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{
"id": "mp-985437",
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{
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"structure_string": "Nd16 Ga8 O36\n1.0\n11.077742 0.000000 0.000000\n0.000000 7.817944 0.000000\n0.000000 3.793137 11.017009\nNd Ga O\n16 8 36\ndirect\n0.605898 0.477675 0.283325 Nd\n0.894102 0.477675 0.783325 Nd\n0.123260 0.335862 0.568172 Nd\n0.091097 0.023396 0.193877 Nd\n0.591097 0.976604 0.306123 Nd\n0.876740 0.664138 0.431828 Nd\n0.408903 0.023396 0.693877 Nd\n0.376740 0.335862 0.068172 Nd\n0.379987 0.834906 0.088857 Nd\n0.120013 0.834906 0.588857 Nd\n0.394102 0.522325 0.716675 Nd\n0.623260 0.664138 0.931828 Nd\n0.105898 0.522325 0.216675 Nd\n0.908903 0.976604 0.806123 Nd\n0.620013 0.165094 0.911143 Nd\n0.879987 0.165094 0.411143 Nd\n0.814507 0.783871 0.126170 Ga\n0.317173 0.656051 0.385810 Ga\n0.182827 0.656051 0.885810 Ga\n0.682827 0.343949 0.614190 Ga\n0.817173 0.343949 0.114190 Ga\n0.685493 0.783871 0.626170 Ga\n0.314507 0.216129 0.373830 Ga\n0.185493 0.216129 0.873830 Ga\n0.250805 0.432852 0.386761 O\n0.770220 0.361005 0.959849 O\n0.226956 0.785975 0.250699 O\n0.994078 0.077883 0.605284 O\n0.490438 0.566365 0.104057 O\n0.972638 0.297044 0.175372 O\n0.229040 0.234329 0.231661 O\n0.475746 0.216184 0.337537 O\n0.527362 0.297044 0.675372 O\n0.494078 0.922117 0.894716 O\n0.273044 0.785975 0.750699 O\n0.729040 0.765671 0.268339 O\n0.729780 0.361005 0.459849 O\n0.270960 0.234329 0.731661 O\n0.009562 0.566365 0.604057 O\n0.264365 0.074022 0.524960 O\n0.524254 0.783816 0.662463 O\n0.235635 0.074022 0.024960 O\n0.024254 0.216184 0.837537 O\n0.229780 0.638995 0.040151 O\n0.249195 0.432852 0.886761 O\n0.005922 0.922117 0.394716 O\n0.270220 0.638995 0.540151 O\n0.990438 0.433635 0.395943 O\n0.735635 0.925978 0.475040 O\n0.764365 0.925978 0.975040 O\n0.027362 0.702956 0.824628 O\n0.726956 0.214025 0.249301 O\n0.770960 0.765671 0.768339 O\n0.975746 0.783816 0.162463 O\n0.773044 0.214025 0.749301 O\n0.472638 0.702956 0.324628 O\n0.505922 0.077883 0.105284 O\n0.749195 0.567148 0.613239 O\n0.750805 0.567148 0.113239 O\n0.509562 0.433635 0.895943 O\n",
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"formula_full": "Nd16 Ga8 O36",
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{
"id": "mp-558387",
"created_at": "2022-09-04T14:40:18.328155Z",
"structure_string": "Te4 O4 F8\n1.0\n8.365482 0.000000 0.000000\n0.000000 5.455771 0.000000\n0.000000 0.637552 5.661372\nTe O F\n4 4 8\ndirect\n0.147453 0.480311 0.347808 Te\n0.910699 0.873003 0.964750 Te\n0.647453 0.519689 0.652192 Te\n0.410699 0.126997 0.035250 Te\n0.605618 0.305875 0.945188 O\n0.853158 0.605785 0.774654 O\n0.105618 0.694125 0.054812 O\n0.353158 0.394215 0.225346 O\n0.330876 0.341006 0.728614 F\n0.830876 0.658994 0.271386 F\n0.046366 0.002080 0.700838 F\n0.764859 0.233174 0.565010 F\n0.546366 0.997920 0.299162 F\n0.569471 0.807687 0.840456 F\n0.264859 0.766826 0.434990 F\n0.069471 0.192313 0.159544 F\n",
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{
"id": "mp-1186356",
"created_at": "2022-09-04T14:40:18.328104Z",
