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{
"id": "jvasp-69203",
"created_at": "2022-09-04T14:35:43.236311Z",
"updated_at": "2022-09-04T14:35:43.236334Z",
"structure_string": "Ba1 Ni2 Br1\n1.0\n-2.139371 2.139371 5.616043\n2.139371 -2.139371 5.616043\n2.139371 2.139371 -5.616043\nBa Ni Br\n1 2 1\ndirect\n0.250000 0.750000 0.500000 Ba\n0.000000 0.000000 0.000000 Ni\n0.500000 0.500000 0.000000 Ni\n0.750000 0.250000 0.500000 Br\n",
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{
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{
"id": "jvasp-37425",
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"structure_string": "Dy1 Y1 Cd2\n1.0\n0.000000 3.718183 3.718183\n3.718183 -0.000000 3.718183\n3.718183 3.718183 0.000000\nDy Y Cd\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Dy\n0.749999 0.749999 0.749999 Y\n0.500001 0.500001 0.500001 Cd\n0.000000 0.000000 0.000000 Cd\n",
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{
"id": "jvasp-117347",
"created_at": "2022-09-04T14:38:26.483302Z",
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"structure_string": "Sb4 Cl14 F6\n1.0\n7.476133 0.035048 6.368280\n3.616891 6.543080 6.368280\n0.048542 0.028785 12.698373\nSb Cl F\n4 14 6\ndirect\n0.243785 0.212183 0.821663 Sb\n0.787817 0.756215 0.178337 Sb\n0.011065 0.890586 0.276460 Sb\n0.109414 -0.011065 0.723540 Sb\n0.099341 0.450329 0.189279 Cl\n0.549670 0.900659 0.810721 Cl\n0.289891 0.135124 0.479326 Cl\n0.864876 0.710109 0.520674 Cl\n0.600743 0.650011 0.431863 Cl\n0.349989 0.399257 0.568137 Cl\n0.701269 0.697760 0.083765 Cl\n0.310649 0.605881 0.208363 Cl\n0.394118 0.689351 0.791637 Cl\n0.787255 0.282265 0.738899 Cl\n0.717735 0.212745 0.261101 Cl\n0.041077 0.839201 0.688024 Cl\n0.160799 -0.041077 0.311975 Cl\n0.302239 0.298731 0.916235 Cl\n0.119083 0.042452 0.038132 F\n0.144257 0.116838 0.787929 F\n0.883162 0.855743 0.212071 F\n-0.037603 0.423195 0.855231 F\n0.576805 0.037602 0.144768 F\n0.957547 0.880918 0.961868 F\n",
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"volume": 616.8365336042341,
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"formula_full": "Sb4 Cl14 F6",
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{
"id": "jvasp-71097",
"created_at": "2022-09-04T14:36:19.696280Z",
"updated_at": "2022-09-04T14:36:19.696307Z",
"structure_string": "Be1 Sb2 Cl1\n1.0\n3.447297 -0.000000 0.000000\n0.000000 3.447297 0.000000\n0.000000 -0.000000 8.650885\nBe Sb Cl\n1 2 1\ndirect\n0.000000 0.000000 0.330749 Be\n0.000000 0.000000 0.050054 Sb\n0.500000 0.500000 0.420868 Sb\n0.500000 0.500000 0.698329 Cl\n",
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{
"id": "jvasp-92282",
"created_at": "2022-09-04T14:36:10.148242Z",
"updated_at": "2022-09-04T14:36:10.148270Z",
"structure_string": "In2 Se3\n1.0\n-2.078773 -3.600538 -0.000000\n2.078773 -3.600538 -0.000000\n-0.000000 -2.400359 8.584557\nIn Se\n2 3\ndirect\n0.207746 0.207746 0.376760 In\n0.792254 0.792254 0.623240 In\n0.401356 0.401356 0.795934 Se\n0.598645 0.598645 0.204066 Se\n0.000000 0.000000 0.000000 Se\n",
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{
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"updated_at": "2022-09-04T14:37:44.955639Z",
