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{
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"structure_string": "Mg2 Mn3 O8\n1.0\n4.635695 0.032620 -1.387337\n-0.838543 4.983768 -2.684757\n-0.011709 -0.139906 5.843014\nMg Mn O\n2 3 8\ndirect\n0.650236 0.722764 0.445526 Mg\n0.349762 0.277237 0.554472 Mg\n0.500000 0.999999 -0.000001 Mn\n0.999998 0.739298 -0.000001 Mn\n0.999998 0.260703 -0.000001 Mn\n0.071627 0.392604 0.785207 O\n0.928372 0.607395 0.214791 O\n0.091097 0.894772 0.789542 O\n0.908903 0.105227 0.210455 O\n0.398669 0.340312 0.226843 O\n0.398669 0.886531 0.226843 O\n0.601331 0.113467 0.773155 O\n0.601331 0.659687 0.773155 O\n",
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"structure_string": "H8 C10 S2\n1.0\n4.775200 0.043379 -0.437633\n-2.527070 5.265315 -1.722247\n-0.055700 -0.246654 8.209398\nH C S\n8 10 2\ndirect\n0.690076 0.686920 0.937137 H\n0.775998 0.297841 0.191161 H\n0.192074 0.657697 0.802008 H\n0.278373 0.521463 0.447207 H\n0.689708 0.434057 0.545954 H\n0.471503 0.731689 0.094945 H\n0.278017 0.268623 0.056029 H\n0.496595 0.223851 0.898225 H\n0.370270 0.335843 0.953656 C\n0.597829 0.619699 0.039511 C\n0.107224 0.285680 0.811543 C\n0.622070 0.069928 0.564495 C\n0.860877 0.669859 0.181619 C\n0.923255 0.502997 0.243112 C\n0.771255 0.331536 0.611483 C\n0.044835 0.452537 0.750052 C\n0.196839 0.623988 0.381676 C\n0.346041 0.885595 0.428662 C\n0.144593 0.980740 0.296528 S\n0.823530 0.974792 0.696628 S\n",
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{
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"structure_string": "Be2 Fe1 Ge1\n1.0\n-1.689841 1.689841 3.587471\n1.689841 -1.689841 3.587471\n1.689841 1.689841 -3.587471\nBe Fe Ge\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.750000 0.500000 Be\n0.500000 0.500000 0.000000 Fe\n0.750000 0.250000 0.500000 Ge\n",
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{
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"structure_string": "Fe1 O2\n1.0\n2.644387 -0.034420 3.954906\n1.174875 2.369311 3.954906\n-0.056303 -0.034420 4.757194\nFe O\n1 2\ndirect\n0.500003 0.500000 0.499997 Fe\n0.761547 0.761544 0.761539 O\n0.238459 0.238457 0.238456 O\n",
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{
"id": "jvasp-14924",
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"updated_at": "2022-09-04T14:35:46.418846Z",
"structure_string": "Hf1 Co3 B2\n1.0\n2.410721 -4.175492 0.000000\n2.410721 4.175492 -0.000000\n0.000000 -0.000000 3.053256\nHf Co B\n1 3 2\ndirect\n0.000000 0.000000 0.000000 Hf\n-0.000000 0.500000 0.500001 Co\n0.500000 -0.000000 0.500001 Co\n0.500000 0.500000 0.500001 Co\n0.333333 0.666667 0.000000 B\n0.666667 0.333333 0.000000 B\n",
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{
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"structure_string": "Ni1 Ru1 O3\n1.0\n3.713863 0.000000 0.000000\n0.000000 3.713863 0.000000\n-0.000000 -0.000000 3.713863\nNi Ru O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Ni\n0.000000 0.000000 0.000000 Ru\n0.500000 0.500000 0.000000 O\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n",
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{
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"created_at": "2022-09-04T14:36:11.682211Z",
"updated_at": "2022-09-04T14:36:11.682231Z",
