd 2.36281984 14.59183446 2.45190577 0.22287119 -0.18558091 0.05055253 Cd 0.01013523 16.92622742 2.39960839 0.21121983 -0.29232965 0.11050254 Cd 4.81908565 14.50977955 0.01623987 -0.02006515 -0.08584650 0.23229959 Ca 7.25517935 16.94683792 0.04148262 0.02042959 0.06939647 -0.12625569 Cd 7.22875359 14.48367770 2.40253697 -0.00851248 -0.00263294 0.24464962 Ca 4.80712822 16.97995826 2.38109258 -0.22463307 -0.35695807 0.74794399 Ca 9.68972545 14.54286516 0.03979403 0.35947435 -0.13780648 -0.19701543 Cd 12.12952092 16.89304541 0.01146135 0.01617193 -0.17322004 0.22516444 Ca 12.06575951 14.55072761 2.44515994 0.01347478 0.38248825 0.36215829 Cd 9.74161265 16.94797600 2.43882834 -0.10482069 -0.15935124 0.10473290 Ca 14.55553350 14.49054524 0.00275302 -0.63181716 0.79739288 -0.81976180 Cd 16.95808412 16.96862888 0.04590926 -0.23851319 -0.28948046 0.23987285 Ca 16.95366093 14.47261035 2.44970661 0.52645204 0.83077017 0.79983053 Cd 14.49981933 16.90674128 2.47757841 0.02111591 -0.25301865 0.03529345 Ca 0.00702607 0.03193219 4.81680508 -0.46421127 -0.23212320 -0.32052159 Cd 2.38446756 2.46250700 4.85738125 0.17060031 0.09223912 -0.05617779 Ca 2.41169427 0.01396607 7.28839715 0.63726676 -0.06806060 0.61568824 Ca 0.01431898 2.41105110 7.25560305 -0.60446373 0.57457643 0.41774290 Ca 4.84265607 0.00975272 4.84915832 -0.14172385 -0.55177148 0.67800711 Ca 7.17875251 2.40358745 4.80413381 0.14124050 0.49718365 0.58063657 Cd 7.28324986 0.00183604 7.19921385 0.01355383 0.25649744 0.17317086 Cd 4.85346356 2.41588893 7.28510040 -0.05646297 0.02531608 -0.04819368 Ca 9.65826462 0.00168092 4.80183509 0.17884720 -0.64468110 0.31592664 Cd 12.12310020 2.39481138 4.76509358 -0.03456748 0.23442282 0.11386056 Ca 12.08328332 0.01649282 7.30475173 0.42486510 -0.58733998 0.08866081 Ca 9.70578113 2.49480575 7.30397638 0.19651966 -0.14782566 0.05840098 Ca 14.51180636 0.01757327 4.79261025 -0.22380559 -0.28008614 0.50209687 Cd 16.88455190 2.39133253 4.83277697 -0.09957709 0.23027106 0.05077381 Ca 16.94952270 0.01949683 7.22182496 0.02734939 0.22128303 0.39544553 Cd 14.51057740 2.40025044 7.23982921 -0.02366830 0.15638526 -0.11757819 Cd 0.02529161 4.85750242 4.86516180 0.20930338 -0.08156667 -0.09349864 Cd 2.38446559 7.32434197 4.85573329 0.26760838 -0.05467373 -0.09759611 Ca 2.41155091 4.79414750 7.27358861 -0.06180141 -0.35935661 -0.04671239 Ca 0.05984088 7.27482215 7.26012184 -0.18345783 -0.35761302 0.00448815 Ca 4.86258357 4.88477106 4.84739232 -0.54949236 -0.15450176 -0.46022842 Ca 7.27489592 7.27850206 4.85645945 0.49712707 -0.05220971 -0.22243250 Ca 7.28033782 4.83657432 7.29876955 0.21370891 0.05967543 0.17996020 Ca 4.80521973 7.21212218 7.27769187 -1.08239972 0.63095761 -0.01696132 Ca 9.71786859 4.83671729 4.86694545 0.43574199 -0.22854476 -0.12220080 Ca 12.10950909 7.27425350 4.82006972 0.50209482 0.42462304 0.83749112 Cd 12.10763889 4.86704592 7.27119509 0.08526574 -0.01083225 -0.03394869 Cd 9.73698943 7.29837402 7.25625239 -0.09668947 