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{
"id": "jvasp-29607",
"created_at": "2022-09-04T14:38:30.270617Z",
"updated_at": "2022-09-04T14:38:30.270640Z",
"structure_string": "Cd8 I16\n1.0\n4.286524 0.000000 0.000000\n-2.143262 3.712239 -0.000000\n-0.000000 0.000000 55.033429\nCd I\n8 16\ndirect\n0.666667 0.333333 0.906223 Cd\n0.666667 0.333333 0.781266 Cd\n0.666667 0.333333 0.531238 Cd\n0.666667 0.333333 0.156236 Cd\n0.333333 0.666667 0.031238 Cd\n0.333333 0.666667 0.406223 Cd\n0.333333 0.666667 0.656236 Cd\n0.333333 0.666667 0.281266 Cd\n0.666667 0.333333 0.249766 I\n0.666667 0.333333 0.374730 I\n0.000000 0.000000 0.812778 I\n0.333333 0.666667 0.874730 I\n0.000000 0.000000 0.062765 I\n0.666667 0.333333 -0.000255 I\n0.666667 0.333333 0.624743 I\n0.333333 0.666667 0.124743 I\n0.000000 0.000000 0.312778 I\n0.000000 0.000000 0.187761 I\n0.000000 0.000000 0.562765 I\n0.000000 0.000000 0.437751 I\n0.333333 0.666667 0.499745 I\n0.333333 0.666667 0.749766 I\n0.000000 0.000000 0.937751 I\n0.000000 0.000000 0.687761 I\n",
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{
"id": "jvasp-29993",
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"structure_string": "Cd4 I8\n1.0\n4.285697 0.000000 -0.000000\n-2.142848 3.711523 0.000000\n-0.000000 0.000000 27.490042\nCd I\n4 8\ndirect\n0.000000 -0.000000 0.562491 Cd\n0.666667 0.333333 0.312448 Cd\n0.666667 0.333333 0.812473 Cd\n0.666667 0.333333 0.062532 Cd\n0.333333 0.666667 0.375556 I\n0.333333 0.666667 0.125613 I\n0.333333 0.666667 0.875556 I\n-0.000000 0.000000 -0.000530 I\n0.666667 0.333333 0.499446 I\n0.000000 -0.000000 0.749419 I\n0.333333 0.666667 0.625591 I\n0.000000 -0.000000 0.249405 I\n",
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{
"id": "jvasp-93143",
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"structure_string": "Na1 Mg6 Si1\n1.0\n6.364231 0.030546 0.000000\n-3.155662 5.465766 0.000000\n0.000000 0.000000 5.079176\nNa Mg Si\n1 6 1\ndirect\n0.166890 0.833444 0.250000 Na\n0.667780 0.336373 0.250000 Mg\n0.667780 0.831408 0.250000 Mg\n0.327964 0.171430 0.750001 Mg\n0.327964 0.656536 0.750001 Mg\n0.835876 0.167939 0.750001 Mg\n0.827371 0.663687 0.750001 Mg\n0.178378 0.339188 0.250000 Si\n",
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"elements": [
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{
"id": "jvasp-29605",
"created_at": "2022-09-04T14:38:30.677402Z",
"updated_at": "2022-09-04T14:38:30.677418Z",
"structure_string": "Cd8 I16\n1.0\n4.286489 -0.000000 -0.000000\n-2.143245 3.712209 -0.000000\n-0.000000 -0.000000 55.019231\nCd I\n8 16\ndirect\n0.000000 0.000000 0.781269 Cd\n0.000000 0.000000 0.406276 Cd\n0.000000 0.000000 0.906210 Cd\n0.666667 0.333333 0.031238 Cd\n0.666667 0.333333 0.281249 Cd\n0.000000 0.000000 0.156242 Cd\n0.666667 0.333333 0.656222 Cd\n0.000000 0.000000 0.531209 Cd\n0.666667 0.333333 0.374773 I\n0.000000 0.000000 0.624724 I\n0.333334 0.666667 0.937746 I\n0.333334 0.666667 0.312784 I\n0.666667 0.333333 0.749762 I\n0.666667 0.333333 0.874712 I\n0.333334 0.666667 0.187775 I\n0.000000 0.000000 0.249753 I\n0.333334 0.666667 0.437795 I\n0.333334 0.666667 0.062774 I\n-0.000000 -0.000000 -0.000260 I\n0.666667 0.333333 0.124744 I\n0.333334 0.666667 0.562743 I\n0.333334 0.666667 0.812789 I\n0.666667 0.333333 0.499710 I\n0.333334 0.666667 0.687758 I\n",
