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{
"id": "jvasp-47032",
"created_at": "2022-09-04T14:38:05.206028Z",
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{
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"created_at": "2022-09-04T14:36:53.204146Z",
"updated_at": "2022-09-04T14:36:53.204174Z",
"structure_string": "Sn2 B8 O14\n1.0\n4.257455 0.000000 0.000000\n0.000000 4.469997 0.000000\n0.000000 0.000000 10.917129\nSn B O\n2 8 14\ndirect\n0.594967 0.825715 0.500000 Sn\n0.094967 0.174285 0.000000 Sn\n0.556228 0.672509 0.122189 B\n0.028089 0.823617 0.751150 B\n0.528089 0.176383 0.748850 B\n0.056227 0.327492 0.377811 B\n0.056227 0.327492 0.622189 B\n0.556228 0.672509 0.877811 B\n0.028089 0.823617 0.248850 B\n0.528089 0.176383 0.251150 B\n0.387368 0.271494 0.362487 O\n0.887369 0.728507 0.137513 O\n0.478139 0.359199 0.856695 O\n0.978139 0.640801 0.643306 O\n0.978139 0.640801 0.356695 O\n0.478139 0.359199 0.143305 O\n0.447862 0.768111 0.000000 O\n0.882145 0.129165 0.719370 O\n0.882145 0.129165 0.280630 O\n0.382145 0.870835 0.219370 O\n0.387368 0.271494 0.637513 O\n0.947862 0.231890 0.500000 O\n0.382145 0.870835 0.780630 O\n0.887369 0.728507 0.862487 O\n",
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{
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"structure_string": "Ti1 H16 C9 O4\n1.0\n4.706888 -0.071241 -0.974972\n-1.248160 7.130635 0.100103\n-0.130413 0.227777 7.780105\nTi H C O\n1 16 9 4\ndirect\n0.817750 0.266369 0.245368 Ti\n0.861760 0.406964 0.823676 H\n0.112391 0.345599 0.708449 H\n0.198413 0.723074 0.896799 H\n0.027353 0.681446 0.674100 H\n0.614472 0.593635 0.285006 H\n0.665754 0.718569 0.842456 H\n0.525973 0.562338 0.663907 H\n-0.034022 0.576984 0.418103 H\n0.333583 0.802439 0.471118 H\n0.709305 0.874248 0.550888 H\n0.325217 -0.004955 0.110237 H\n0.643133 0.107130 0.742838 H\n0.269437 0.009565 0.726423 H\n0.629764 0.903322 0.239699 H\n0.930532 0.644732 0.189730 H\n0.635032 0.981940 0.019238 H\n0.090943 0.429911 0.817314 C\n0.195050 0.639812 0.781180 C\n0.488212 0.686723 0.725870 C\n0.499537 0.847600 0.590578 C\n0.254351 0.358511 0.987867 C\n0.362924 0.157203 0.497157 C\n0.825784 0.557293 0.285235 C\n0.561691 0.006979 0.138940 C\n0.445965 0.034477 0.654930 C\n0.518804 0.352551 0.011746 O\n0.553147 0.236427 0.415821 O\n0.106291 0.303699 0.108490 O\n0.094035 0.171476 0.449024 O\n",
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{
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"created_at": "2022-09-04T14:36:21.437633Z",
"updated_at": "2022-09-04T14:36:21.437658Z",
"structure_string": "Mo2 N4\n1.0\n4.343248 0.000000 0.000000\n0.000000 4.343248 0.000000\n0.000000 0.000000 2.753201\nMo N\n2 4\ndirect\n0.500000 0.500000 0.000000 Mo\n0.000000 0.000000 0.000000 Mo\n0.387922 0.887923 0.500000 N\n0.612078 0.112078 0.500000 N\n0.112078 0.387922 0.500000 N\n0.887923 0.612078 0.500000 N\n",
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{
"id": "jvasp-93677",
"created_at": "2022-09-04T14:36:20.521106Z",
"updated_at": "2022-09-04T14:36:20.521136Z",
"structure_string": "Li4 N1 O1\n1.0\n-2.312024 -2.312024 0.000000\n-2.312024 2.312024 0.000000\n-0.000000 -0.000000 -4.855012\nLi N O\n4 1 1\ndirect\n0.499999 0.000000 0.736740 Li\n0.000000 0.499999 0.263260 Li\n0.499999 0.000000 0.263260 Li\n0.000000 0.499999 0.736740 Li\n0.000000 0.000000 0.000000 N\n0.499999 0.499999 0.500000 O\n",
