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{
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{
"id": "jvasp-43964",
"created_at": "2022-09-04T14:35:51.070207Z",
"updated_at": "2022-09-04T14:35:51.070234Z",
"structure_string": "Na6 Fe2 O8\n1.0\n0.000000 5.200948 -0.000920\n6.376452 0.000000 0.000000\n0.000000 -1.930603 -5.357697\nNa Fe O\n6 2 8\ndirect\n0.250000 0.619879 0.000000 Na\n0.750000 0.380120 0.000000 Na\n0.250000 0.884963 0.500000 Na\n0.250000 0.373296 0.500000 Na\n0.750001 0.626704 0.500000 Na\n0.750001 0.115037 0.500000 Na\n0.250000 0.127746 0.000000 Fe\n0.750000 0.872254 0.000000 Fe\n0.050221 0.321701 0.783474 O\n0.493123 0.097003 0.812520 O\n0.550221 0.678299 0.783474 O\n0.993124 0.902996 0.812520 O\n0.449780 0.321701 0.216527 O\n0.506878 0.902996 0.187481 O\n0.949780 0.678299 0.216527 O\n0.006878 0.097003 0.187481 O\n",
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{
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"structure_string": "Cu2 O2\n1.0\n2.929458 -0.034164 -0.042660\n0.038003 2.929478 -0.040387\n0.083379 0.076930 5.173064\nCu O\n2 2\ndirect\n-0.000000 0.500000 -0.000000 Cu\n0.500001 0.000001 0.500000 Cu\n0.000544 0.999485 0.249995 O\n0.999457 0.000518 0.750004 O\n",
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{
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"created_at": "2022-09-04T14:36:49.163159Z",
"updated_at": "2022-09-04T14:36:49.163194Z",
"structure_string": "Li2 Cu2 C2 O6\n1.0\n3.550881 0.020596 -0.381706\n-0.623539 -4.456754 0.310720\n0.861091 0.669024 -8.556231\nLi Cu C O\n2 2 2 6\ndirect\n0.839821 0.189104 0.634423 Li\n0.160139 0.810833 0.365465 Li\n-0.000020 0.499967 0.999938 Cu\n0.499972 -0.000022 0.999938 Cu\n0.214962 0.769630 0.716177 C\n0.784999 0.230306 0.283700 C\n0.058281 0.524655 0.779788 O\n0.149362 0.812505 0.583583 O\n0.439023 0.977855 0.790185 O\n0.941683 0.475278 0.220085 O\n0.850585 0.187433 0.416299 O\n0.560939 0.022071 0.209694 O\n",
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"volume": 133.2576500196919,
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"formula_full": "Li2 Cu2 C2 O6",
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"formula_anonymous": "ABCD3",
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"spacegroup": 2
},
{
"id": "jvasp-79522",
"created_at": "2022-09-04T14:36:40.681313Z",
"updated_at": "2022-09-04T14:36:40.681331Z",
"structure_string": "Cu2 O2\n1.0\n2.063524 2.071473 -0.184285\n2.063524 -2.071473 -0.184285\n-0.455402 0.000000 -5.155087\nCu O\n2 2\ndirect\n0.000000 0.499999 0.500000 Cu\n0.499999 -0.000000 -0.000000 Cu\n0.500225 0.499773 0.249999 O\n0.499773 0.500226 0.750000 O\n",
"nsites": 4,
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"volume": 44.41888349097337,
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"formula_full": "Cu2 O2",
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},
{
"id": "jvasp-110142",
"created_at": "2022-09-04T14:38:11.288618Z",
"updated_at": "2022-09-04T14:38:11.288636Z",
