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{
"id": "jvasp-86792",
"created_at": "2022-09-04T14:35:55.811451Z",
"updated_at": "2022-09-04T14:35:55.811470Z",
"structure_string": "Na4 Be2 H8\n1.0\n4.981859 0.000000 0.000000\n0.000000 4.962339 -0.853129\n0.000000 -0.168021 6.688549\nNa Be H\n4 2 8\ndirect\n0.250000 0.722742 0.028864 Na\n0.750000 0.277259 0.971136 Na\n0.750000 0.248085 0.463058 Na\n0.250000 0.751916 0.536942 Na\n0.250000 0.280108 0.217946 Be\n0.750000 0.719892 0.782055 Be\n0.750000 0.930887 0.660984 H\n0.750000 0.825748 0.998726 H\n0.520262 0.545960 0.735797 H\n0.250000 0.069114 0.339016 H\n0.979738 0.545960 0.735797 H\n0.020262 0.454040 0.264203 H\n0.479738 0.454040 0.264203 H\n0.250000 0.174252 0.001274 H\n",
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{
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"updated_at": "2022-09-04T14:36:06.662077Z",
"structure_string": "Sr4 Li2 Co2 N4\n1.0\n5.367150 0.000000 0.000000\n0.000000 5.367150 0.000000\n0.000000 0.000000 7.345524\nSr Li Co N\n4 2 2 4\ndirect\n0.000000 0.500000 0.750000 Sr\n0.000000 0.500000 0.250000 Sr\n0.500000 0.000000 0.250000 Sr\n0.500000 0.000000 0.750000 Sr\n0.000000 0.000000 0.500000 Li\n0.500000 0.500000 0.000000 Li\n0.500000 0.500000 0.500000 Co\n0.000000 0.000000 0.000000 Co\n0.737870 0.737870 0.500000 N\n0.762129 0.237870 0.000000 N\n0.262130 0.262130 0.500000 N\n0.237870 0.762129 0.000000 N\n",
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"formula_full": "Sr4 Li2 Co2 N4",
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"formula_anonymous": "ABC2D2",
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"spacegroup": 136
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{
"id": "jvasp-86797",
"created_at": "2022-09-04T14:36:11.447594Z",
"updated_at": "2022-09-04T14:36:11.447604Z",
"structure_string": "Pd2 Cl4\n1.0\n3.413241 0.000000 0.000000\n0.000000 3.695189 0.000000\n0.000000 -0.000000 10.991946\nPd Cl\n2 4\ndirect\n0.500000 0.000000 0.000000 Pd\n0.000000 0.500000 0.500000 Pd\n0.000000 0.856994 0.863741 Cl\n0.500000 0.356994 0.636260 Cl\n0.000000 0.143006 0.136259 Cl\n0.500000 0.643006 0.363741 Cl\n",
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{
"id": "jvasp-86798",
"created_at": "2022-09-04T14:36:15.972499Z",
"updated_at": "2022-09-04T14:36:15.972515Z",
"structure_string": "Ho1 Si2 Au2\n1.0\n4.014408 -0.000000 -1.546290\n-0.595608 3.969978 -1.546290\n-0.036778 -0.042708 5.888674\nHo Si Au\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ho\n0.386331 0.386331 0.772664 Si\n0.613668 0.613669 0.227336 Si\n0.750000 0.250000 0.500000 Au\n0.250000 0.750000 0.500000 Au\n",
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{
"id": "jvasp-86799",
"created_at": "2022-09-04T14:35:41.489923Z",
"updated_at": "2022-09-04T14:35:41.489950Z",
"structure_string": "Mg3 Bi2\n1.0\n4.691333 -0.000000 0.000000\n-2.345666 4.062814 -0.000000\n-0.000000 0.000000 7.463808\nMg Bi\n3 2\ndirect\n0.333332 0.666666 0.627203 Mg\n0.000000 0.000000 0.000000 Mg\n0.666666 0.333333 0.372797 Mg\n0.333332 0.666666 0.221261 Bi\n0.666666 0.333333 0.778739 Bi\n",
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"formula_full": "Mg3 Bi2",
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{
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"created_at": "2022-09-04T14:37:12.441760Z",
"updated_at": "2022-09-04T14:37:12.441780Z",
"structure_string": "Li5 N1 Cl2\n1.0\n3.568389 0.011218 9.031845\n1.728666 3.121737 9.031845\n0.018967 0.011218 9.711193\nLi N Cl\n5 1 2\ndirect\n0.500001 0.500001 0.499999 Li\n0.933277 0.933278 0.933274 Li\n0.066724 0.066724 0.066724 Li\n0.674448 0.674448 0.674445 Li\n0.325554 0.325554 0.325552 Li\n0.000000 0.000000 0.000000 N\n0.218357 0.218358 0.218357 Cl\n0.781644 0.781645 0.781641 Cl\n",
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"formula_full": "Li5 N1 Cl2",
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"formula_anonymous": "AB2C5",
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{
"id": "jvasp-86801",
"created_at": "2022-09-04T14:35:45.511911Z",
"updated_at": "2022-09-04T14:35:45.511936Z",