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{
"id": "jvasp-94086",
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"structure_string": "Mg6 Ga1 Ni1\n1.0\n6.054956 -0.139272 0.000000\n-3.148091 5.452653 0.000000\n0.000000 0.000000 4.704133\nMg Ga Ni\n6 1 1\ndirect\n0.676717 0.336150 0.250000 Mg\n0.676717 0.840566 0.250000 Mg\n0.318603 0.171839 0.750000 Mg\n0.318603 0.646763 0.750000 Mg\n0.844358 0.172178 0.750000 Mg\n0.835632 0.667816 0.750000 Mg\n0.171464 0.835731 0.250000 Ga\n0.157911 0.328955 0.250000 Ni\n",
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{
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"structure_string": "Mg6 Al1 Sb1\n1.0\n6.285063 -0.081230 0.000000\n-3.212880 5.564869 0.000000\n0.000000 0.000000 5.157326\nMg Al Sb\n6 1 1\ndirect\n0.668606 0.332507 0.250000 Mg\n0.668606 0.836097 0.250000 Mg\n0.333065 0.176393 0.750001 Mg\n0.333065 0.656675 0.750001 Mg\n0.836829 0.168416 0.750001 Mg\n0.830100 0.665051 0.750001 Mg\n0.163980 0.331991 0.250000 Al\n0.165743 0.832872 0.250000 Sb\n",
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{
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"created_at": "2022-09-04T14:37:11.917010Z",
"updated_at": "2022-09-04T14:37:11.917029Z",
"structure_string": "Zn1 Hg3\n1.0\n0.000000 3.679783 3.679783\n3.679783 0.000000 3.679783\n3.679783 3.679783 0.000000\nZn Hg\n1 3\ndirect\n0.749999 0.749999 0.749999 Zn\n0.000000 0.000000 0.000000 Hg\n0.499999 0.499999 0.499999 Hg\n0.250000 0.250000 0.250000 Hg\n",
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{
"id": "jvasp-29674",
"created_at": "2022-09-04T14:37:05.925053Z",
"updated_at": "2022-09-04T14:37:05.925079Z",
"structure_string": "Cd10 I20\n1.0\n4.287000 0.000000 -0.000000\n-2.143500 3.712651 0.000000\n-0.000000 -0.000000 68.778080\nCd I\n10 20\ndirect\n0.666667 0.333333 0.224997 Cd\n0.000000 0.000000 0.825004 Cd\n0.000000 0.000000 0.124991 Cd\n0.666667 0.333333 0.424991 Cd\n0.000000 0.000000 0.524972 Cd\n0.666667 0.333333 0.024993 Cd\n0.666667 0.333333 0.624980 Cd\n0.000000 0.000000 0.924979 Cd\n0.000000 0.000000 0.725010 Cd\n0.000000 0.000000 0.324992 Cd\n0.333333 0.666667 0.050217 I\n0.333333 0.666667 0.850218 I\n0.666667 0.333333 0.499780 I\n0.333333 0.666667 0.250221 I\n0.333333 0.666667 0.150217 I\n0.333333 0.666667 0.550198 I\n0.000000 0.000000 0.999798 I\n0.666667 0.333333 0.299797 I\n0.666667 0.333333 0.099799 I\n0.666667 0.333333 0.899784 I\n0.666667 0.333333 0.699809 I\n0.000000 0.000000 0.599787 I\n0.333333 0.666667 0.950205 I\n0.333333 0.666667 0.650208 I\n0.666667 0.333333 0.799800 I\n0.333333 0.666667 0.350217 I\n0.333333 0.666667 0.450216 I\n0.000000 0.000000 0.199802 I\n0.000000 0.000000 0.399798 I\n0.333333 0.666667 0.750226 I\n",
