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{
"id": "jvasp-114990",
"created_at": "2022-09-04T14:38:42.790381Z",
"updated_at": "2022-09-04T14:38:42.790410Z",
"structure_string": "Ge1 Cl3\n1.0\n6.685160 1.915663 0.633960\n2.880840 -2.779193 -0.984198\n-2.963491 -6.149067 -6.612928\nGe Cl\n1 3\ndirect\n0.098938 -0.110408 0.019717 Ge\n0.753206 0.442053 0.351569 Cl\n0.277350 -0.097704 0.858877 Cl\n0.549199 0.063240 0.642847 Cl\n",
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{
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"structure_string": "Li1 Ca2 Ge1\n1.0\n4.457366 -0.000000 2.573461\n1.485789 4.202445 2.573461\n0.000000 0.000000 5.146923\nLi Ca Ge\n1 2 1\ndirect\n0.500000 0.500001 0.499999 Li\n0.250000 0.250000 0.249999 Ca\n0.750001 0.750001 0.749998 Ca\n0.000000 0.000000 0.000000 Ge\n",
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{
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"structure_string": "Sn1 C1 Cl3\n1.0\n5.230529 0.000000 0.000000\n0.000000 5.230529 -0.000000\n-0.000000 0.000000 5.230529\nSn C Cl\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Sn\n0.000000 0.000000 0.000000 C\n0.500000 0.500000 0.000000 Cl\n0.500000 0.000000 0.500000 Cl\n0.000000 0.500000 0.500000 Cl\n",
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{
"id": "jvasp-30106",
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"structure_string": "U2 B8 H32\n1.0\n3.966353 3.890931 -0.000000\n-3.966353 3.890931 -0.000000\n0.000000 0.000000 11.631742\nU B H\n2 8 32\ndirect\n0.304816 0.304816 0.250000 U\n0.695184 0.695184 0.750000 U\n0.382333 0.809988 0.250000 B\n0.190012 0.617667 0.750000 B\n0.617667 0.190012 0.750000 B\n0.809988 0.382333 0.250000 B\n0.234387 0.234387 0.038942 B\n0.765613 0.765613 0.961058 B\n0.234387 0.234387 0.461058 B\n0.765613 0.765613 0.538942 B\n0.893373 0.893373 0.896654 H\n0.106627 0.106627 0.396654 H\n0.893373 0.893373 0.603346 H\n0.444763 0.192315 0.070396 H\n0.807685 0.555236 0.929604 H\n0.444763 0.192315 0.429604 H\n0.192315 0.444763 0.429604 H\n0.555236 0.807685 0.929604 H\n0.192315 0.444763 0.070396 H\n0.555236 0.807685 0.570396 H\n0.106627 0.106627 0.103346 H\n0.801686 0.801686 0.061107 H\n0.198313 0.198313 0.938893 H\n0.807685 0.555236 0.570396 H\n0.688592 0.394232 0.161878 H\n0.394232 0.688592 0.161878 H\n0.688592 0.394232 0.338122 H\n0.605768 0.311408 0.661878 H\n0.311408 0.605768 0.838121 H\n0.801686 0.801686 0.438893 H\n0.311408 0.605768 0.661878 H\n0.394232 0.688592 0.338122 H\n0.909112 0.184254 0.250000 H\n0.815745 0.090887 0.750000 H\n0.090887 0.815745 0.750000 H\n0.184254 0.909112 0.250000 H\n0.959219 0.550365 0.250000 H\n0.449634 0.040781 0.750000 H\n0.040781 0.449634 0.750000 H\n0.550365 0.959219 0.250000 H\n0.605768 0.311408 0.838121 H\n0.198313 0.198313 0.561107 H\n",
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{
"id": "jvasp-52881",
"created_at": "2022-09-04T14:35:44.016599Z",
"updated_at": "2022-09-04T14:35:44.016622Z",
"structure_string": "K3 Ca1 P2 H1 O8\n1.0\n4.939563 2.872917 -0.366286\n-4.939563 2.872917 0.366286\n0.001122 0.000000 7.407871\nK Ca P H O\n3 1 2 1 8\ndirect\n-0.000000 0.000000 0.500000 K\n0.667899 0.332102 0.186990 K\n0.332102 0.667899 0.813010 K\n0.000000 0.000000 0.000000 Ca\n0.662353 0.337648 0.746249 P\n0.337648 0.662353 0.253750 P\n0.500000 0.500001 0.500000 H\n0.817870 0.182131 0.776628 O\n0.182131 0.817871 0.223372 O\n0.621904 0.378097 0.536001 O\n0.378097 0.621904 0.463999 O\n0.821459 0.619388 0.828745 O\n0.380613 0.178542 0.828745 O\n0.178542 0.380613 0.171255 O\n0.619388 0.821460 0.171255 O\n",
"nsites": 15,
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{
"id": "jvasp-105706",
"created_at": "2022-09-04T14:36:19.668494Z",