"structure_string": "Os3 Cl1\n1.0\n0.000000 3.105176 3.105176\n3.105176 0.000000 3.105176\n3.105176 3.105176 0.000000\nOs Cl\n3 1\ndirect\n0.750000 0.750000 0.750000 Os\n0.250000 0.250000 0.250000 Os\n0.500000 0.500000 0.500000 Os\n0.000000 0.000000 0.000000 Cl\n",
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{
"id": "mp-1193589",
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"structure_string": "Fe3 Ni20 B6\n1.0\n0.000000 5.233207 5.233207\n5.233207 0.000000 5.233207\n5.233207 5.233207 0.000000\nFe Ni B\n3 20 6\ndirect\n0.000000 0.000000 0.000000 Fe\n0.750000 0.750000 0.750000 Fe\n0.250000 0.250000 0.250000 Fe\n0.000000 0.000000 0.337801 Ni\n0.662199 0.000000 0.337801 Ni\n0.000000 0.662199 0.337801 Ni\n0.662199 0.337801 0.000000 Ni\n0.000000 0.337801 0.000000 Ni\n0.000000 0.337801 0.662199 Ni\n0.337801 0.662199 0.000000 Ni\n0.337801 0.000000 0.662199 Ni\n0.337801 0.000000 0.000000 Ni\n0.000000 0.000000 0.662199 Ni\n0.000000 0.662199 0.000000 Ni\n0.662199 0.000000 0.000000 Ni\n0.617302 0.617302 0.148094 Ni\n0.617302 0.148094 0.617302 Ni\n0.148094 0.617302 0.617302 Ni\n0.617302 0.617302 0.617302 Ni\n0.382698 0.382698 0.851906 Ni\n0.382698 0.851906 0.382698 Ni\n0.851906 0.382698 0.382698 Ni\n0.382698 0.382698 0.382698 Ni\n0.727978 0.727978 0.272022 B\n0.272022 0.727978 0.272022 B\n0.727978 0.272022 0.272022 B\n0.272022 0.272022 0.727978 B\n0.727978 0.272022 0.727978 B\n0.272022 0.727978 0.727978 B\n",
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{
"id": "mp-1100786",
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"structure_string": "Ni22 As16\n1.0\n4.888165 4.886695 0.000000\n-4.888165 4.886695 0.000000\n0.000000 2.416810 10.952790\nNi As\n22 16\ndirect\n0.466734 0.144692 0.907319 Ni\n0.855308 0.533266 0.592681 Ni\n0.533266 0.855308 0.092681 Ni\n0.144692 0.466734 0.407319 Ni\n0.084517 0.651194 0.907978 Ni\n0.348806 0.915483 0.592022 Ni\n0.915483 0.348806 0.092022 Ni\n0.651194 0.084517 0.407978 Ni\n0.460049 0.652097 0.907629 Ni\n0.347903 0.539951 0.592371 Ni\n0.539951 0.347903 0.092371 Ni\n0.652097 0.460049 0.407629 Ni\n0.802032 0.677723 0.786557 Ni\n0.322277 0.197968 0.713443 Ni\n0.197968 0.322277 0.213443 Ni\n0.677723 0.802032 0.286557 Ni\n0.078660 0.145172 0.906699 Ni\n0.854828 0.921340 0.593301 Ni\n0.145172 0.078660 0.406699 Ni\n0.921340 0.854828 0.093301 Ni\n0.810481 0.189519 0.750000 Ni\n0.189519 0.810481 0.250000 Ni\n0.749107 0.624149 0.001282 As\n0.375851 0.250893 0.498718 As\n0.250893 0.375851 0.998718 As\n0.624149 0.749107 0.501282 As\n0.873005 0.248109 0.508367 As\n0.751891 0.126995 0.991633 As\n0.126995 0.751891 0.491633 As\n0.248110 0.873005 0.008367 As\n0.067129 0.932871 0.750000 As\n0.932871 0.067129 0.250000 As\n0.557032 0.442968 0.750000 As\n0.442968 0.557032 0.250000 As\n0.556608 0.933928 0.749013 As\n0.066072 0.443392 0.750987 As\n0.443392 0.066072 0.250987 As\n0.933928 0.556608 0.249013 As\n",
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{
"id": "mp-772970",
