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{
"id": "jvasp-49897",
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"structure_string": "Ca2 Ti2 O6\n1.0\n5.321744 0.000312 0.000646\n2.660701 4.608743 0.000036\n2.660250 1.536698 5.016743\nCa Ti O\n2 2 6\ndirect\n0.636866 0.636869 0.089394 Ca\n0.363133 0.363130 0.910607 Ca\n0.850836 0.850842 0.447478 Ti\n0.149163 0.149157 0.552523 Ti\n0.564927 0.973211 0.274501 O\n0.187366 0.564914 0.274502 O\n0.026762 0.812657 0.725520 O\n0.973237 0.187342 0.274481 O\n0.812633 0.435085 0.725499 O\n0.435072 0.026788 0.725500 O\n",
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{
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"structure_string": "Ca2 Ti2 P2 O10\n1.0\n5.535560 -0.049955 0.007733\n-1.527625 5.326572 0.005198\n-1.616541 -2.132598 6.441040\nCa Ti P O\n2 2 2 10\ndirect\n0.336749 0.167788 0.757262 Ca\n0.669219 0.833352 0.259377 Ca\n0.002961 0.500567 0.508367 Ti\n0.002974 0.500538 0.008367 Ti\n0.682235 0.821873 0.758440 P\n0.323693 0.179237 0.258265 P\n0.671283 0.610038 0.872968 O\n0.894976 0.832974 0.644336 O\n0.334664 0.391072 0.143739 O\n0.110942 0.168148 0.372360 O\n0.593887 0.239892 0.422038 O\n0.264362 0.908759 0.095585 O\n0.412036 0.761237 0.594686 O\n0.741569 0.092336 0.921141 O\n0.922001 0.581170 0.258421 O\n0.083934 0.419935 0.758301 O\n",
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{
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"updated_at": "2022-09-04T14:38:48.771148Z",
"structure_string": "Ca2 Ti2 Si1 Ge1 O10\n1.0\n5.364429 -0.013955 1.342773\n-1.916062 5.010589 1.342773\n-0.012341 -0.017882 7.120537\nCa Ti Si Ge O\n2 2 1 1 10\ndirect\n0.827799 0.172200 0.500000 Ca\n0.171805 0.828195 -0.000000 Ca\n0.499202 0.504029 0.746351 Ti\n0.495971 0.500798 0.253649 Ti\n0.179831 0.820170 0.500000 Si\n0.817018 0.182981 -0.000000 Ge\n0.386150 0.812565 0.633838 O\n0.187435 0.613851 0.366162 O\n0.597249 0.181173 0.856292 O\n0.818827 0.402750 0.143708 O\n0.755239 0.868326 0.177024 O\n0.131674 0.244761 0.822976 O\n0.250708 0.120864 0.340359 O\n0.879136 0.749292 0.659640 O\n0.431998 0.568002 -0.000000 O\n0.569964 0.430036 0.500000 O\n",
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{
"id": "jvasp-9792",
"created_at": "2022-09-04T14:37:15.507391Z",
"updated_at": "2022-09-04T14:37:15.507416Z",
"structure_string": "Ca2 Ti2 Si2 O10\n1.0\n5.324764 0.003569 -1.330239\n-1.900160 4.974185 -1.330239\n-0.000728 -0.001058 7.082264\nCa Ti Si O\n2 2 2 10\ndirect\n0.170308 0.829690 0.749999 Ca\n0.829690 0.170309 0.249999 Ca\n0.499999 0.499999 0.499999 Ti\n0.500000 0.500000 -0.000000 Ti\n0.181120 0.818879 0.249999 Si\n0.818879 0.181120 0.749999 Si\n0.184971 0.609541 0.382913 O\n0.390458 0.815028 0.117086 O\n0.815027 0.390458 0.617086 O\n0.609541 0.184971 0.882913 O\n0.879585 0.750559 0.087968 O\n0.249440 0.120414 0.412030 O\n0.429227 0.570772 0.749999 O\n0.570772 0.429227 0.249999 O\n0.750559 0.879585 0.587968 O\n0.120414 0.249440 0.912030 O\n",
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"formula_full": "Ca2 Ti2 Si2 O10",
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{
"id": "jvasp-21296",
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"updated_at": "2022-09-04T14:37:00.408838Z",
"structure_string": "Ca2 Ti2 Si4 O12\n1.0\n5.029304 -0.071578 0.959845\n1.073100 6.645075 0.771951\n-0.163521 0.195257 6.770496\nCa Ti Si O\n2 2 4 12\ndirect\n0.750000 0.301366 0.698635 Ca\n0.250001 0.698633 0.301368 Ca\n0.249999 0.070716 0.929286 Ti\n0.749999 0.929285 0.070715 Ti\n0.272637 0.195233 0.392709 Si\n0.227362 0.607292 0.804768 Si\n0.772637 0.392708 0.195234 Si\n0.727363 0.804767 0.607293 Si\n0.653179 0.966071 0.771148 O\n0.846821 0.228852 0.033929 O\n0.672249 0.623070 0.117513 O\n0.827749 0.882488 0.376930 O\n0.327750 0.376928 0.882488 O\n0.972274 0.618776 0.673956 O\n0.027725 0.381223 0.326046 O\n0.472275 0.673954 0.618779 O\n0.346820 0.033929 0.228853 O\n0.527725 0.326046 0.381223 O\n0.172250 0.117511 0.623072 O\n0.153180 0.771148 0.966072 O\n",
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"formula_full": "Ca2 Ti2 Si4 O12",
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{
"id": "jvasp-9459",
"created_at": "2022-09-04T14:38:06.315525Z",
"updated_at": "2022-09-04T14:38:06.315553Z",