"structure_string": "Li2 U2 P2 H16 O20\n1.0\n6.902416 -0.000000 0.000000\n0.000000 6.902416 0.000000\n0.000000 -0.000000 9.031691\nLi U P H O\n2 2 2 16 20\ndirect\n0.750000 0.250000 0.500000 Li\n0.250000 0.750000 0.500000 Li\n0.250000 0.250000 0.104302 U\n0.750000 0.750000 0.895698 U\n0.750000 0.250000 0.000000 P\n0.250000 0.750000 0.000000 P\n0.584106 0.895692 0.385392 H\n0.424842 0.835312 0.270933 H\n0.835312 0.075158 0.270933 H\n0.075158 0.664689 0.270933 H\n0.084105 0.395692 0.614608 H\n0.604309 0.584106 0.385392 H\n0.164688 0.924842 0.729066 H\n0.104308 0.084105 0.614608 H\n0.575159 0.164688 0.729066 H\n0.924842 0.335312 0.729066 H\n0.895692 0.915895 0.385392 H\n0.664689 0.424842 0.270933 H\n0.395692 0.415895 0.614608 H\n0.915895 0.604309 0.385392 H\n0.335312 0.575159 0.729066 H\n0.415895 0.104308 0.614608 H\n0.750000 0.750000 0.693916 O\n0.250000 0.250000 0.306084 O\n0.471104 0.806931 0.372538 O\n0.078835 0.805048 0.897447 O\n0.028897 0.693070 0.372538 O\n0.578835 0.305048 0.102552 O\n0.806931 0.028897 0.372538 O\n0.693070 0.471104 0.372538 O\n0.971104 0.306931 0.627462 O\n0.421166 0.694952 0.897447 O\n0.750000 0.750000 0.097280 O\n0.528897 0.193069 0.627462 O\n0.193069 0.971104 0.627462 O\n0.305048 0.921166 0.102552 O\n0.921166 0.194952 0.102552 O\n0.250000 0.250000 0.902720 O\n0.194952 0.578835 0.102552 O\n0.694952 0.078835 0.897447 O\n0.306931 0.528897 0.627462 O\n0.805048 0.421166 0.897447 O\n",
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"formula_full": "Li2 U2 P2 H16 O20",
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{
"id": "jvasp-110146",
"created_at": "2022-09-04T14:38:45.252336Z",
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"structure_string": "Ti4 W1 C5\n1.0\n3.043740 -0.000455 12.332805\n1.498992 2.649033 12.332805\n-0.000780 -0.000455 12.702851\nTi W C\n4 1 5\ndirect\n0.099133 0.099134 0.099133 Ti\n0.699636 0.699639 0.699637 Ti\n0.300362 0.300363 0.300363 Ti\n0.900865 0.900869 0.900866 Ti\n0.499999 0.500001 0.500000 W\n0.600045 0.600048 0.600046 C\n0.399953 0.399955 0.399953 C\n0.000000 0.000000 0.000000 C\n0.200182 0.200183 0.200183 C\n0.799816 0.799819 0.799817 C\n",
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{
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"created_at": "2022-09-04T14:35:44.264300Z",
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"structure_string": "Be2 Fe1 Ru1\n1.0\n2.788641 0.000000 0.000000\n0.000000 2.788641 0.000000\n0.000000 0.000000 5.270532\nBe Fe Ru\n2 1 1\ndirect\n0.000000 0.000000 0.750739 Be\n0.000000 0.000000 0.249261 Be\n0.500000 0.500000 0.000000 Fe\n0.500000 0.500000 0.500000 Ru\n",
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{
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"structure_string": "Li2 Mn2 B2 O6\n1.0\n5.161043 -0.003019 -0.028621\n-2.539287 4.535444 0.015874\n-2.391102 -1.364656 5.267420\nLi Mn B O\n2 2 2 6\ndirect\n0.445351 0.376928 0.680356 Li\n0.554647 0.623070 0.319644 Li\n0.160716 0.747990 0.763994 Mn\n0.839282 0.252008 0.236006 Mn\n0.813763 0.075102 0.739883 B\n0.186235 0.924896 0.260116 B\n0.047997 0.311501 0.686783 O\n0.620447 0.127054 0.821647 O\n0.759997 0.787578 0.702415 O\n0.240001 0.212420 0.297584 O\n0.379551 0.872944 0.178353 O\n0.952001 0.688497 0.313216 O\n",
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"structure_string": "Mg4 Ni2 Sb2 O12\n1.0\n0.000000 5.077379 -0.135115\n7.601372 0.000000 0.000000\n0.000000 -0.182967 -5.305131\nMg Ni Sb O\n4 2 2 12\ndirect\n0.477772 0.750000 0.420642 Mg\n0.522228 0.250000 0.579359 Mg\n0.016458 0.750000 0.951730 Mg\n-0.016458 0.250000 0.048270 Mg\n0.500000 0.500000 0.000000 Ni\n0.500000 0.000000 0.000000 Ni\n-0.000000 0.500000 0.500000 Sb\n-0.000000 0.000000 0.500000 Sb\n0.317491 0.573441 0.690524 O\n0.634254 0.750000 0.066702 O\n0.682508 0.073441 0.309476 O\n0.141925 0.250000 0.430798 O\n0.188348 0.926177 0.191210 O\n0.811651 0.073823 0.808791 O\n0.188348 0.573823 0.191210 O\n0.317491 0.926559 0.690524 O\n0.858075 0.750000 0.569203 O\n0.682508 0.426559 0.309476 O\n0.811651 0.426177 0.808791 O\n0.365746 0.250000 0.933299 O\n",
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}