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{
"id": "jvasp-109384",
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"structure_string": "Mn5 Al2 V1\n1.0\n3.884271 -0.003316 -1.164191\n-1.764422 3.460402 1.164191\n-0.008356 0.005124 7.031472\nMn Al V\n5 2 1\ndirect\n0.749081 0.250917 0.247203 Mn\n0.250890 0.749108 0.752745 Mn\n0.000918 0.999081 0.002797 Mn\n0.499108 0.500889 0.497255 Mn\n0.375000 0.624999 0.125000 Mn\n0.124858 0.875140 0.374488 Al\n0.625140 0.374857 0.875512 Al\n0.874999 0.124998 0.625000 V\n",
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{
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{
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"updated_at": "2022-09-04T14:35:49.905950Z",
"structure_string": "Fe4 O2 F6\n1.0\n3.099897 0.000000 0.000000\n0.000000 4.774311 0.000000\n0.000000 0.000000 9.568757\nFe O F\n4 2 6\ndirect\n0.000000 0.032821 0.135551 Fe\n0.000000 0.973812 0.633146 Fe\n0.500001 0.532820 0.864450 Fe\n0.500001 0.473812 0.366854 Fe\n0.500001 0.201111 0.222783 O\n0.000000 0.701111 0.777218 O\n0.500001 0.203750 0.719950 F\n0.000000 0.296104 0.965941 F\n0.000000 0.292402 0.483639 F\n0.000000 0.703750 0.280050 F\n0.500001 0.792402 0.516361 F\n0.500001 0.796104 0.034059 F\n",
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"formula_full": "Fe4 O2 F6",
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{
"id": "jvasp-92254",
"created_at": "2022-09-04T14:36:11.414632Z",
"updated_at": "2022-09-04T14:36:11.414658Z",
"structure_string": "Li1 V1 F6\n1.0\n5.067894 -0.267499 -1.399697\n2.200166 4.183188 -1.461538\n-1.083594 -0.641242 4.771042\nLi V F\n1 1 6\ndirect\n0.520402 0.520401 0.526093 Li\n0.020408 0.020390 0.026090 V\n0.253879 0.255259 0.381970 F\n0.255469 0.664600 0.140347 F\n0.256987 0.908896 0.791470 F\n0.783839 0.131932 0.260736 F\n0.785336 0.376152 0.911800 F\n0.786935 0.785505 0.670233 F\n",
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"formula_full": "Li1 V1 F6",
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{
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"created_at": "2022-09-04T14:35:53.505541Z",
"updated_at": "2022-09-04T14:35:53.505568Z",
"structure_string": "Ba4 Li2 B10 O20\n1.0\n0.000000 4.442765 -0.018776\n14.682084 0.000000 0.000000\n0.000000 -1.657670 -6.506141\nBa Li B O\n4 2 10 20\ndirect\n0.335424 0.910741 0.696595 Ba\n0.664577 0.410741 0.303405 Ba\n0.664577 0.089259 0.303405 Ba\n0.335424 0.589259 0.696595 Ba\n0.988143 0.750000 0.978191 Li\n0.011859 0.250000 0.021810 Li\n0.558362 0.663649 0.175747 B\n0.441639 0.163649 0.824253 B\n0.441639 0.336350 0.824253 B\n0.233121 0.250000 0.496133 B\n0.558362 0.836350 0.175747 B\n0.953157 0.420630 0.823113 B\n0.046844 0.920630 0.176887 B\n0.046844 0.579370 0.176887 B\n0.953157 0.079370 0.823113 B\n0.766880 0.750000 0.503867 B\n0.665696 0.831968 0.403624 O\n0.780894 0.354376 0.894553 O\n0.219108 0.854376 0.105447 O\n0.219108 0.645623 0.105447 O\n0.780894 0.145623 0.894553 O\n0.665696 0.668031 0.403624 O\n0.334306 0.168031 0.596377 O\n0.334306 0.331969 0.596377 O\n0.378159 0.250000 0.917291 O\n0.279053 0.413080 0.897543 O\n0.830724 0.487337 0.692062 O\n0.169277 0.987337 0.307938 O\n0.169277 0.512663 0.307938 O\n0.830724 0.012663 0.692062 O\n0.720948 0.586920 0.102457 O\n0.279053 0.086920 0.897543 O\n0.950838 0.750000 0.695461 O\n0.720948 0.913080 0.102457 O\n0.621843 0.750000 0.082710 O\n0.049164 0.250000 0.304540 O\n",
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{
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"created_at": "2022-09-04T14:36:36.576566Z",
"updated_at": "2022-09-04T14:36:36.576585Z",
"structure_string": "Na1 Sc1 O2\n1.0\n3.044334 -0.001681 4.845139\n1.394569 2.706132 4.845139\n-0.002759 -0.001681 5.722178\nNa Sc O\n1 1 2\ndirect\n0.499999 0.500000 0.500001 Na\n0.000000 0.000000 0.000000 Sc\n0.735080 0.735081 0.735082 O\n0.264919 0.264919 0.264920 O\n",
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},