"structure_string": "K4 P2 Pd1 S8\n1.0\n6.338644 0.003006 -0.000162\n0.645506 6.834620 -0.048477\n1.199241 0.185735 8.897435\nK P Pd S\n4 2 1 8\ndirect\n0.294953 0.336582 0.141494 K\n0.751726 0.213116 0.469489 K\n0.248274 0.786885 0.530512 K\n0.705046 0.663419 0.858506 K\n0.825699 0.727062 0.263269 P\n0.174300 0.272940 0.736732 P\n0.000000 0.000000 0.000000 Pd\n0.669367 0.957845 0.149607 S\n0.780004 0.466315 0.178688 S\n0.137310 0.806694 0.193226 S\n0.754802 0.736854 0.490739 S\n0.245197 0.263147 0.509262 S\n0.862689 0.193307 0.806774 S\n0.219996 0.533686 0.821312 S\n0.330632 0.042157 0.850394 S\n",
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{
"id": "jvasp-37935",
"created_at": "2022-09-04T14:37:57.370619Z",
"updated_at": "2022-09-04T14:37:57.370629Z",
"structure_string": "Ca1 Tm1 Cd2\n1.0\n-0.000000 3.718083 3.718083\n3.718083 0.000000 3.718083\n3.718083 3.718083 -0.000000\nCa Tm Cd\n1 1 2\ndirect\n0.250001 0.250001 0.250001 Ca\n0.749999 0.749999 0.749999 Tm\n0.499999 0.499999 0.499999 Cd\n0.000000 0.000000 0.000000 Cd\n",
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{
"id": "jvasp-69053",
"created_at": "2022-09-04T14:36:04.773763Z",
"updated_at": "2022-09-04T14:36:04.773790Z",
"structure_string": "Ba1 Ca1 Ti4\n1.0\n-0.000000 4.256127 4.256127\n4.256127 0.000000 4.256127\n4.256127 4.256127 -0.000000\nBa Ca Ti\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Ba\n0.000000 0.000000 0.000000 Ca\n0.087224 0.637593 0.637593 Ti\n0.637593 0.637593 0.637593 Ti\n0.637593 0.087224 0.637593 Ti\n0.637593 0.637593 0.087224 Ti\n",
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{
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"created_at": "2022-09-04T14:36:45.736328Z",
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"structure_string": "Sm2 Ag2 Sn2\n1.0\n4.849978 -0.000000 0.000000\n-2.424989 4.200204 0.000000\n-0.000000 -0.000000 7.569317\nSm Ag Sn\n2 2 2\ndirect\n0.000000 0.000000 0.271697 Sm\n0.000000 0.000000 0.728304 Sm\n0.333333 0.666666 0.489789 Ag\n0.666667 0.333333 0.510212 Ag\n0.666667 0.333333 0.942721 Sn\n0.333333 0.666666 0.057280 Sn\n",
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{
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"created_at": "2022-09-04T14:38:34.690922Z",
"updated_at": "2022-09-04T14:38:34.690945Z",
"structure_string": "Re6 Cl18\n1.0\n8.404159 -0.069715 3.093833\n2.134552 8.128865 3.093833\n-0.091164 -0.069715 8.955076\nRe Cl\n6 18\ndirect\n0.647638 0.884836 0.647638 Re\n0.884837 0.647637 0.647638 Re\n0.115164 0.352362 0.352362 Re\n0.352362 0.115163 0.352362 Re\n0.352362 0.352362 0.115164 Re\n0.647639 0.647637 0.884836 Re\n0.267980 0.267979 0.951292 Cl\n0.267980 0.951292 0.267980 Cl\n0.951293 0.267979 0.267980 Cl\n0.048708 0.732020 0.732020 Cl\n0.732020 0.732020 0.048707 Cl\n0.732021 0.048707 0.732020 Cl\n0.119303 0.119303 0.589332 Cl\n0.178694 0.495985 0.495985 Cl\n0.821306 0.504014 0.504015 Cl\n0.504015 0.504014 0.821306 Cl\n0.504015 0.821306 0.504014 Cl\n0.880698 0.410668 0.880697 Cl\n0.880697 0.880697 0.410668 Cl\n0.410669 0.880697 0.880697 Cl\n0.589332 0.119303 0.119303 Cl\n0.119303 0.589332 0.119303 Cl\n0.495986 0.178693 0.495985 Cl\n0.495985 0.495985 0.178694 Cl\n",
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{
"id": "jvasp-69049",
"created_at": "2022-09-04T14:35:59.020811Z",
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"structure_string": "Ba1 Mo1 Se4\n1.0\n-0.000000 4.256096 4.256096\n4.256096 -0.000000 4.256096\n4.256096 4.256096 0.000000\nBa Mo Se\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Ba\n0.000000 0.000000 0.000000 Mo\n0.122415 0.625862 0.625862 Se\n0.625862 0.625862 0.625862 Se\n0.625862 0.122415 0.625862 Se\n0.625862 0.625862 0.122415 Se\n",
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}