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{
"id": "jvasp-20757",
"created_at": "2022-09-04T14:38:33.753192Z",
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"structure_string": "Na2 B30\n1.0\n5.344620 -0.000000 2.349816\n2.147399 6.525366 2.368811\n-0.005933 -0.022016 7.266530\nNa B\n2 30\ndirect\n0.750000 0.912557 0.587444 Na\n0.250000 0.087443 0.412557 Na\n0.665970 0.546206 0.616917 B\n0.829092 0.453794 0.383083 B\n0.834031 0.883083 0.953794 B\n0.670908 0.116917 0.046206 B\n0.334031 0.453794 0.383083 B\n0.170908 0.546206 0.616917 B\n0.165970 0.116917 0.046206 B\n0.329093 0.883083 0.953794 B\n0.613912 0.712460 0.381153 B\n0.707525 0.287540 0.618848 B\n0.886089 0.118847 0.787541 B\n0.792475 0.881153 0.212460 B\n0.386088 0.287540 0.618847 B\n0.292476 0.712460 0.381153 B\n0.250000 0.494356 0.005645 B\n0.645665 0.750880 0.957791 B\n0.354335 0.249120 0.042209 B\n0.854336 0.542209 0.749120 B\n0.145664 0.457791 0.250880 B\n0.664786 0.286885 0.383545 B\n0.335215 0.713115 0.616455 B\n0.835215 0.116455 0.213115 B\n0.164786 0.883545 0.786885 B\n0.603042 0.547812 0.246104 B\n0.396959 0.452188 0.753896 B\n0.896959 0.253895 0.952189 B\n0.103042 0.746105 0.047811 B\n0.750001 0.505644 0.994356 B\n0.207525 0.118847 0.787540 B\n0.113912 0.881153 0.212460 B\n",
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"structure_string": "Li4 Mn2 Si4 O12\n1.0\n-1.773814 1.582198 4.543495\n-7.532286 -0.360497 0.185043\n0.499184 -7.524367 -0.185044\nLi Mn Si O\n4 2 4 12\ndirect\n0.496756 0.795957 0.584946 Li\n0.250000 0.794785 0.794784 Li\n0.003246 0.584947 0.795958 Li\n0.750001 0.221340 0.221341 Li\n0.750001 0.960680 0.960680 Mn\n0.250000 0.184274 0.184274 Mn\n0.858210 0.777501 0.368567 Si\n0.353054 0.616120 0.198899 Si\n0.641791 0.368566 0.777501 Si\n0.146947 0.198899 0.616120 Si\n0.832807 0.217570 0.978015 O\n0.295112 0.363124 0.702477 O\n0.374194 0.400929 0.166419 O\n0.808319 0.276807 0.625440 O\n0.204889 0.702477 0.363124 O\n0.667194 0.978015 0.217570 O\n0.691682 0.625440 0.276807 O\n0.138648 0.752208 -0.003753 O\n0.878207 0.792528 0.585826 O\n0.125806 0.166419 0.400929 O\n0.621795 0.585825 0.792528 O\n0.361352 -0.003753 0.752207 O\n",
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{
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"structure_string": "Ba4 Ti1 Tl1\n1.0\n0.000000 5.024387 5.024387\n5.024387 0.000000 5.024387\n5.024387 5.024387 0.000000\nBa Ti Tl\n4 1 1\ndirect\n0.124352 0.625217 0.625217 Ba\n0.625217 0.625217 0.625217 Ba\n0.625217 0.124352 0.625217 Ba\n0.625217 0.625217 0.124352 Ba\n0.250000 0.250000 0.250000 Ti\n0.000000 0.000000 0.000000 Tl\n",
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{
"id": "jvasp-112793",
"created_at": "2022-09-04T14:38:43.768623Z",
"updated_at": "2022-09-04T14:38:43.768647Z",