"updated_at": "2022-09-04T14:36:19.668523Z",
"structure_string": "K2 Pd1\n1.0\n5.617164 0.000000 0.000000\n0.000000 5.617164 -0.000000\n0.000000 0.000000 3.532846\nK Pd\n2 1\ndirect\n0.000000 0.500000 0.500001 K\n0.500000 0.000000 0.500001 K\n0.000000 0.000000 0.000000 Pd\n",
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{
"id": "jvasp-38223",
"created_at": "2022-09-04T14:37:46.266965Z",
"updated_at": "2022-09-04T14:37:46.266986Z",
"structure_string": "Rb3 Mo1\n1.0\n-3.348502 3.348502 4.743738\n3.348502 -3.348502 4.743738\n3.348502 3.348502 -4.743738\nRb Mo\n3 1\ndirect\n0.750001 0.250000 0.500001 Rb\n0.250000 0.750001 0.500001 Rb\n0.500000 0.500000 0.000000 Rb\n0.000000 0.000000 0.000000 Mo\n",
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{
"id": "jvasp-13346",
"created_at": "2022-09-04T14:36:56.507293Z",
"updated_at": "2022-09-04T14:36:56.507325Z",
"structure_string": "K6 Fe2 O5\n1.0\n6.616853 0.008689 0.014416\n-0.294173 6.590228 0.080667\n-0.294173 -3.006554 5.865001\nK Fe O\n6 2 5\ndirect\n0.990020 0.199433 0.795484 K\n0.174915 0.361215 0.361215 K\n0.499441 0.759265 0.248792 K\n0.499441 0.248792 0.759264 K\n0.835804 0.639921 0.639921 K\n0.990020 0.795484 0.199433 K\n0.336246 0.794491 0.794490 Fe\n0.689011 0.190014 0.190014 Fe\n0.217547 0.843135 0.562504 O\n0.217547 0.562504 0.843134 O\n0.602424 0.922543 0.922542 O\n0.768343 0.164250 0.447365 O\n0.768343 0.447365 0.164250 O\n",
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{
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"created_at": "2022-09-04T14:37:40.389109Z",
"updated_at": "2022-09-04T14:37:40.389141Z",
"structure_string": "Li10 Co2 O8\n1.0\n6.372166 0.242128 -0.000005\n0.242130 6.372168 -0.000001\n-0.000005 0.000001 4.695608\nLi Co O\n10 2 8\ndirect\n0.041424 0.950893 0.778585 Li\n0.950893 0.041425 0.278586 Li\n0.781376 0.714218 0.803478 Li\n0.714217 0.781375 0.303478 Li\n0.541425 0.450893 0.221416 Li\n0.982052 0.482052 0.250001 Li\n0.450892 0.541425 0.721416 Li\n0.281375 0.214217 0.196523 Li\n0.214217 0.281375 0.696523 Li\n0.482051 0.982052 0.750001 Li\n0.256869 0.756871 0.250001 Co\n0.756873 0.256871 0.750001 Co\n0.737960 0.501091 0.519019 O\n0.001090 0.237960 0.980981 O\n0.237961 0.001093 0.480984 O\n0.265703 0.484401 0.415105 O\n0.484400 0.265703 0.915105 O\n0.501094 0.737961 0.019016 O\n0.765703 0.984402 0.584898 O\n0.984403 0.765704 0.084898 O\n",
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{
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"created_at": "2022-09-04T14:38:52.650442Z",
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"structure_string": "Ti1 P1 Cl2\n1.0\n3.462250 -0.000000 -0.000000\n0.000000 3.462250 -0.000000\n0.000000 0.000000 7.544921\nTi P Cl\n1 1 2\ndirect\n0.500000 0.500000 0.791202 Ti\n0.000000 0.000000 0.709521 P\n0.000000 0.000000 0.427271 Cl\n0.500000 0.500000 0.082006 Cl\n",
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{
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"created_at": "2022-09-04T14:37:59.840085Z",
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"structure_string": "Li4 Mn1 F8\n1.0\n0.000000 4.967107 -0.034085\n5.971623 0.000000 0.000000\n0.000000 -1.844048 -4.766244\nLi Mn F\n4 1 8\ndirect\n-0.000000 0.817930 0.500000 Li\n0.500000 0.010830 0.500000 Li\n0.500000 0.208531 0.000000 Li\n0.500000 0.764985 0.000000 Li\n0.500000 0.495295 0.500000 Mn\n0.708051 0.506463 0.267486 F\n0.705458 0.981775 0.255959 F\n0.717224 0.276487 0.724390 F\n0.734787 0.718504 0.714659 F\n0.282776 0.276487 0.275610 F\n0.265213 0.718504 0.285341 F\n0.294542 0.981775 0.744041 F\n0.291949 0.506463 0.732514 F\n",
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{
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}