0.00621232 0.04955881 Cd 14.53688087 4.86752408 4.77223148 -0.09855135 -0.15864307 0.09293231 Cd 16.95215568 7.19199632 4.86110287 -0.28472014 0.06399312 0.00595947 Cd 16.93082741 4.85040530 7.28624679 -0.18769308 -0.05989244 -0.15015512 Cd 14.57770161 7.22698061 7.26186394 -0.07405846 0.12209509 -0.06641546 Ca 0.02250420 9.71755471 4.87136125 -0.31450515 -0.53450436 -0.11574639 Ca 2.37134746 12.03367179 4.82153878 0.97906129 0.30060506 -0.28905103 Cd 2.43817104 9.65194501 7.31168410 0.22252013 0.00796645 -0.01435997 Ca 0.03297181 12.08107183 7.30028403 -0.49876140 -0.15615461 0.24147723 Ca 4.84626514 9.65631414 4.82507272 -1.24775077 -0.81206694 -0.12789533 Ca 7.24340795 12.06381036 4.86006643 0.77097368 1.22266853 -0.73198224 Ca 7.25057667 9.71545043 7.25131580 0.62528205 -0.34468000 0.12301556 Ca 4.88200923 12.08664015 7.29009707 -0.39614651 0.80860595 0.50958142 Cd 9.64865618 9.68297846 4.84045224 -0.01030028 -0.04671620 -0.05559112 Ca 12.07643108 12.06222809 4.81543148 -0.26046887 -0.34790356 -0.16112124 Cd 12.10676072 9.71845444 7.22418043 0.00546336 -0.19201237 0.01331304 Ca 9.67233127 12.07620615 7.22332278 0.12925659 0.92342952 0.08532637 Cd 14.56686704 9.68263627 4.85663380 -0.07098677 -0.00953454 0.05840493 Cd 16.94073201 12.11557621 4.81626757 -0.25700988 -0.04230505 0.12806006 Cd 16.91626918 9.69043323 7.25710750 -0.33334468 -0.04077930 -0.03755387 Ca 14.47650719 12.13992955 7.24705290 0.82117656 -0.42205435 -0.36367357 Ca 0.04743476 14.53246650 4.82731415 -0.62727878 0.81749153 -0.30798561 Cd 2.44421132 16.89515705 4.80660690 0.11663175 -0.18760434 -0.04882108 Ca 2.42655309 14.53079295 7.24400333 0.97901778 0.83071695 0.50470175 Cd 0.03727328 16.91637698 7.26206243 0.19451957 -0.17617679 0.02920422 Cd 4.86150405 14.51910728 4.86343223 -0.08892962 -0.09681387 -0.12206623 Ca 7.27959984 16.92119687 4.88246302 -0.11844240 -0.38498389 -0.33938981 Cd 7.25327267 14.45656462 7.20341747 0.09366303 0.09335678 0.15914639 Cd 4.89341124 16.93252929 7.25156402 -0.07651954 -0.30417092 0.03131808 Cd 9.71444129 14.53100576 4.77494604 -0.12989880 -0.05743857 0.08235029 Cd 12.05628230 16.90183412 4.81321995 0.02418375 -0.23704383 0.08298236 Cd 12.17493977 14.54326772 7.18764689 -0.19478993 0.01950301 -0.02477769 Ca 9.69882635 16.97921518 7.23164373 0.21244688 -0.39241898 -0.28805297 Cd 14.51992917 14.44857880 4.81017010 -0.00258848 0.18369511 0.05290070 Cd 16.96060162 16.89677679 4.81086949 -0.36379846 -0.30829564 0.04726507 Cd 16.89998098 14.59978049 7.30409425 -0.18130283 -0.03855990 -0.15387916 Cd 14.49552305 16.93170317 7.19431865 -0.01197009 -0.31163943 -0.10513592 Cd 0.02734490 0.01726531 9.67592992 0.21359690 0.21585944 0.08044015 Cd 2.42017517 2.39630619 9.64348174 0.12599473 0.06030619 0.19752766 Cd 2.39643900 0.04749003 12.04948538 0.18861341 0.21868574 -0.11491252 Ca 0.02355095 2.41171333 12.13617398 -0.02649293 0.40450377 -0.51879804 Cd 4.88619386 0.04682255 9.75579073 -0.22851612 0.23960744 -0.12664310 