"structure_string": "Ca6 Mn2 Co2 O12\n1.0\n6.319990 -0.016608 -0.231706\n-0.246115 6.348508 -0.236927\n-0.016924 -0.017507 6.323961\nCa Mn Co O\n6 2 2 12\ndirect\n0.884778 0.249954 0.615200 Ca\n0.612603 0.887735 0.246429 Ca\n0.253630 0.612276 0.887408 Ca\n0.115202 0.750021 0.384783 Ca\n0.387427 0.112259 0.753595 Ca\n0.746396 0.387711 0.112614 Ca\n0.499958 0.500024 0.500011 Mn\n0.000013 0.000028 0.999964 Mn\n0.756860 0.749880 0.743277 Co\n0.243228 0.249992 0.256796 Co\n0.911136 0.713023 0.042279 O\n0.209627 0.417892 0.544214 O\n0.418536 0.549480 0.213419 O\n0.542317 0.213056 0.411146 O\n0.581416 0.450490 0.786606 O\n0.955756 0.082142 0.290317 O\n0.790328 0.582197 0.455826 O\n0.088837 0.286979 0.957695 O\n0.286585 0.950521 0.081477 O\n0.044280 0.917951 0.709635 O\n0.457661 0.786949 0.588836 O\n0.713444 0.049455 0.918478 O\n",
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"structure_string": "Al4 Cr2 S8\n1.0\n6.130676 0.034988 3.593646\n2.076546 5.768395 3.593646\n-0.000000 -0.000000 7.187295\nAl Cr S\n4 2 8\ndirect\n0.991244 0.991242 0.008758 Al\n0.258758 0.258758 0.241242 Al\n0.625001 0.625000 0.125000 Al\n0.625001 0.625000 0.625000 Al\n0.125001 0.625000 0.625000 Cr\n0.625001 0.125000 0.625000 Cr\n0.385074 0.385073 0.379416 S\n0.385074 0.385073 0.850437 S\n0.382561 0.856355 0.380542 S\n0.856357 0.382560 0.380542 S\n0.393645 0.867439 0.869458 S\n0.867441 0.393644 0.869458 S\n0.864928 0.864926 0.399563 S\n0.864928 0.864926 0.870584 S\n",
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{
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"created_at": "2022-09-04T14:37:10.522372Z",
"updated_at": "2022-09-04T14:37:10.522394Z",
"structure_string": "Sr4 Ca1 Mn2 S2 O6\n1.0\n3.880405 -0.000000 -0.000000\n0.000000 3.880405 -0.000000\n-0.000000 -0.000000 16.845178\nSr Ca Mn S O\n4 1 2 2 6\ndirect\n0.000000 0.499999 0.796788 Sr\n0.499999 0.000000 0.203212 Sr\n0.000000 0.499999 0.581134 Sr\n0.499999 0.000000 0.418867 Sr\n0.499999 0.499999 0.000000 Ca\n0.499999 0.000000 0.682274 Mn\n0.000000 0.499999 0.317726 Mn\n0.499999 0.000000 0.888341 S\n0.000000 0.499999 0.111659 S\n0.000000 0.000000 0.698446 O\n0.499999 0.499999 0.698625 O\n0.499999 0.499999 0.301375 O\n0.000000 0.000000 0.301554 O\n0.499999 0.000000 0.565313 O\n0.000000 0.499999 0.434687 O\n",
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{
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"updated_at": "2022-09-04T14:37:44.695241Z",
"structure_string": "Mo2 W1 Se4 S2\n1.0\n3.278249 0.000000 0.000000\n-1.639124 2.839041 0.000000\n-0.000000 0.000000 27.252913\nMo W Se S\n2 1 4 2\ndirect\n0.333324 0.666647 0.111610 Mo\n0.333324 0.666647 0.582355 Mo\n0.666668 0.333335 0.346982 W\n0.666658 0.333315 0.049636 Se\n0.666660 0.333318 0.520322 Se\n0.666660 0.333318 0.173643 Se\n0.666658 0.333315 0.644328 Se\n0.333327 0.666653 0.403744 S\n0.333327 0.666653 0.290221 S\n",
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{
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"created_at": "2022-09-04T14:38:48.346018Z",
"updated_at": "2022-09-04T14:38:48.346038Z",