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},
{
"id": "jvasp-112359",
"created_at": "2022-09-04T14:38:26.501181Z",
"updated_at": "2022-09-04T14:38:26.501204Z",
"structure_string": "La1 Ni5 H6\n1.0\n5.442256 0.000000 0.000000\n-2.721127 4.713132 0.000000\n0.000000 0.000000 4.047109\nLa Ni H\n1 5 6\ndirect\n0.000000 0.000000 0.878553 La\n0.666667 0.333333 0.990975 Ni\n0.333333 0.666666 0.990975 Ni\n0.500000 0.500000 0.503827 Ni\n-0.000000 0.500000 0.503827 Ni\n0.500000 -0.000000 0.503827 Ni\n0.795525 0.204476 0.291532 H\n0.408953 0.204476 0.291532 H\n0.795524 0.591047 0.291532 H\n0.204476 0.795524 0.291532 H\n0.204476 0.408953 0.291532 H\n0.591047 0.795524 0.291532 H\n",
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{
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"structure_string": "Li1 Mn3 Al2 H6 O12\n1.0\n5.030389 -0.037320 0.010987\n-2.482786 4.375112 0.010761\n-0.869362 -1.479678 9.465502\nLi Mn Al H O\n1 3 2 6 12\ndirect\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Mn\n0.666599 0.333401 0.000000 Mn\n0.333400 0.666599 0.000000 Mn\n0.166668 0.833332 0.500000 Al\n0.833332 0.166667 0.500000 Al\n0.569583 0.917417 0.708940 H\n0.917422 0.569584 0.708941 H\n0.221830 0.221829 0.708930 H\n0.430416 0.082582 0.291060 H\n0.778170 0.778170 0.291070 H\n0.082577 0.430415 0.291059 H\n0.299047 0.299046 0.897397 O\n0.823732 0.823731 0.394981 O\n0.700952 0.700953 0.102603 O\n0.465032 0.106321 0.394972 O\n0.367495 0.034040 0.102584 O\n0.106319 0.465031 0.394973 O\n0.034039 0.367495 0.102584 O\n0.965961 0.632504 0.897416 O\n0.893680 0.534968 0.605027 O\n0.632504 0.965959 0.897416 O\n0.534967 0.893678 0.605028 O\n0.176268 0.176268 0.605019 O\n",
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{
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{
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"structure_string": "Mg2 H2 O3\n1.0\n1.538489 -2.664741 0.000000\n1.538489 2.664741 -0.000000\n0.000000 -0.000000 7.384250\nMg H O\n2 2 3\ndirect\n0.333334 0.666667 0.165365 Mg\n0.666667 0.333334 0.834635 Mg\n0.333334 0.666667 0.559763 H\n0.666667 0.333334 0.440237 H\n0.333334 0.666667 0.691292 O\n0.666667 0.333334 0.308708 O\n0.000000 0.000000 0.000000 O\n",
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{
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"created_at": "2022-09-04T14:37:17.051051Z",
"updated_at": "2022-09-04T14:37:17.051083Z",
"structure_string": "Li3 Co4 O8\n1.0\n5.437924 0.008787 8.269358\n2.479613 4.839691 8.269358\n0.010439 0.006393 4.954623\nLi Co O\n3 4 8\ndirect\n0.250000 0.750000 0.500001 Li\n0.749999 0.250000 0.500001 Li\n0.749999 0.750000 0.500002 Li\n0.001970 0.001970 0.000466 Co\n0.001242 0.498758 0.000001 Co\n0.498758 0.001242 0.000000 Co\n0.498029 0.498030 -0.000464 Co\n0.128685 0.128685 0.277271 O\n0.125005 0.639447 0.260033 O\n0.639447 0.125006 0.260033 O\n0.630826 0.630827 0.254966 O\n0.371315 0.371315 0.722730 O\n0.374994 0.860552 0.739970 O\n0.860552 0.374995 0.739969 O\n0.869173 0.869174 0.745038 O\n",
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]
}