"structure_string": "Ca2 Ti3 O8\n1.0\n4.845335 -0.011687 -1.535062\n-0.894743 5.317786 -2.864692\n-0.040130 -0.082863 6.366546\nCa Ti O\n2 3 8\ndirect\n0.661873 0.725511 0.451020 Ca\n0.338126 0.274491 0.548981 Ca\n0.500000 1.000000 0.000001 Ti\n0.999998 0.733976 0.000000 Ti\n0.999998 0.266024 -0.000000 Ti\n0.047898 0.395640 0.791280 O\n0.952102 0.604360 0.208722 O\n0.093983 0.899987 0.799974 O\n0.906017 0.100013 0.200027 O\n0.394094 0.324806 0.208577 O\n0.394095 0.883770 0.208578 O\n0.605906 0.116230 0.791424 O\n0.605906 0.675194 0.791424 O\n",
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{
"id": "jvasp-11013",
"created_at": "2022-09-04T14:37:18.425825Z",
"updated_at": "2022-09-04T14:37:18.425851Z",
"structure_string": "Ca2 Ti4 O10\n1.0\n3.632584 0.000000 0.000000\n0.000000 4.897615 0.000000\n0.000000 0.000000 11.653018\nCa Ti O\n2 4 10\ndirect\n0.000000 0.144200 0.000000 Ca\n0.500000 0.855801 0.500000 Ca\n0.500000 0.611495 0.847313 Ti\n0.000000 0.388506 0.652687 Ti\n0.000000 0.388506 0.347313 Ti\n0.500000 0.611495 0.152687 Ti\n0.000000 0.531437 0.500000 O\n0.500000 0.468564 0.000000 O\n0.000000 0.470922 0.826191 O\n0.500000 0.529079 0.673809 O\n0.000000 0.470922 0.173809 O\n0.500000 0.529079 0.326191 O\n0.500000 0.957932 0.123927 O\n0.000000 0.042069 0.376073 O\n0.000000 0.042069 0.623927 O\n0.500000 0.957932 0.876073 O\n",
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{
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"structure_string": "Ca2 Ti4 O10\n1.0\n3.787768 0.000000 -0.000000\n-1.893883 5.528900 -0.000000\n-0.000000 -0.000000 11.503322\nCa Ti O\n2 4 10\ndirect\n0.903331 0.806656 0.750000 Ca\n0.096672 0.193344 0.250000 Ca\n0.205531 0.411063 0.596940 Ti\n0.794471 0.588938 0.403059 Ti\n0.794471 0.588938 0.096941 Ti\n0.205531 0.411063 0.903059 Ti\n0.713970 0.427939 0.250000 O\n0.286032 0.572062 0.750000 O\n0.238409 0.476816 0.076028 O\n0.761595 0.523185 0.923971 O\n0.761595 0.523185 0.576028 O\n0.238409 0.476816 0.423971 O\n0.054173 0.108344 0.619485 O\n0.945829 0.891655 0.380515 O\n0.054173 0.108344 0.880515 O\n0.945829 0.891655 0.119486 O\n",
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{
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"structure_string": "Ca2 Ti4 O8\n1.0\n3.039531 0.001562 0.001805\n1.515593 7.200919 0.072620\n1.514649 1.179974 7.584060\nCa Ti O\n2 4 8\ndirect\n0.348826 0.151685 0.143229 Ca\n0.637811 0.884600 0.832391 Ca\n0.631679 0.563961 0.165308 Ti\n0.133070 0.212769 0.513704 Ti\n0.853591 0.823501 0.461915 Ti\n0.354975 0.472314 0.810305 Ti\n0.852107 0.617601 0.670777 O\n0.458586 0.778061 0.297367 O\n0.528073 0.258215 0.678252 O\n0.134535 0.418675 0.304847 O\n0.163345 0.676115 0.989813 O\n0.762822 0.101982 0.364968 O\n0.823323 0.360157 0.985796 O\n0.223841 0.934287 0.610652 O\n",
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"structure_string": "Ca2 Ti4 O8\n1.0\n3.067832 0.000000 0.000000\n-1.533916 4.897884 -0.000000\n0.000000 0.000000 10.117053\nCa Ti O\n2 4 8\ndirect\n0.379701 0.759404 0.750000 Ca\n0.620296 0.240595 0.250000 Ca\n0.875615 0.751233 0.064999 Ti\n0.124382 0.248766 0.935001 Ti\n0.875615 0.751233 0.435001 Ti\n0.124382 0.248766 0.564999 Ti\n0.232514 0.465029 0.392850 O\n0.767484 0.534970 0.607150 O\n0.767484 0.534970 0.892850 O\n0.232514 0.465029 0.107150 O\n0.939087 0.878179 0.250000 O\n0.060910 0.121820 0.750000 O\n0.500000 0.000000 0.000000 O\n0.500000 0.000000 0.500000 O\n",
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{
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"structure_string": "Ca2 Ti4 O8\n1.0\n3.067881 0.000000 0.000000\n-1.533941 4.897937 0.000000\n0.000000 0.000000 10.117342\nCa Ti O\n2 4 8\ndirect\n0.379699 0.759399 0.750000 Ca\n0.620301 0.240602 0.250000 Ca\n0.875616 0.751233 0.064999 Ti\n0.124384 0.248768 0.935001 Ti\n0.875616 0.751233 0.435001 Ti\n0.124384 0.248768 0.564999 Ti\n0.232513 0.465027 0.392850 O\n0.767487 0.534974 0.607149 O\n0.767487 0.534974 0.892850 O\n0.232513 0.465027 0.107150 O\n0.939089 0.878180 0.250000 O\n0.060911 0.121821 0.750000 O\n0.500000 0.000000 0.000000 O\n0.500000 0.000000 0.500000 O\n",
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{
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}