"structure_string": "Nd2 Fe15 Co2 H3\n1.0\n6.328654 0.010050 0.693674\n0.622885 6.297934 0.693674\n0.011075 0.010050 6.366547\nNd Fe Co H\n2 15 2 3\ndirect\n0.654788 0.654789 0.654789 Nd\n0.345210 0.345210 0.345210 Nd\n0.662457 0.149932 0.662458 Fe\n0.149931 0.662458 0.662458 Fe\n0.662457 0.662458 0.149931 Fe\n0.337541 0.850067 0.337541 Fe\n0.850067 0.337542 0.337541 Fe\n0.337541 0.337542 0.850068 Fe\n0.717186 0.000000 0.282813 Fe\n0.282813 0.717186 -0.000001 Fe\n0.282813 0.000000 0.717187 Fe\n-0.000001 0.717186 0.282813 Fe\n0.717186 0.282813 -0.000001 Fe\n-0.000000 0.500000 -0.000000 Fe\n0.500000 0.000000 -0.000000 Fe\n-0.000000 0.000000 0.500000 Fe\n-0.000001 0.282813 0.717187 Fe\n0.905266 0.905268 0.905268 Co\n0.094731 0.094732 0.094732 Co\n-0.000001 0.500000 0.500000 H\n0.499999 0.500000 -0.000001 H\n0.499999 0.000000 0.500000 H\n",
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{
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"structure_string": "Nb4 Te6\n1.0\n3.639925 0.000006 0.753199\n1.563643 7.535439 1.615340\n-0.024792 0.306659 9.291726\nNb Te\n4 6\ndirect\n0.668060 0.547630 0.116242 Nb\n0.331940 0.452371 0.883758 Nb\n0.756105 0.113548 0.374242 Nb\n0.243895 0.886453 0.625759 Nb\n0.410547 0.856037 0.322864 Te\n0.872591 0.212032 0.042797 Te\n0.123446 0.404464 0.348644 Te\n0.876555 0.595537 0.651356 Te\n0.589454 0.143964 0.677136 Te\n0.127409 0.787969 0.957203 Te\n",
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{
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"updated_at": "2022-09-04T14:38:11.803879Z",
"structure_string": "Li4 V2 Co6 O16\n1.0\n2.837255 -4.914270 0.000000\n2.837255 4.914270 0.000000\n0.000000 -0.000000 9.091467\nLi V Co O\n4 2 6 16\ndirect\n0.333332 0.666666 0.894163 Li\n0.000000 0.000000 0.998949 Li\n0.000000 0.000000 0.498949 Li\n0.666666 0.333332 0.394163 Li\n0.333332 0.666666 0.498997 V\n0.666666 0.333332 -0.001003 V\n0.829896 0.659793 0.714408 Co\n0.340205 0.170102 0.714408 Co\n0.829896 0.170102 0.714408 Co\n0.659793 0.829896 0.214408 Co\n0.170102 0.340205 0.214408 Co\n0.170102 0.829896 0.214408 Co\n0.829808 0.170191 0.096374 O\n0.340381 0.170191 0.096374 O\n0.666666 0.333332 0.607733 O\n0.957731 0.478865 0.837745 O\n0.521133 0.042267 0.837745 O\n0.170191 0.829808 0.596374 O\n0.478865 0.957731 0.337745 O\n0.478865 0.521133 0.337745 O\n0.659617 0.829807 0.596374 O\n0.000000 0.000000 0.808494 O\n0.000000 0.000000 0.308494 O\n0.333332 0.666666 0.107732 O\n0.521133 0.478865 0.837745 O\n0.170191 0.340381 0.596374 O\n0.042267 0.521133 0.337745 O\n0.829807 0.659617 0.096374 O\n",
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{
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{
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"created_at": "2022-09-04T14:37:32.620117Z",
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"structure_string": "Yb4 Ga4 Ge4\n1.0\n2.108019 -3.651195 -0.000000\n2.108019 3.651195 0.000000\n-0.000000 0.000000 16.469226\nYb Ga Ge\n4 4 4\ndirect\n0.000000 0.000000 0.250000 Yb\n0.000000 0.000000 0.750000 Yb\n0.000000 0.000000 0.500000 Yb\n0.000000 0.000000 0.000000 Yb\n0.333334 0.666667 0.158164 Ga\n0.333334 0.666667 0.341837 Ga\n0.666667 0.333334 0.841837 Ga\n0.666667 0.333334 0.658164 Ga\n0.333334 0.666667 0.890786 Ge\n0.333334 0.666667 0.609215 Ge\n0.666667 0.333334 0.109215 Ge\n0.666667 0.333334 0.390785 Ge\n",
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]
}