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{
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"structure_string": "Na6 Ga2\n1.0\n3.434042 -5.947935 0.000000\n3.434042 5.947935 0.000000\n0.000000 0.000000 5.673726\nNa Ga\n6 2\ndirect\n0.174130 0.348261 0.250000 Na\n0.651739 0.825870 0.250000 Na\n0.174130 0.825870 0.250000 Na\n0.825870 0.651739 0.750000 Na\n0.348261 0.174130 0.750000 Na\n0.825870 0.174130 0.750000 Na\n0.333333 0.666667 0.750000 Ga\n0.666667 0.333333 0.250000 Ga\n",
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{
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{
"id": "mp-1194731",
"created_at": "2022-09-04T14:47:03.167093Z",
"structure_string": "Cs4 Ba8 Sn4 S16 Cl4\n1.0\n8.974257 0.000000 0.000000\n0.000000 10.122176 0.000000\n0.000000 0.195707 12.780237\nCs Ba Sn S Cl\n4 8 4 16 4\ndirect\n0.084577 0.521923 0.171694 Cs\n0.584577 0.478077 0.328306 Cs\n0.915423 0.478077 0.828306 Cs\n0.415423 0.521923 0.671694 Cs\n0.092636 0.979592 0.177743 Ba\n0.592636 0.020408 0.322257 Ba\n0.907364 0.020408 0.822257 Ba\n0.407364 0.979592 0.677743 Ba\n0.101370 0.251845 0.477163 Ba\n0.601370 0.748155 0.022837 Ba\n0.898630 0.748155 0.522837 Ba\n0.398630 0.251845 0.977163 Ba\n0.812459 0.242476 0.099914 Sn\n0.312459 0.757524 0.400086 Sn\n0.187541 0.757524 0.900086 Sn\n0.687541 0.242476 0.599914 Sn\n0.174670 0.561011 0.440881 S\n0.674670 0.438989 0.059119 S\n0.825330 0.438989 0.559119 S\n0.325330 0.561011 0.940881 S\n0.871343 0.217828 0.283585 S\n0.371343 0.782172 0.216415 S\n0.128657 0.782172 0.716415 S\n0.628657 0.217828 0.783585 S\n0.158370 0.945738 0.437441 S\n0.658370 0.054262 0.062559 S\n0.841630 0.054262 0.562559 S\n0.341630 0.945738 0.937441 S\n0.037469 0.216895 0.000040 S\n0.537469 0.783105 0.499960 S\n0.962531 0.783105 0.999960 S\n0.462531 0.216895 0.500040 S\n0.828404 0.784508 0.274662 Cl\n0.328404 0.215492 0.225338 Cl\n0.171596 0.215492 0.725338 Cl\n0.671596 0.784508 0.774662 Cl\n",
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"volume": 1160.944061605996,
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"formula_full": "Cs4 Ba8 Sn4 S16 Cl4",
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"spacegroup": 14
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{
"id": "mp-1219797",
"created_at": "2022-09-04T14:47:09.427750Z",
"structure_string": "Ni6 Sn1 Te2\n1.0\n-1.897477 1.897477 9.681298\n1.897477 -1.897477 9.681298\n1.897477 1.897477 -9.681298\nNi Sn Te\n6 1 2\ndirect\n0.501075 0.501075 0.000000 Ni\n0.906556 0.406556 0.500000 Ni\n0.406556 0.906556 0.500000 Ni\n0.095409 0.595409 0.500000 Ni\n0.595409 0.095409 0.500000 Ni\n0.808853 0.808853 0.000000 Ni\n0.000351 0.000351 0.000000 Sn\n0.316225 0.316225 0.000000 Te\n0.679167 0.679167 0.000000 Te\n",
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"formula_full": "Ni6 Sn1 Te2",