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{
"id": "jvasp-29614",
"created_at": "2022-09-04T14:37:59.819317Z",
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"structure_string": "Cd9 I18\n1.0\n4.286589 0.000000 0.000000\n-2.143295 3.712296 -0.000000\n-0.000000 -0.000000 61.906413\nCd I\n9 18\ndirect\n0.000000 0.000000 0.805554 Cd\n0.666668 0.333333 0.472239 Cd\n0.000000 0.000000 0.138899 Cd\n0.666668 0.333333 0.027797 Cd\n0.666668 0.333333 0.250027 Cd\n0.000000 0.000000 0.916631 Cd\n0.000000 0.000000 0.694428 Cd\n0.333334 0.666668 0.361097 Cd\n0.666668 0.333333 0.583303 Cd\n0.666668 0.333333 0.110902 I\n0.666668 0.333333 0.666423 I\n0.333334 0.666668 0.833564 I\n0.000000 0.000000 0.333081 I\n0.666668 0.333333 0.389099 I\n0.333334 0.666668 0.166921 I\n0.000000 0.000000 0.999796 I\n0.333334 0.666668 0.944655 I\n0.333334 0.666668 0.055820 I\n0.666668 0.333333 0.888631 I\n0.333334 0.666668 0.611324 I\n0.333334 0.666668 0.500243 I\n0.333334 0.666668 0.278033 I\n0.000000 0.000000 0.444219 I\n0.000000 0.000000 0.555304 I\n0.000000 0.000000 0.222024 I\n0.666668 0.333333 0.777545 I\n0.333334 0.666668 0.722441 I\n",
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{
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"structure_string": "Cd9 I18\n1.0\n4.286487 -0.000000 0.000000\n-2.143243 3.712207 -0.000000\n0.000000 -0.000000 61.918829\nCd I\n9 18\ndirect\n0.333334 0.666668 0.361083 Cd\n0.333334 0.666668 0.583312 Cd\n0.333334 0.666668 0.916661 Cd\n0.666668 0.333333 0.027805 Cd\n0.666668 0.333333 0.250021 Cd\n0.333334 0.666668 0.805587 Cd\n0.333334 0.666668 0.138893 Cd\n-0.000000 0.000000 0.472210 Cd\n-0.000000 0.000000 0.694427 Cd\n0.666668 0.333333 0.611326 I\n-0.000000 0.000000 0.333077 I\n0.666668 0.333333 0.944667 I\n0.666668 0.333333 0.389090 I\n-0.000000 0.000000 0.555317 I\n0.333334 0.666668 0.444214 I\n0.000000 -0.000000 -0.000210 I\n0.666668 0.333333 0.500225 I\n-0.000000 0.000000 0.777581 I\n0.666668 0.333333 0.833590 I\n-0.000000 0.000000 0.110877 I\n0.666668 0.333333 0.166887 I\n0.333334 0.666668 0.278016 I\n0.666668 0.333333 0.722443 I\n0.333334 0.666668 0.666431 I\n-0.000000 0.000000 0.222007 I\n0.333334 0.666668 0.055800 I\n-0.000000 0.000000 0.888659 I\n",
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{
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{
"id": "jvasp-15625",
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"structure_string": "K2 Cu1 F4\n1.0\n3.877404 -0.000000 -1.202246\n-0.372774 3.859443 -1.202246\n0.076107 0.083811 7.099152\nK Cu F\n2 1 4\ndirect\n0.355894 0.355893 0.711787 K\n0.644106 0.644106 0.288212 K\n0.000000 0.000000 0.000000 Cu\n0.155124 0.155124 0.310248 F\n0.500000 0.000000 -0.000000 F\n0.844877 0.844875 0.689750 F\n0.000000 0.500000 -0.000000 F\n",
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"formula_full": "K2 Cu1 F4",
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}