"structure_string": "Ti1 Nb1 B2\n1.0\n4.638949 0.001569 0.000000\n-3.464926 3.084499 0.000000\n0.000000 0.000000 3.102915\nTi Nb B\n1 1 2\ndirect\n0.855250 0.144751 -0.000000 Ti\n0.147206 0.852793 0.500001 Nb\n0.441607 0.558393 0.500001 B\n0.555936 0.444064 -0.000000 B\n",
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"spacegroup": 38
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{
"id": "jvasp-27269",
"created_at": "2022-09-04T14:37:44.748379Z",
"updated_at": "2022-09-04T14:37:44.748401Z",
"structure_string": "Y4 Be4 Ge2 O14\n1.0\n7.440576 0.000000 -0.000000\n-0.000000 7.440576 -0.000000\n0.000000 -0.000000 4.813669\nY Be Ge O\n4 4 2 14\ndirect\n0.341761 0.158239 0.504711 Y\n0.841761 0.341761 0.495289 Y\n0.158239 0.658240 0.495289 Y\n0.658240 0.841761 0.504711 Y\n0.135419 0.364581 0.951459 Be\n0.635419 0.135419 0.048542 Be\n0.364581 0.864582 0.048542 Be\n0.864582 0.635419 0.951459 Be\n0.000000 0.000000 0.000000 Ge\n0.500000 0.500000 0.000000 Ge\n0.418470 0.671929 0.218422 O\n0.581531 0.328072 0.218422 O\n0.918470 0.828072 0.781578 O\n0.171929 0.918470 0.218422 O\n0.828072 0.081530 0.218422 O\n0.081530 0.171929 0.781578 O\n0.500000 0.000000 0.186703 O\n0.357651 0.857652 0.718141 O\n0.642349 0.142349 0.718141 O\n0.142349 0.357651 0.281859 O\n0.671929 0.581531 0.781578 O\n0.000000 0.500000 0.813298 O\n0.857652 0.642349 0.281859 O\n0.328072 0.418470 0.781578 O\n",
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{
"id": "jvasp-36641",
"created_at": "2022-09-04T14:37:19.265159Z",
"updated_at": "2022-09-04T14:37:19.265176Z",
"structure_string": "Hg1 Ge1 O3\n1.0\n3.814894 -0.000000 0.000000\n0.000000 3.814894 0.000000\n-0.000000 0.000000 3.814894\nHg Ge O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Hg\n0.499999 0.499999 0.499999 Ge\n0.499999 0.499999 0.000000 O\n0.499999 0.000000 0.499999 O\n0.000000 0.499999 0.499999 O\n",
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"formula_full": "Hg1 Ge1 O3",
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"formula_anonymous": "ABC3",
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"spacegroup": 221
},
{
"id": "jvasp-107255",
"created_at": "2022-09-04T14:36:58.263925Z",
"updated_at": "2022-09-04T14:36:58.263947Z",
"structure_string": "Mn3 Au1 N1\n1.0\n3.814888 -0.000000 0.000000\n0.000000 3.814888 0.000000\n0.000000 -0.000000 3.814888\nMn Au N\n3 1 1\ndirect\n0.500000 0.000000 -0.000000 Mn\n-0.000000 0.500000 -0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.500000 0.500000 0.500000 Au\n0.000000 0.000000 0.000000 N\n",
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},
{
"id": "jvasp-43806",
"created_at": "2022-09-04T14:36:00.561600Z",
"updated_at": "2022-09-04T14:36:00.561626Z",
