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{
"id": "mp-1209335",
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{
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"created_at": "2022-09-04T14:40:22.075260Z",
"structure_string": "Li6 V6 P16 O58\n1.0\n9.777764 0.000000 0.000000\n4.878806 8.486449 0.000000\n0.075305 0.052664 14.109180\nLi V P O\n6 6 16 58\ndirect\n0.086915 0.689074 0.055024 Li\n0.225255 0.085167 0.055186 Li\n0.307016 0.913018 0.447979 Li\n0.684777 0.086933 0.563548 Li\n0.774182 0.318274 0.445401 Li\n0.905120 0.319510 0.938407 Li\n0.003844 0.433756 0.741910 V\n0.429481 0.569056 0.751204 V\n0.438448 0.998712 0.248977 V\n0.570768 0.994814 0.756864 V\n0.563220 0.432108 0.243408 V\n0.997060 0.570469 0.257645 V\n0.085466 0.681510 0.840686 P\n0.233244 0.683285 0.342813 P\n0.087907 0.227792 0.341105 P\n0.341526 0.329781 0.629578 P\n0.326740 0.335567 0.129688 P\n0.227376 0.090986 0.840491 P\n0.319954 0.912157 0.660516 P\n0.683194 0.230432 0.841638 P\n0.314892 0.771328 0.157589 P\n0.682716 0.088982 0.341678 P\n0.774360 0.914136 0.157637 P\n0.669344 0.659217 0.870275 P\n0.662384 0.664468 0.370219 P\n0.914172 0.773803 0.657063 P\n0.767051 0.319852 0.658978 P\n0.914349 0.321120 0.158768 P\n0.000361 0.764215 0.569317 O\n0.089641 0.655991 0.334915 O\n0.210828 0.792322 0.250868 O\n0.234976 0.760071 0.072001 O\n0.093671 0.521609 0.819047 O\n0.254427 0.657411 0.831892 O\n0.181032 0.485715 0.171609 O\n0.096210 0.381837 0.323937 O\n0.997263 0.248300 0.067911 O\n0.080925 0.258746 0.835931 O\n0.340448 0.476354 0.675831 O\n0.187676 0.333681 0.672915 O\n0.385277 0.523067 0.321598 O\n0.340456 0.331896 0.524405 O\n0.328761 0.332665 0.024757 O\n0.523907 0.383504 0.825379 O\n0.327925 0.183298 0.171586 O\n0.477555 0.335082 0.174182 O\n0.256686 0.082351 0.339779 O\n0.207909 0.003156 0.750153 O\n0.237500 0.009713 0.931550 O\n0.248368 0.992901 0.570027 O\n0.380921 0.099292 0.821665 O\n0.490154 0.179068 0.669711 O\n0.661382 0.257140 0.334476 O\n0.338634 0.917237 0.160353 O\n0.520756 0.098036 0.318577 O\n0.242464 0.762233 0.428931 O\n0.758573 0.243601 0.568842 O\n0.479032 0.905970 0.681045 O\n0.655667 0.087355 0.835769 O\n0.787591 0.205865 0.746150 O\n0.344255 0.743702 0.668686 O\n0.512679 0.816239 0.327489 O\n0.619191 0.904981 0.179838 O\n0.760176 0.001708 0.070269 O\n0.744724 0.013233 0.434462 O\n0.794306 0.994806 0.253807 O\n0.743322 0.918167 0.663190 O\n0.521902 0.660707 0.825379 O\n0.477821 0.618453 0.176013 O\n0.666233 0.812663 0.826485 O\n0.662484 0.668235 0.475169 O\n0.667658 0.661941 0.975459 O\n0.616106 0.478508 0.675974 O\n0.812803 0.666097 0.325697 O\n0.666614 0.514140 0.329615 O\n0.918627 0.743703 0.163858 O\n0.992070 0.794742 0.753211 O\n0.007989 0.748625 0.932623 O\n0.904595 0.619162 0.676331 O\n0.819975 0.511700 0.829549 O\n0.745799 0.344520 0.166537 O\n0.907163 0.479327 0.179644 O\n0.769976 0.235496 0.925829 O\n0.912369 0.343049 0.664643 O\n0.992474 0.238838 0.425371 O\n0.009608 0.205233 0.245347 O\n",
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{