{
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"created_at": "2022-09-04T14:36:39.254556Z",
"updated_at": "2022-09-04T14:36:39.254589Z",
"structure_string": "Li2 P4 W2 O14\n1.0\n6.469583 -0.048375 -0.000913\n0.951253 6.414168 0.012728\n0.801588 2.621125 6.254191\nLi P W O\n2 4 2 14\ndirect\n0.981487 0.301442 0.174947 Li\n0.018512 0.698558 0.825054 Li\n0.864368 0.778588 0.237905 P\n0.605720 0.646690 0.657608 P\n0.394280 0.353310 0.342393 P\n0.135631 0.221412 0.762095 P\n0.653677 0.094087 0.775099 W\n0.346322 0.905913 0.224901 W\n0.228679 0.376973 0.532187 O\n0.288502 0.224459 0.243579 O\n0.328346 0.057717 0.878046 O\n0.415144 0.595986 0.190312 O\n0.401985 0.772707 0.554220 O\n0.598014 0.227293 0.445780 O\n0.771320 0.623027 0.467814 O\n0.671653 0.942283 0.121955 O\n0.711498 0.775541 0.756421 O\n0.039914 0.376928 0.868981 O\n0.960085 0.623073 0.131020 O\n0.985393 0.072476 0.732695 O\n0.584856 0.404014 0.809688 O\n0.014606 0.927524 0.267306 O\n",
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"created_at": "2022-09-04T14:37:31.178063Z",
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"structure_string": "Cr3 Ni1\n1.0\n2.868370 2.868370 -0.000000\n2.868370 -0.000000 -2.868370\n-0.000000 2.868370 -2.868370\nCr Ni\n3 1\ndirect\n0.250000 0.250000 0.250000 Cr\n0.750000 0.750000 0.750000 Cr\n0.500000 0.500000 0.500000 Cr\n0.000000 0.000000 0.000000 Ni\n",
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{
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"created_at": "2022-09-04T14:38:16.481011Z",
"updated_at": "2022-09-04T14:38:16.481033Z",
"structure_string": "Na2 V2 Ge4 O12\n1.0\n5.341530 -0.052430 1.112310\n1.195681 6.550593 0.866028\n-0.086467 -0.000926 6.714347\nNa V Ge O\n2 2 4 12\ndirect\n0.750000 0.809156 0.190844 Na\n0.250000 0.190843 0.809157 Na\n0.250000 0.590434 0.409566 V\n0.750000 0.409565 0.590435 V\n0.724322 0.309070 0.113113 Ge\n0.224322 0.113112 0.309070 Ge\n0.275678 0.690929 0.886888 Ge\n0.775678 0.886886 0.690931 Ge\n0.371761 0.522252 0.690992 O\n0.168437 0.594008 0.136837 O\n0.668437 0.136836 0.594008 O\n0.331563 0.863162 0.405993 O\n-0.023940 0.106792 0.171300 O\n0.523940 0.828700 0.893209 O\n0.476060 0.171299 0.106792 O\n0.831563 0.405991 0.863164 O\n0.128239 0.309008 0.477747 O\n0.871761 0.690991 0.522254 O\n0.023940 0.893207 0.828701 O\n0.628239 0.477747 0.309009 O\n",
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"created_at": "2022-09-04T14:35:54.235895Z",
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"structure_string": "Li2 Si4 Bi2 O12\n1.0\n5.031878 4.610769 0.136345\n-5.031878 4.610769 -0.136345\n-1.539762 0.000000 5.044088\nLi Si Bi O\n2 4 2 12\ndirect\n0.088691 0.088690 0.750000 Li\n0.911310 0.911310 0.250000 Li\n0.189490 0.625021 0.726189 Si\n0.374979 0.810511 0.226189 Si\n0.625021 0.189489 0.773812 Si\n0.810511 0.374979 0.273812 Si\n0.722444 0.722444 0.750000 Bi\n0.277556 0.277556 0.250000 Bi\n0.887423 0.603914 0.179767 O\n0.684877 0.361110 0.519220 O\n0.396086 0.112577 0.679767 O\n0.638890 0.315124 0.019219 O\n0.361110 0.684876 0.980781 O\n0.208006 0.980613 0.142646 O\n0.315124 0.638890 0.480781 O\n0.112577 0.396086 0.820233 O\n0.791994 0.019387 0.857354 O\n0.019387 0.791994 0.642647 O\n0.603914 0.887423 0.320233 O\n0.980613 0.208006 0.357354 O\n",
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{
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"created_at": "2022-09-04T14:36:14.887915Z",
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"structure_string": "Mn1 Be2 Se1\n1.0\n-1.712531 1.712531 4.023201\n1.712531 -1.712531 4.023201\n1.712531 1.712531 -4.023201\nMn Be Se\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Mn\n0.000000 0.000000 0.000000 Be\n0.250000 0.750000 0.500000 Be\n0.750000 0.250000 0.500000 Se\n",
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"formula_full": "Mn1 Be2 Se1",
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]
}