"structure_string": "V5 O12\n1.0\n4.897608 -0.022739 -0.007832\n0.042215 5.262350 0.010527\n-0.003342 0.880472 7.325043\nV O\n5 12\ndirect\n0.975474 0.020055 0.984195 V\n0.523871 0.489323 0.515371 V\n0.030349 -0.004400 0.519249 V\n0.467242 0.496233 0.978069 V\n0.006785 0.594991 0.274047 V\n0.317552 0.776579 0.924855 O\n0.196064 0.655263 0.521367 O\n0.814402 0.621742 0.071796 O\n0.327934 0.458550 0.232731 O\n0.612412 0.473755 0.736323 O\n0.838177 0.300589 0.413230 O\n0.105697 0.935083 0.226543 O\n0.677758 0.145830 0.035262 O\n0.894006 0.961480 0.732668 O\n0.711860 0.759672 0.419601 O\n0.175176 0.283595 0.930619 O\n0.325255 0.150253 0.543374 O\n",
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{
"id": "jvasp-52403",
"created_at": "2022-09-04T14:36:34.560627Z",
"updated_at": "2022-09-04T14:36:34.560658Z",
"structure_string": "Na2 Cu1 H4 C4 O10\n1.0\n3.528449 0.026786 -0.028603\n-1.708849 7.302858 0.023614\n-1.433370 -2.696973 9.040515\nNa Cu H C O\n2 1 4 4 10\ndirect\n0.689757 0.301526 0.576027 Na\n0.310243 0.698475 0.423972 Na\n0.000000 0.000000 0.000000 Cu\n0.468954 0.531949 0.801847 H\n0.531046 0.468052 0.198153 H\n0.346147 0.325918 0.827011 H\n0.653853 0.674083 0.172988 H\n0.738533 0.026002 0.257036 C\n0.261467 0.973999 0.742963 C\n0.040232 0.219145 0.278447 C\n0.959768 0.780856 0.721553 C\n0.293823 0.400912 0.757843 O\n0.188560 0.234572 0.164909 O\n0.811440 0.765429 0.835091 O\n0.672271 0.904502 0.127547 O\n0.327729 0.095499 0.872452 O\n0.125737 0.344273 0.398850 O\n0.874263 0.655728 0.601149 O\n0.576131 -0.001671 0.358689 O\n0.423870 0.001672 0.641310 O\n0.706178 0.599089 0.242157 O\n",
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{
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"created_at": "2022-09-04T14:36:11.553231Z",
"updated_at": "2022-09-04T14:36:11.553247Z",
"structure_string": "Be2 Cr1 Pt1\n1.0\n3.953391 -0.000000 0.000000\n0.000000 3.953391 0.000000\n0.000000 -0.000000 2.841415\nBe Cr Pt\n2 1 1\ndirect\n0.000000 0.500000 0.000000 Be\n0.500000 0.000000 0.000000 Be\n0.000000 0.000000 0.499999 Cr\n0.500000 0.500000 0.499999 Pt\n",
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{
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"created_at": "2022-09-04T14:37:59.283387Z",
"updated_at": "2022-09-04T14:37:59.283418Z",
"structure_string": "Co2 Mo2 H4 Se2 O14\n1.0\n4.958240 -0.012128 0.009636\n-2.275701 6.174911 -0.001450\n-1.140299 -0.724050 8.707945\nCo Mo H Se O\n2 2 4 2 14\ndirect\n0.500000 -0.000000 0.000000 Co\n0.000000 0.500000 0.500000 Co\n0.206630 0.405803 0.105347 Mo\n0.793370 0.594197 0.894654 Mo\n0.616226 0.140855 0.356093 H\n0.454046 0.247450 0.480296 H\n0.545954 0.752549 0.519705 H\n0.383774 0.859145 0.643908 H\n0.873674 0.822240 0.260423 Se\n0.126326 0.177759 0.739578 Se\n0.360219 0.414495 0.869065 O\n0.335727 0.020689 0.776507 O\n0.856516 0.538419 0.710417 O\n0.364482 0.742910 0.562912 O\n0.196231 0.269517 0.565617 O\n0.803769 0.730482 0.434384 O\n0.269606 0.157656 0.103146 O\n0.143484 0.461580 0.289584 O\n0.664273 0.979311 0.223494 O\n0.639781 0.585505 0.130936 O\n0.730394 0.842344 0.896855 O\n0.168249 0.695642 0.012792 O\n0.635518 0.257089 0.437089 O\n0.831751 0.304358 0.987209 O\n",
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}
]
}