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"structure_string": "Mn6 O7 F5\n1.0\n5.535940 0.000000 0.000000\n1.761520 5.295320 0.000000\n2.267657 1.450879 6.852726\nMn O F\n6 7 5\ndirect\n0.686079 0.693494 0.837950 Mn\n0.338639 0.337575 0.674115 Mn\n0.679439 0.610822 0.311688 Mn\n0.329180 0.333078 0.164389 Mn\n0.990669 0.983224 0.502717 Mn\n0.975985 0.044662 0.998975 Mn\n0.025226 0.643658 0.672173 O\n0.226141 0.250065 0.958414 O\n0.771185 0.797035 0.025940 O\n0.430414 0.412967 0.381236 O\n0.973283 0.321642 0.328414 O\n0.645061 0.030532 0.673170 O\n0.683069 0.344691 0.002969 O\n0.365653 0.922729 0.339016 F\n0.892416 0.849968 0.305767 F\n0.573256 0.577287 0.642117 F\n0.112658 0.105629 0.690686 F\n0.301645 0.740944 0.990261 F\n",
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{
"id": "mp-554280",
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"structure_string": "Rb2 Th4 P6 O24\n1.0\n3.479374 8.985716 0.000000\n-3.479374 8.985716 0.000000\n0.000000 1.789349 8.044177\nRb Th P O\n2 4 6 24\ndirect\n0.405762 0.594238 0.750000 Rb\n0.594238 0.405762 0.250000 Rb\n0.060133 0.248712 0.466481 Th\n0.248712 0.060133 0.966481 Th\n0.751288 0.939867 0.033519 Th\n0.939867 0.751288 0.533519 Th\n0.600311 0.783455 0.317785 P\n0.399689 0.216545 0.682215 P\n0.094808 0.905192 0.250000 P\n0.216545 0.399689 0.182215 P\n0.905192 0.094808 0.750000 P\n0.783455 0.600311 0.817785 P\n0.261602 0.449130 0.650356 O\n0.757058 0.188222 0.909442 O\n0.602835 0.087549 0.571314 O\n0.448092 0.143501 0.870382 O\n0.449130 0.261602 0.150356 O\n0.040681 0.102311 0.256723 O\n0.959319 0.897689 0.743277 O\n0.897689 0.959319 0.243277 O\n0.856499 0.551908 0.629618 O\n0.242942 0.811778 0.090558 O\n0.828948 0.723826 0.830444 O\n0.738398 0.550870 0.349644 O\n0.912451 0.397165 0.928686 O\n0.188222 0.757058 0.409442 O\n0.811778 0.242942 0.590558 O\n0.087549 0.602835 0.071314 O\n0.551908 0.856499 0.129618 O\n0.143501 0.448092 0.370382 O\n0.171052 0.276174 0.169556 O\n0.550870 0.738398 0.849644 O\n0.276174 0.171052 0.669556 O\n0.102311 0.040681 0.756723 O\n0.397165 0.912451 0.428686 O\n0.723826 0.828948 0.330444 O\n",
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{
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{
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{
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{
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{
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{
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"structure_string": "Rb4 U12 Pt8 Se34\n1.0\n10.659916 0.000000 0.000000\n0.000000 10.659916 0.000000\n0.000000 0.000000 13.635931\nRb U Pt Se\n4 12 8 34\ndirect\n0.500000 0.500000 0.236020 Rb\n0.000000 0.000000 0.736020 Rb\n0.500000 0.500000 0.763980 Rb\n0.000000 0.000000 0.263980 Rb\n0.000000 0.500000 0.250000 U\n0.500000 0.000000 0.750000 U\n0.500000 0.000000 0.250000 U\n0.000000 0.500000 0.750000 U\n0.621134 0.744950 0.500000 U\n0.378866 0.255050 0.500000 U\n0.878866 0.244950 0.000000 U\n0.121134 0.755050 0.000000 