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"id": "jvasp-48168",
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"structure_string": "Li8 Mn4 F16\n1.0\n-2.987644 6.077414 4.208549\n2.987644 -6.077414 4.208549\n5.975288 0.000000 0.000000\nLi Mn F\n8 4 16\ndirect\n0.000000 0.000000 0.000000 Li\n0.612510 0.887491 0.112510 Li\n0.387490 0.112510 0.387491 Li\n0.500000 0.500000 0.500000 Li\n0.745016 0.245017 0.750000 Li\n0.254984 0.754984 0.250000 Li\n0.612510 0.887491 0.612510 Li\n0.387490 0.112510 0.887491 Li\n0.264205 0.488879 0.887663 Mn\n0.988879 0.764205 0.612338 Mn\n0.011121 0.235795 0.387662 Mn\n0.735796 0.511121 0.112338 Mn\n0.257569 0.220360 0.018605 F\n0.616758 0.367732 0.851369 F\n0.383242 0.632269 0.602342 F\n0.132269 0.883242 0.351369 F\n0.720360 0.757569 0.481395 F\n0.509821 0.009821 0.750000 F\n0.490179 0.990179 0.250000 F\n0.742431 0.779640 0.981395 F\n0.867731 0.116758 0.648632 F\n0.616758 0.367732 0.397659 F\n0.383242 0.632269 0.148631 F\n0.012085 0.512084 0.250000 F\n0.987916 0.487916 0.750000 F\n0.867731 0.116758 0.102342 F\n0.279640 0.242431 0.518605 F\n0.132269 0.883242 0.897658 F\n",
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{
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{
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"created_at": "2022-09-04T14:35:42.940511Z",
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"structure_string": "Ca1 Mn1 Be2\n1.0\n3.164295 -3.162527 0.000000\n3.164295 3.162527 0.000000\n0.000000 0.000000 2.979574\nCa Mn Be\n1 1 2\ndirect\n0.500000 -0.000001 0.499999 Ca\n-0.000001 0.500000 0.499999 Mn\n0.000000 0.000000 0.000000 Be\n0.499999 0.499999 0.000000 Be\n",
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"structure_string": "K12 As4 Se12\n1.0\n9.674337 -0.000000 -0.000000\n-0.000000 9.674337 0.000000\n-0.000000 -0.000000 9.674337\nK As Se\n12 4 12\ndirect\n0.819806 0.180195 0.680195 K\n0.680195 0.819806 0.180195 K\n0.180195 0.680195 0.819806 K\n0.319806 0.319806 0.319806 K\n0.186439 0.313560 0.686441 K\n0.313561 0.686441 0.186440 K\n0.686441 0.186440 0.313560 K\n0.813560 0.813560 0.813560 K\n0.425058 0.074942 0.925058 K\n0.074942 0.925058 0.425058 K\n0.925058 0.425058 0.074942 K\n0.574942 0.574942 0.574942 K\n0.525444 0.474556 0.974556 As\n0.974556 0.525444 0.474556 As\n0.474556 0.974556 0.525444 As\n0.025444 0.025444 0.025444 As\n0.285831 0.396025 0.996559 Se\n0.785831 0.103975 0.003441 Se\n0.714170 0.896025 0.503441 Se\n0.103975 0.003441 0.785831 Se\n0.503441 0.714170 0.896025 Se\n0.003441 0.785831 0.103975 Se\n0.396025 0.996559 0.285831 Se\n0.996559 0.285831 0.396025 Se\n0.896025 0.503441 0.714170 Se\n0.603975 0.496559 0.214169 Se\n0.496559 0.214169 0.603975 Se\n0.214169 0.603975 0.496559 Se\n",
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"structure_string": "K2 Y1 In1 F6\n1.0\n5.767347 -0.000000 3.329780\n1.922449 5.437507 3.329780\n-0.000000 -0.000000 6.659559\nK Y In F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.500000 In\n0.770377 0.229624 0.229624 F\n0.229624 0.229624 0.770376 F\n0.229624 0.770377 0.770376 F\n0.229624 0.770377 0.229624 F\n0.770377 0.229624 0.770376 F\n0.770377 0.770377 0.229623 F\n",
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"created_at": "2022-09-04T14:35:44.365462Z",
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"structure_string": "Mg6 Nb1 Fe1\n1.0\n6.252896 -0.167661 0.000000\n-3.271645 5.331336 0.000000\n0.000000 0.000000 4.739284\nMg Nb Fe\n6 1 1\ndirect\n0.179787 0.840280 0.250000 Mg\n0.659721 0.320213 0.250000 Mg\n0.673680 0.826321 0.250000 Mg\n0.318355 0.666239 0.749999 Mg\n0.833762 0.181645 0.749999 Mg\n0.831537 0.668464 0.749999 Mg\n0.308020 0.191981 0.749999 Nb\n0.195140 0.304861 0.250000 Fe\n",
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"structure_string": "Ca1 Ti2 S4\n1.0\n3.558732 0.000000 0.000000\n0.000000 5.714987 1.761520\n0.000000 0.017555 6.854372\nCa Ti S\n1 2 4\ndirect\n0.000000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500000 -0.000000 Ti\n0.500000 0.765507 0.221016 S\n0.000000 0.257297 0.216861 S\n0.500000 0.234493 0.778983 S\n0.000000 0.742703 0.783139 S\n",
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