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{
"id": "mp-16673",
"created_at": "2022-09-04T14:47:08.505546Z",
"structure_string": "Sm4 Mo20 O32\n1.0\n9.278038 0.000000 0.000000\n0.000000 8.386174 0.000000\n0.000000 3.534454 10.149530\nSm Mo O\n4 20 32\ndirect\n0.014882 0.694628 0.038383 Sm\n0.514882 0.305372 0.461617 Sm\n0.985118 0.305372 0.961617 Sm\n0.485118 0.694628 0.538383 Sm\n0.354127 0.990539 0.078129 Mo\n0.854127 0.009461 0.421871 Mo\n0.645873 0.009461 0.921871 Mo\n0.145873 0.990539 0.578129 Mo\n0.360567 0.203264 0.772093 Mo\n0.860567 0.796736 0.727907 Mo\n0.639433 0.796736 0.227907 Mo\n0.139433 0.203264 0.272093 Mo\n0.375207 0.801741 0.863611 Mo\n0.875207 0.198259 0.636389 Mo\n0.624793 0.198259 0.136389 Mo\n0.124793 0.801741 0.363611 Mo\n0.360934 0.597934 0.188560 Mo\n0.860934 0.402066 0.311440 Mo\n0.639066 0.402066 0.811440 Mo\n0.139066 0.597934 0.688560 Mo\n0.351796 0.390632 0.982016 Mo\n0.851796 0.609368 0.517984 Mo\n0.648204 0.609368 0.017984 Mo\n0.148204 0.390632 0.482016 Mo\n0.502020 0.580402 0.865712 O\n0.002020 0.419598 0.634288 O\n0.497980 0.419598 0.134288 O\n0.997980 0.580402 0.365712 O\n0.282121 0.375069 0.326587 O\n0.782121 0.624931 0.173413 O\n0.717879 0.624931 0.673413 O\n0.217879 0.375069 0.826587 O\n0.293741 0.792050 0.682106 O\n0.793741 0.207950 0.817894 O\n0.706259 0.207950 0.317894 O\n0.206259 0.792050 0.182106 O\n0.289553 0.190079 0.589749 O\n0.789553 0.809921 0.910251 O\n0.710447 0.809921 0.410251 O\n0.210447 0.190079 0.089749 O\n0.250832 0.603881 0.509533 O\n0.750832 0.396119 0.990467 O\n0.749168 0.396119 0.490467 O\n0.249168 0.603881 0.009533 O\n0.511284 0.012430 0.768564 O\n0.011284 0.987570 0.731436 O\n0.488716 0.987570 0.231436 O\n0.988716 0.012430 0.268564 O\n0.999281 0.594411 0.853975 O\n0.499281 0.405589 0.646025 O\n0.000719 0.405589 0.146025 O\n0.500719 0.594411 0.353975 O\n0.252805 0.990437 0.906509 O\n0.752805 0.009563 0.593491 O\n0.747195 0.009563 0.093491 O\n0.247195 0.990437 0.406509 O\n",
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{
"id": "mp-1043109",
"created_at": "2022-09-04T14:47:13.123029Z",
"structure_string": "Zn4 Fe4 Ni4 P8 O36\n1.0\n6.231245 0.000000 0.000000\n0.000000 7.386745 0.000000\n0.000000 0.000000 14.209686\nZn Fe Ni P O\n4 4 4 8 36\ndirect\n0.250000 0.929167 0.779242 Zn\n0.250000 0.570833 0.279242 Zn\n0.750000 0.070833 0.220758 Zn\n0.750000 0.429167 0.720758 Zn\n0.250000 0.353149 0.881755 Fe\n0.750000 0.646851 0.118245 Fe\n0.750000 0.853149 0.618245 Fe\n0.250000 0.146851 0.381755 Fe\n0.000000 0.000000 0.000000 Ni\n0.000000 0.500000 0.500000 Ni\n0.500000 0.500000 0.500000 Ni\n0.500000 0.000000 0.000000 Ni\n0.750000 0.357052 0.929208 P\n0.250000 0.642948 0.070792 P\n0.250000 0.857052 0.570792 P\n0.750000 0.142948 0.429208 P\n0.250000 0.379267 0.695228 P\n0.750000 0.620733 0.304772 