Ca 7.23793661 2.45751167 9.72345630 0.20691904 -0.27914085 0.23376025 Ca 7.26040060 0.01058267 12.05470139 0.49275400 -0.50823789 -0.16141453 Cd 4.86066790 2.38995392 12.07198396 -0.17929025 0.21654183 0.09096826 Cd 9.69116647 0.00331918 9.66439148 -0.11143803 0.22816812 0.01045345 Ca 12.13590073 2.41680707 9.63347785 -0.32460719 0.65278705 0.28906480 Ca 12.10382261 0.02876542 12.08095178 -0.58166352 -0.42527164 0.08312757 Cd 9.65334470 2.40267380 12.11021658 0.13151996 0.15521512 0.04740800 Cd 14.51839446 0.01839189 9.74536366 0.12889171 0.15646576 -0.08309003 Cd 16.90719291 2.47540150 9.66579619 -0.13457057 -0.12787803 -0.01964966 Cd 16.90095721 0.01624445 12.10067466 -0.24258159 0.26462466 -0.04309508 Ca 14.56464291 2.44185231 12.10513318 -0.38484771 -0.22341961 -0.15560495 Cd 0.03418040 4.90019987 9.61090841 0.18050169 -0.09751261 0.18857850 Cd 2.39438667 7.27816679 9.72446743 0.21361893 -0.07739644 -0.18702382 Ca 2.42545160 4.88560041 12.06640787 -0.23533828 -1.04897115 -0.26425977 Ca 0.02338044 7.26492597 12.10953956 -0.92740513 -0.33208551 0.02050083 Ca 4.83423756 4.80706828 9.68181277 -0.36590357 -0.61635024 0.33764521 Ca 7.21245324 7.29791528 9.65362731 0.90941942 -0.97188435 -0.03795014 Cd 7.27798565 4.86703238 12.10866828 -0.06390198 -0.04554539 -0.03295408 Ca 4.81331715 7.21393126 12.09654801 -0.05577516 0.23538973 0.07855769 Cd 9.68134934 4.85155737 9.68792546 0.02049535 0.13849657 0.10208444 Cd 12.12552789 7.29879757 9.66243687 -0.00620613 -0.04821160 -0.05903822 Cd 12.13340527 4.85903419 12.07351003 -0.17077459 -0.07411701 0.06153403 Ca 9.66834702 7.30636997 12.07637893 0.51974010 -1.03583372 -0.11893836 Ca 14.56600241 4.83674668 9.63218091 -0.27150583 0.38390657 -0.87983217 Cd 16.94811946 7.27355839 9.72419549 -0.23310124 0.08693284 -0.00292559 Ca 16.94802840 4.82027996 12.11721023 1.22688915 0.36404954 -0.30974293 Ca 14.53761674 7.23519314 12.10990091 0.12007896 0.49920363 -0.71299443 Ca 0.00005976 9.69047572 9.64891556 -0.18386051 0.34744911 0.12803179 Cd 2.41494634 12.04931871 9.70850288 0.17200065 0.14113932 -0.00950578 Ca 2.41754148 9.66434872 12.06014323 0.17974900 1.08972445 0.51982848 Cd 0.02661952 12.13464500 12.13167567 0.27087013 -0.05578744 0.03365499 Ca 4.85355191 9.66717419 9.68952951 -0.88050199 0.69247721 -0.01369508 Cd 7.25381228 12.03457131 9.65280129 0.09542717 0.15859383 0.06734415 Ca 7.29208458 9.64151732 12.07194039 -0.20520204 1.63990739 0.88315274 Cd 4.80740743 12.07473499 12.15253820 -0.00502117 -0.11001770 -0.09352785 Ca 9.70072561 9.65372775 9.65887039 0.29984103 -0.03346050 -0.53120162 Ca 12.11014305 12.05098812 9.70081002 -0.05195413 0.29714480 -0.12805476 Ca 12.08213327 9.70060103 12.09824834 0.12223601 0.29987734 -0.04475740 Cd 9.62441194 12.11016584 12.03485322 0.06048418 -0.02635643 0.08600785 Cd 14.48645671 9.72482373 9.72915722 0.11328038 -0.09774183 -0.00605533 Cd 16.97381582 12.05902468 9.76634129 -0.35520259 0.01594350 0.07074008 Cd 16.96019545 9.70633835 