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{
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{
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{
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{
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"created_at": "2022-09-04T14:48:06.146236Z",
"structure_string": "Co4 O8\n1.0\n-2.436415 1.409272 -0.006873\n2.471914 4.274245 -0.021290\n0.000690 -0.015470 -10.294806\nCo O\n4 8\ndirect\n0.498773 0.500971 0.501832 Co\n0.998749 0.001026 0.002318 Co\n0.998773 0.000940 0.501832 Co\n0.498748 0.501020 0.002314 Co\n0.499287 0.834108 0.410616 O\n0.999294 0.334000 0.410678 O\n0.498176 0.832928 0.093452 O\n0.998182 0.333043 0.093503 O\n0.498258 0.167781 0.593002 O\n0.998253 0.667898 0.592944 O\n0.499313 0.169071 0.911241 O\n0.999307 0.668979 0.911182 O\n",
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{
"id": "mp-554293",
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"structure_string": "Ba2 Fe24 O38\n1.0\n3.008405 -5.210711 0.000000\n3.008405 5.210711 0.000000\n0.000000 0.000000 23.495368\nBa Fe O\n2 24 38\ndirect\n0.666667 0.333333 0.250000 Ba\n0.333333 0.666667 0.750000 Ba\n0.831987 0.663974 0.108258 Fe\n0.831987 0.663974 0.391742 Fe\n0.666667 0.333333 0.971914 Fe\n0.168013 0.831987 0.608258 Fe\n0.666667 0.333333 0.809715 Fe\n0.336026 0.168013 0.391742 Fe\n0.168013 0.336026 0.608258 Fe\n0.333333 0.666667 0.309715 Fe\n0.333333 0.666667 0.028086 Fe\n0.663974 0.831987 0.891742 Fe\n0.336026 0.168013 0.108258 Fe\n0.831987 0.168013 0.108258 Fe\n0.333333 0.666667 0.190285 Fe\n0.663974 0.831987 0.608258 Fe\n0.000000 0.000000 0.500000 Fe\n0.333333 0.666667 0.471914 Fe\n0.168013 0.336026 0.891742 Fe\n0.666667 0.333333 0.690285 Fe\n0.168013 0.831987 0.891742 Fe\n0.666667 0.333333 0.528086 Fe\n0.831987 0.168013 0.391742 Fe\n0.000000 0.000000 0.750000 Fe\n0.000000 0.000000 0.000000 Fe\n0.000000 0.000000 0.250000 Fe\n0.007230 0.503615 0.850956 O\n0.634437 0.817219 0.250000 O\n0.155059 0.310119 0.052430 O\n0.503615 0.496385 0.149044 O\n0.496385 0.503615 0.850956 O\n0.000000 0.000000 0.151245 O\n0.000000 0.000000 0.348755 O\n0.844941 0.689881 0.552430 O\n0.496385 0.992770 0.649044 O\n0.365563 0.182781 0.750000 O\n0.310119 0.155059 0.947570 O\n0.000000 0.000000 0.848755 O\n0.155059 0.844941 0.052430 O\n0.844941 0.155059 0.552430 O\n0.333333 0.666667 0.554680 O\n0.182781 0.817219 0.250000 O\n0.333333 0.666667 0.945320 O\n0.503615 0.007230 0.350956 O\n0.666667 0.333333 0.054680 O\n0.000000 0.000000 0.651245 O\n0.992770 0.496385 0.350956 O\n0.844941 0.155059 0.947570 O\n0.817219 0.634437 0.750000 O\n0.310119 0.155059 0.552430 O\n0.503615 0.496385 0.350956 O\n0.844941 0.689881 0.947570 O\n0.496385 0.503615 0.649044 O\n0.992770 0.496385 0.149044 O\n0.689881 0.844941 0.447570 O\n0.007230 0.503615 0.649044 O\n0.666667 0.333333 0.445320 O\n0.155059 0.310119 0.447570 O\n0.496385 0.992770 0.850956 O\n0.155059 0.844941 0.447570 O\n0.182781 0.365563 0.250000 O\n0.689881 0.844941 0.052430 O\n0.817219 0.182781 0.750000 O\n0.503615 0.007230 0.149044 O\n",
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{
"id": "mp-1213834",
"created_at": "2022-09-04T14:48:06.635977Z",
"structure_string": "Cs6 Sc4 Br18\n1.0\n3.968685 -6.873963 0.000000\n3.968685 6.873963 0.000000\n0.000000 0.000000 20.018659\nCs Sc Br\n6 4 18\ndirect\n0.333333 0.666667 0.072239 Cs\n0.666667 0.333333 0.927761 Cs\n0.666667 0.333333 0.572239 Cs\n0.333333 0.666667 0.427761 Cs\n0.000000 0.000000 0.250000 Cs\n0.000000 0.000000 0.750000 Cs\n0.333333 0.666667 0.658177 Sc\n0.666667 0.333333 0.341823 Sc\n0.666667 0.333333 0.158177 Sc\n0.333333 0.666667 0.841823 Sc\n0.173191 0.346382 0.592404 Br\n0.826809 0.653618 0.407596 Br\n0.653618 0.826809 0.592404 Br\n0.826809 0.653618 0.092404 Br\n0.346382 0.173191 0.407596 Br\n0.173191 0.346382 0.907596 Br\n0.173191 0.826809 0.592404 Br\n0.346382 0.173191 0.092404 Br\n0.826809 0.173191 0.407596 Br\n0.653618 0.826809 0.907596 Br\n0.826809 0.173191 0.092404 Br\n0.173191 0.826809 0.907596 Br\n0.514641 0.029282 0.250000 Br\n0.485359 0.970718 0.750000 Br\n0.970718 0.485359 0.250000 Br\n0.029282 0.514641 0.750000 Br\n0.514641 0.485359 0.250000 Br\n0.485359 0.514641 0.750000 Br\n",