"structure_string": "Mg6 B6 Ir6\n1.0\n5.298401 0.000000 0.000000\n-2.649201 4.588550 -0.000000\n0.000000 -0.000000 9.514566\nMg B Ir\n6 6 6\ndirect\n0.000000 0.500000 0.666667 Mg\n0.000000 0.000000 0.833333 Mg\n0.000000 0.000000 0.500000 Mg\n0.000000 0.000000 0.166667 Mg\n0.500000 0.500000 0.333333 Mg\n0.500000 -0.000000 0.000000 Mg\n0.397711 0.795422 0.500000 B\n0.397711 0.602289 0.833333 B\n0.795422 0.397711 0.166667 B\n0.602289 0.397711 0.833333 B\n0.602289 0.204578 0.500000 B\n0.204578 0.602289 0.166667 B\n0.500000 0.500000 0.045537 Ir\n0.500000 -0.000000 0.712204 Ir\n0.500000 0.500000 0.621129 Ir\n0.500000 -0.000000 0.287796 Ir\n0.000000 0.500000 0.378871 Ir\n0.000000 0.500000 0.954464 Ir\n",
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"density": 9.791597561558195,
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"formula_full": "Mg6 B6 Ir6",
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{
"id": "jvasp-86802",
"created_at": "2022-09-04T14:35:56.056399Z",
"updated_at": "2022-09-04T14:35:56.056425Z",
"structure_string": "Mg4 H8\n1.0\n4.810998 0.000000 0.000000\n0.000000 4.810442 0.000000\n0.000000 0.000000 4.810243\nMg H\n4 8\ndirect\n0.750005 0.712779 -0.000002 Mg\n0.249996 0.712779 0.499998 Mg\n0.750005 0.212779 0.500001 Mg\n0.249996 0.212779 0.000002 Mg\n0.595527 0.058309 0.154457 H\n0.095505 0.367312 0.345507 H\n0.595527 0.558309 0.345542 H\n0.904496 0.867312 0.654492 H\n0.095505 0.867312 0.154493 H\n0.404474 0.558309 0.845542 H\n0.404474 0.058309 0.654457 H\n0.904496 0.367312 0.845507 H\n",
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{
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"created_at": "2022-09-04T14:36:01.585130Z",
"updated_at": "2022-09-04T14:36:01.585140Z",
"structure_string": "Tb10 Sb2 Au4\n1.0\n6.553414 -0.000000 -3.386786\n-1.750281 6.315358 -3.386786\n0.994106 1.307090 9.957395\nTb Sb Au\n10 2 4\ndirect\n0.996967 0.496967 0.667467 Tb\n0.003034 0.503034 0.332532 Tb\n0.503034 0.329499 0.332531 Tb\n0.829498 0.003034 0.332531 Tb\n0.496967 0.670502 0.667468 Tb\n0.670502 0.170502 0.667468 Tb\n0.170502 0.996967 0.667468 Tb\n0.000000 0.000000 0.000000 Tb\n0.500000 0.500000 -0.000000 Tb\n0.329499 0.829499 0.332531 Tb\n0.750000 0.750000 0.499999 Sb\n0.250000 0.250000 0.500000 Sb\n0.127847 0.627847 -0.000000 Au\n0.372153 0.127847 -0.000000 Au\n0.627847 0.872153 -0.000001 Au\n0.872153 0.372153 -0.000001 Au\n",
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{
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"created_at": "2022-09-04T14:36:05.867801Z",
"updated_at": "2022-09-04T14:36:05.867830Z",
"structure_string": "Sm1 Sb12 Os4\n1.0\n7.709559 -0.000000 -2.725741\n-3.854780 6.676674 -2.725741\n-0.000000 -0.000000 8.177222\nSm Sb Os\n1 12 4\ndirect\n0.000000 0.000000 0.000000 Sm\n0.844035 0.181999 0.337963 Sb\n0.155965 0.818000 0.662037 Sb\n0.844035 0.506072 0.662037 Sb\n0.662037 0.155965 0.818001 Sb\n0.337963 0.155965 0.493928 Sb\n0.155965 0.493927 0.337963 Sb\n0.506072 0.662037 0.844035 Sb\n0.493928 0.337963 0.155965 Sb\n0.181999 0.337963 0.844035 Sb\n0.662037 0.844035 0.506072 Sb\n0.337963 0.844035 0.181999 Sb\n0.818001 0.662037 0.155965 Sb\n-0.000000 0.500000 -0.000000 Os\n0.500000 0.500000 0.500000 Os\n0.000000 0.000000 0.500000 Os\n0.500000 0.000000 0.000000 Os\n",
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"created_at": "2022-09-04T14:36:17.601771Z",
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"structure_string": "H6 Au2 C4 N2 Cl2\n1.0\n4.033339 0.000000 -0.234807\n0.000000 6.187904 0.000000\n0.007253 0.000000 9.058915\nH Au C N Cl\n6 2 4 2 2\ndirect\n0.718625 0.560900 0.126745 H\n0.363893 0.706597 0.049848 H\n0.281795 0.352798 0.873335 H\n0.281375 0.060901 0.873255 H\n0.636107 0.206597 0.950152 H\n0.718205 0.852797 0.126665 H\n0.138933 0.706757 0.584916 Au\n0.861067 0.206758 0.415084 Au\n0.677090 0.206757 0.605934 C\n0.322909 0.706757 0.394066 C\n0.434616 0.206763 0.863073 C\n0.565383 0.706763 0.136927 C\n0.430056 0.706756 0.277481 N\n0.569943 0.206756 0.722519 N\n0.079239 0.206760 0.186961 Cl\n0.920760 0.706759 0.813039 Cl\n",
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"formula_full": "H6 Au2 C4 N2 Cl2",
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}