12.09307708 -0.31517492 -0.00000063 0.01119105 Cd 14.50669328 12.06049721 12.13319615 0.04593323 -0.04738444 -0.01303301 Ca 0.00967261 14.51149734 9.70706381 -0.06977277 -0.20140250 0.32383284 Cd 2.38920989 16.90591994 9.75071150 0.26438579 -0.19579840 -0.15619391 Cd 2.45406322 14.56739064 12.12716321 0.06539571 -0.15600046 -0.06710110 Ca 0.05319587 16.96077513 12.10052043 0.10490980 0.18377764 0.43476012 Cd 4.85265145 14.48840777 9.69600211 -0.09508113 -0.07775085 -0.03297652 Ca 7.25303602 16.95836637 9.72655718 -0.21799421 0.05174142 -0.21110838 Ca 7.27043274 14.51436280 12.09113839 0.36257148 -0.57013099 0.05075991 Cd 4.81419654 16.92423094 12.12593073 -0.11706722 -0.16332083 0.00451521 Cd 9.72783459 14.57277308 9.67433917 -0.03649386 -0.16786483 -0.07716147 Ca 12.11132292 16.95372983 9.59902233 0.06587312 0.32377251 0.16541387 Ca 12.13749217 14.50806766 12.09744192 -0.76724477 0.26894436 0.28260971 Cd 9.71977562 16.97681640 12.09755908 0.04788922 -0.24942943 0.04468874 Ca 14.53510476 14.51093642 9.66829382 0.85213694 0.17268740 0.13353058 Cd 16.91761615 16.89155910 9.67436035 -0.28106458 -0.23644853 0.04418230 Cd 16.89876389 14.55292615 12.12373236 -0.21537800 -0.04284716 -0.05062434 Cd 14.50879667 16.90380750 12.10713751 0.04243550 -0.12031250 -0.02444402 Ca 0.04704474 0.03473950 14.52668347 0.20303303 -0.27817028 0.28853992 Cd 2.45662125 2.42585911 14.58895597 0.06438458 0.18502052 -0.07091614 Cd 2.43848699 0.03391924 16.89079584 0.11314651 0.30357519 -0.17290711 Cd 0.02344226 2.37188401 16.96346248 0.31826893 0.20630920 -0.27512944 Ca 4.82051702 0.02962216 14.48145100 -0.80257252 -0.12882836 0.19569455 Ca 7.25452947 2.36086495 14.54989457 -0.09915541 0.00875030 -0.79179946 Cd 7.21991451 0.07246576 16.92644652 -0.03783172 0.08167122 -0.14971310 Cd 4.86169714 2.39509464 16.95958442 -0.04903969 0.11609808 -0.17821352 Cd 9.75161772 0.02809345 14.52252360 -0.03109688 0.17122901 -0.04486642 Cd 12.10351530 2.39189471 14.55899810 -0.08199543 0.17784690 -0.17736215 Cd 12.13010164 0.02942068 16.89198441 -0.19844842 0.19035053 -0.21873375 Ca 9.63598753 2.41574063 16.90558367 0.99183651 -0.68973507 0.69532856 Ca 14.53988668 0.03269100 14.60107631 -0.14782801 -0.97532161 -0.18001289 Ca 16.94991268 2.43410692 14.56368082 1.22581986 -0.64476627 -0.30114963 Cd 16.97146897 0.03915568 16.95837790 -0.14020178 0.19327243 -0.14543008 Ca 14.48428045 2.39433064 16.89503415 -0.79466823 0.17996281 1.06619042 Cd 0.02181334 4.87084485 14.52195086 0.22020093 -0.23098722 -0.05679533 Ca 2.39508661 7.27097573 14.56627745 0.01510401 0.39555476 0.31256996 Cd 2.44039996 4.81056651 16.96051055 0.02486266 -0.16025264 -0.23186991 Ca 0.04784708 7.18229915 16.89592550 -0.23470700 0.15964720 0.29269949 Ca 4.80397354 4.85235676 14.56276661 -0.34183147 -1.34927497 -0.19564986 Ca 7.21885620 7.24067402 14.45149091 -0.00634997 0.79684911 0.11201958 Ca 7.29630300 4.83961685 16.91029135 -0.72291999 -0.28187347 1.28779094 Ca 4.80252015 7.28892518 