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"structure_string": "Na12 Mn4 Si4 B4 O28\n1.0\n0.109655 0.000034 5.288854\n8.949653 0.000790 0.216797\n0.001139 12.945341 0.000058\nNa Mn Si B O\n12 4 4 4 28\ndirect\n0.767768 0.083151 0.125057 Na\n0.767761 0.083202 0.625043 Na\n0.232268 0.916821 0.374939 Na\n0.232266 0.916812 0.874970 Na\n0.254319 0.263058 0.005385 Na\n0.254342 0.263107 0.505382 Na\n0.254265 0.263143 0.244620 Na\n0.254263 0.263199 0.744623 Na\n0.745752 0.736822 0.255403 Na\n0.745652 0.736795 0.755399 Na\n0.745578 0.736894 0.494594 Na\n0.745683 0.736889 0.994625 Na\n0.783886 0.334553 0.874897 Mn\n0.216042 0.665513 0.624977 Mn\n0.783901 0.334523 0.374908 Mn\n0.216165 0.665524 0.125062 Mn\n0.721848 0.429389 0.125019 Si\n0.721738 0.429379 0.624980 Si\n0.278215 0.570624 0.374974 Si\n0.278150 0.570621 0.874996 Si\n0.723390 0.068374 0.374983 B\n0.723345 0.068374 0.874995 B\n0.276671 0.931611 0.125050 B\n0.276637 0.931618 0.625010 B\n0.314349 0.078107 0.125049 O\n0.314346 0.078169 0.625049 O\n0.685790 0.921850 0.374965 O\n0.685756 0.921850 0.875005 O\n0.959976 0.133789 0.375028 O\n0.959943 0.133785 0.875027 O\n0.040044 0.866213 0.125009 O\n0.040015 0.866238 0.624937 O\n0.531036 0.182556 0.374936 O\n0.530965 0.182544 0.874935 O\n0.469016 0.817420 0.125098 O\n0.468937 0.817424 0.625039 O\n0.415779 0.478595 0.125309 O\n0.415654 0.478583 0.625224 O\n0.584291 0.521459 0.374741 O\n0.584246 0.521424 0.874750 O\n0.110870 0.422630 0.375063 O\n0.110770 0.422604 0.875069 O\n0.889241 0.577373 0.124974 O\n0.889124 0.577365 0.624919 O\n0.786435 0.317841 0.025782 O\n0.786489 0.317845 0.525750 O\n0.787207 0.317651 0.224111 O\n0.787104 0.317664 0.724092 O\n0.212851 0.682379 0.275895 O\n0.212794 0.682328 0.775896 O\n0.213510 0.682150 0.474216 O\n0.213559 0.682167 0.974245 O\n",
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{
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{
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],
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"formula_full": "La2 Cr1 Mo1 O6",
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"formula_anonymous": "ABC2D6",
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{
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{
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"created_at": "2022-09-04T14:40:18.298692Z",
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"elements": [
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"volume": 348.3214137029186,
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"formula_full": "Pd2 Au4 F16",
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"spacegroup": 14
},
{
"id": "mp-1205512",
"created_at": "2022-09-04T14:40:18.297977Z",
"structure_string": "K1 Ba2 I1 O6\n1.0\n0.000000 4.372853 4.372853\n4.372853 0.000000 4.372853\n4.372853 4.372853 0.000000\nK Ba I O\n1 2 1 6\ndirect\n0.500000 0.500000 0.500000 K\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.000000 0.000000 0.000000 I\n0.782435 0.217565 0.217565 O\n0.217565 0.782435 0.782435 O\n0.217565 0.782435 0.217565 O\n0.782435 0.217565 0.782435 O\n0.217565 0.217565 0.782435 O\n0.782435 0.782435 0.217565 O\n",
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"formula_full": "K1 Ba2 I1 O6",
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]
}