P\n0.750000 0.879267 0.804772 P\n0.250000 0.120733 0.195228 P\n0.536863 0.609027 0.360773 O\n0.036863 0.390973 0.639227 O\n0.463137 0.109027 0.139227 O\n0.963137 0.890973 0.860773 O\n0.463137 0.390973 0.639227 O\n0.963137 0.609027 0.360773 O\n0.536863 0.890973 0.860773 O\n0.036863 0.109027 0.139227 O\n0.750000 0.334239 0.476590 O\n0.250000 0.665761 0.523410 O\n0.250000 0.834239 0.023410 O\n0.750000 0.165761 0.976590 O\n0.250000 0.131053 0.947633 O\n0.750000 0.868947 0.052367 O\n0.750000 0.631053 0.552367 O\n0.250000 0.368947 0.447633 O\n0.250000 0.200172 0.754711 O\n0.750000 0.799828 0.245289 O\n0.750000 0.700172 0.745289 O\n0.250000 0.299828 0.254711 O\n0.939169 0.128933 0.359746 O\n0.439169 0.871067 0.640254 O\n0.060831 0.628933 0.140254 O\n0.560831 0.371067 0.859746 O\n0.060831 0.871067 0.640254 O\n0.560831 0.128933 0.359746 O\n0.939169 0.371067 0.859746 O\n0.439169 0.628933 0.140254 O\n0.250000 0.969510 0.271980 O\n0.750000 0.030490 0.728020 O\n0.750000 0.469510 0.228020 O\n0.250000 0.530490 0.771980 O\n0.250000 0.002214 0.494971 O\n0.750000 0.997786 0.505029 O\n0.750000 0.502214 0.005029 O\n0.250000 0.497786 0.994971 O\n",
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"formula_full": "Zn4 Fe4 Ni4 P8 O36",
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{
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{
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"structure_string": "Ag6 Sb2 S6\n1.0\n4.528212 -6.107788 0.000000\n4.528212 6.107788 0.000000\n-3.710155 0.000000 6.636605\nAg Sb S\n6 2 6\ndirect\n0.953206 0.460084 0.880521 Ag\n0.380521 0.960084 0.453206 Ag\n0.880521 0.953206 0.460084 Ag\n0.453206 0.380521 0.960084 Ag\n0.460084 0.880521 0.953206 Ag\n0.960084 0.453206 0.380521 Ag\n0.401700 0.401700 0.401700 Sb\n0.901700 0.901700 0.901700 Sb\n0.682547 0.574509 0.322733 S\n0.822733 0.074509 0.182547 S\n0.322733 0.682547 0.574509 S\n0.182547 0.822733 0.074509 S\n0.574509 0.322733 0.682547 S\n0.074509 0.182547 0.822733 S\n",
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{
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"structure_string": "Sr4 Pr2 O8\n1.0\n3.734720 0.000000 0.000000\n0.000000 6.281526 0.000000\n0.000000 0.000000 10.387937\nSr Pr O\n4 2 8\ndirect\n0.500000 0.063976 0.322958 Sr\n0.500000 0.936024 0.677042 Sr\n0.500000 0.436024 0.822958 Sr\n0.500000 0.563976 0.177042 Sr\n0.000000 0.000000 0.000000 Pr\n0.000000 0.500000 0.500000 Pr\n0.000000 0.152158 0.794232 O\n0.000000 0.847842 0.205768 O\n0.000000 0.652158 0.705768 O\n0.000000 0.347842 0.294232 O\n0.500000 0.263479 0.543916 O\n0.500000 0.736521 0.456084 O\n0.500000 0.236521 0.043916 O\n0.500000 0.763479 0.956084 O\n",
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{
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{
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}