16.96104563 -0.14686643 0.70270931 0.77913229 Ca 9.63435546 4.80903110 14.55636721 0.93786500 -0.63903532 -1.29546333 Ca 12.08827783 7.23242523 14.56452366 -0.35801971 0.13953356 -0.02444615 Cd 12.01466269 4.83557202 16.96116996 0.18344824 -0.06721739 -0.19501536 Ca 9.64973810 7.27143113 16.89791165 0.33780613 0.91027366 0.90086394 Ca 14.49009575 4.87853439 14.51682559 -0.74573930 -0.24121552 0.02111764 Cd 16.92558141 7.24819485 14.49362885 -0.06672745 0.04398688 0.02735553 Ca 16.98095837 4.81338422 16.92094040 0.73744434 0.43346343 0.51559497 Ca 14.52406088 7.27124077 16.97738586 -0.18254488 0.21404545 0.82186581 Cd 0.03255682 9.75184727 14.56781017 0.26178495 0.04303323 -0.09036356 Cd 2.39737287 12.08042139 14.46295715 -0.00743406 -0.06243435 -0.01108205 Cd 2.43719101 9.70817262 16.90452643 -0.04935169 0.07406815 -0.23620585 Cd 0.03679370 12.12622708 16.89073301 0.24109583 -0.17381237 -0.30427398 Cd 4.76803871 9.69256063 14.55547761 0.12512674 -0.05859241 -0.21911617 Cd 7.26776053 12.10242988 14.55606221 0.09861320 -0.14543162 -0.19710698 Cd 7.24234057 9.69180218 16.94232612 0.00771653 -0.09897385 -0.35141106 Ca 4.88086877 12.05936276 16.90073412 0.29027816 -0.59776403 0.18241125 Cd 9.73114849 9.67401632 14.52138439 -0.14097416 0.02260653 -0.08425399 Ca 12.05763575 12.13000084 14.52896209 -0.49789100 -0.34305217 -0.65106447 Cd 12.08988206 9.74632775 16.91312432 0.02462014 -0.15334144 -0.18844083 Ca 9.66693381 12.05404868 16.89822123 -0.80004121 -0.21401896 0.19013128 Ca 14.56116135 9.62959370 14.54664927 0.35690682 0.07612495 -0.38571135 Ca 16.90368026 12.14823259 14.55979730 0.91780525 -0.07312370 -0.60923086 Cd 16.94985788 9.68543743 16.89003995 -0.18302119 -0.07729220 -0.18028459 Ca 14.49691412 12.11209571 16.90206014 0.24110739 -0.35222471 1.29908389 Cd 0.02293753 14.52472823 14.47876267 0.27136637 -0.07596681 -0.01349590 Cd 2.43959870 16.94384909 14.51620847 0.03627370 -0.25629902 -0.00626459 Ca 2.38874318 14.43325074 16.94519215 -0.72882105 0.03949408 -0.00894339 Cd 0.04235123 16.91398966 16.96208333 0.27263009 -0.21433330 -0.27704035 Ca 4.82745172 14.45757372 14.47602049 -0.09896091 0.10397806 -0.52471383 Cd 7.23841726 16.91283892 14.50600069 0.09709124 -0.22613035 -0.01576952 Cd 7.31025736 14.55267085 16.97037144 0.03217550 -0.02220209 -0.30104712 Ca 4.81583140 16.93995934 16.97560120 0.27859104 0.27123591 0.03445891 Cd 9.75679022 14.58649034 14.45907582 -0.10455780 -0.02237167 0.04399833 Cd 12.11111364 16.90271393 14.51473796 -0.01673160 -0.20645993 -0.04736107 Ca 12.08347289 14.52114672 16.98536084 -0.31215308 0.96744221 0.31593698 Cd 9.69024523 16.94811408 16.89807048 -0.04959104 -0.35294346 -0.30622600 Ca 14.54553085 14.52759371 14.48844215 0.42688230 1.00799941 -0.24868660 Cd 16.95997743 16.93053376 14.59853436 -0.30189488 -0.31554609 -0.03786049 Cd 16.96765211 14.58678083 16.94005558 -0.31673733 0.00063644 -0.21922498 Cd 14.52856351 16.92214032 16.97675333 -0.02409168 -0.33331040 -0.29284852