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{
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{
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"structure_string": "Na4 Th12 F52\n1.0\n4.188699 -7.255039 0.000000\n4.188699 7.255039 0.000000\n0.000000 0.000000 16.876224\nNa Th F\n4 12 52\ndirect\n0.333333 0.666667 0.369802 Na\n0.666667 0.333333 0.630198 Na\n0.666667 0.333333 0.869802 Na\n0.333333 0.666667 0.130198 Na\n0.332508 0.166254 0.386676 Th\n0.833746 0.166254 0.386676 Th\n0.833746 0.667492 0.386676 Th\n0.667492 0.833746 0.613324 Th\n0.166254 0.833746 0.613324 Th\n0.166254 0.332508 0.613324 Th\n0.667492 0.833746 0.886676 Th\n0.166254 0.833746 0.886676 Th\n0.166254 0.332508 0.886676 Th\n0.332508 0.166254 0.113324 Th\n0.833746 0.166254 0.113324 Th\n0.833746 0.667492 0.113324 Th\n0.157147 0.314295 0.360778 F\n0.685705 0.842853 0.360778 F\n0.157147 0.842853 0.360778 F\n0.842853 0.685705 0.639222 F\n0.314295 0.157147 0.639222 F\n0.842853 0.157147 0.639222 F\n0.842853 0.685705 0.860778 F\n0.314295 0.157147 0.860778 F\n0.842853 0.157147 0.860778 F\n0.157147 0.314295 0.139222 F\n0.685705 0.842853 0.139222 F\n0.157147 0.842853 0.139222 F\n0.540886 0.081771 0.340532 F\n0.918229 0.459114 0.340532 F\n0.540886 0.459114 0.340532 F\n0.459114 0.918229 0.659468 F\n0.081771 0.540886 0.659468 F\n0.459114 0.540886 0.659468 F\n0.459114 0.918229 0.840532 F\n0.081771 0.540886 0.840532 F\n0.459114 0.540886 0.840532 F\n0.540886 0.081771 0.159468 F\n0.918229 0.459114 0.159468 F\n0.540886 0.459114 0.159468 F\n0.326932 0.326932 0.500000 F\n0.673068 0.000000 0.500000 F\n0.000000 0.673068 0.500000 F\n0.673068 0.673068 0.500000 F\n0.000000 0.326932 0.500000 F\n0.326932 0.000000 0.500000 F\n0.673068 0.673068 0.000000 F\n0.326932 0.000000 0.000000 F\n0.000000 0.326932 0.000000 F\n0.326932 0.326932 0.000000 F\n0.000000 0.673068 0.000000 F\n0.673068 0.000000 0.000000 F\n0.276180 0.138090 0.250000 F\n0.861910 0.138090 0.250000 F\n0.861910 0.723820 0.250000 F\n0.723820 0.861910 0.750000 F\n0.138090 0.861910 0.750000 F\n0.138090 0.276180 0.750000 F\n0.000000 0.000000 0.421657 F\n0.000000 0.000000 0.578343 F\n0.000000 0.000000 0.921657 F\n0.000000 0.000000 0.078343 F\n0.666667 0.333333 0.448290 F\n0.333333 0.666667 0.551710 F\n0.333333 0.666667 0.948290 F\n0.666667 0.333333 0.051710 F\n0.333333 0.666667 0.250000 F\n0.666667 0.333333 0.750000 F\n",
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"elements": [
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],
"chemical_system": "F-Na-Th",
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"formula_full": "Na4 Th12 F52",
"formula_reduced": "NaTh3F13",
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"updated_at": "2021-11-28T01:38:33.129000Z",
"spacegroup": 194
},
{
"id": "mp-1192940",
"created_at": "2022-09-04T14:48:06.829026Z",
"structure_string": "Gd6 Ni14 B4\n1.0\n5.108839 0.000000 0.000000\n-2.554420 4.440305 0.000000\n0.000000 0.000000 14.338485\nGd Ni B\n6 14 4\ndirect\n0.333471 0.666941 0.968943 Gd\n0.666529 0.333059 0.031057 Gd\n0.666529 0.333059 0.468943 Gd\n0.333471 0.666941 0.531057 Gd\n0.333273 0.666547 0.750000 Gd\n0.666727 0.333453 0.250000 Gd\n0.165455 0.834519 0.350069 Ni\n0.165450 0.330901 0.350010 Ni\n0.669064 0.834519 0.350069 Ni\n0.834545 0.165481 0.649931 Ni\n0.834550 0.669099 0.649990 Ni\n0.330936 0.165481 0.649931 Ni\n0.834545 0.165481 0.850069 Ni\n0.834550 0.669099 0.850010 Ni\n0.330936 0.165481 0.850069 Ni\n0.165455 0.834519 0.149931 Ni\n0.165450 0.330901 0.149990 Ni\n0.669064 0.834519 0.149931 Ni\n0.000000 0.000000 0.500000 Ni\n0.000000 0.000000 0.000000 Ni\n0.333390 0.666780 0.250000 B\n0.666610 0.333220 0.750000 B\n0.000019 0.000037 0.250000 B\n0.999981 0.999963 0.750000 B\n",
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"formula_full": "Gd6 Ni14 B4",
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"updated_at": "2021-11-28T01:38:31.064000Z",
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}
]
}