U\n0.744950 0.378866 0.500000 U\n0.255050 0.621134 0.500000 U\n0.244950 0.121134 0.000000 U\n0.755050 0.878866 0.000000 U\n0.930528 0.637975 0.500000 Pt\n0.069472 0.362025 0.500000 Pt\n0.569472 0.137975 0.000000 Pt\n0.430528 0.862025 0.000000 Pt\n0.637975 0.069472 0.500000 Pt\n0.362025 0.930528 0.500000 Pt\n0.137975 0.430528 0.000000 Pt\n0.862025 0.569472 0.000000 Pt\n0.774716 0.590721 0.366608 Se\n0.225284 0.409279 0.366608 Se\n0.725284 0.090721 0.866608 Se\n0.274716 0.909279 0.866608 Se\n0.590721 0.225284 0.366608 Se\n0.409279 0.774716 0.366608 Se\n0.090721 0.274716 0.866608 Se\n0.909279 0.725284 0.866608 Se\n0.225284 0.409279 0.633392 Se\n0.774716 0.590721 0.633392 Se\n0.274716 0.909279 0.133392 Se\n0.725284 0.090721 0.133392 Se\n0.409279 0.774716 0.633392 Se\n0.590721 0.225284 0.633392 Se\n0.909279 0.725284 0.133392 Se\n0.090721 0.274716 0.133392 Se\n0.574206 0.784538 0.131811 Se\n0.425794 0.215462 0.131811 Se\n0.925794 0.284538 0.631811 Se\n0.074206 0.715462 0.631811 Se\n0.784538 0.425794 0.131811 Se\n0.215462 0.574206 0.131811 Se\n0.284538 0.074206 0.631811 Se\n0.715462 0.925794 0.631811 Se\n0.425794 0.215462 0.868189 Se\n0.574206 0.784538 0.868189 Se\n0.074206 0.715462 0.368189 Se\n0.925794 0.284538 0.368189 Se\n0.215462 0.574206 0.868189 Se\n0.784538 0.425794 0.868189 Se\n0.715462 0.925794 0.368189 Se\n0.284538 0.074206 0.368189 Se\n0.500000 0.500000 0.500000 Se\n0.000000 0.000000 0.000000 Se\n",
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"formula_full": "Rb4 U12 Pt8 Se34",
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"spacegroup": 128
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{
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"created_at": "2022-09-04T14:40:22.156934Z",
"structure_string": "Ce2 Co4\n1.0\n0.000000 3.534599 3.534599\n3.534599 0.000000 3.534599\n3.534599 3.534599 0.000000\nCe Co\n2 4\ndirect\n0.750000 0.750000 0.750000 Ce\n0.500000 0.500000 0.500000 Ce\n0.125000 0.125000 0.625000 Co\n0.125000 0.625000 0.125000 Co\n0.125000 0.125000 0.125000 Co\n0.625000 0.125000 0.125000 Co\n",
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"formula_full": "Ce2 Co4",
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{
"id": "mp-1181977",
"created_at": "2022-09-04T14:40:18.251275Z",
"structure_string": "Ca4 Ti8 O24\n1.0\n8.979032 0.000000 0.000000\n0.000000 5.225249 0.000000\n0.000000 0.017485 10.030469\nCa Ti O\n4 8 24\ndirect\n0.996211 0.507193 0.249614 Ca\n0.496211 0.992807 0.750386 Ca\n0.003789 0.492807 0.750386 Ca\n0.503789 0.007193 0.249614 Ca\n0.661873 0.507790 0.490498 Ti\n0.161873 0.992210 0.509502 Ti\n0.338127 0.492210 0.509502 Ti\n0.838127 0.007790 0.490498 Ti\n0.677331 0.500766 0.988440 Ti\n0.177331 0.999234 0.011560 Ti\n0.322669 0.499234 0.011560 Ti\n0.822669 0.000766 0.988440 Ti\n0.999429 0.870188 0.391479 O\n0.499429 0.629812 0.608521 O\n0.000571 0.129812 0.608521 O\n0.500571 0.370188 0.391479 O\n0.496134 0.358569 0.896501 O\n0.996134 0.141431 0.103499 O\n0.503866 0.641431 0.103499 O\n0.003866 0.858569 0.896501 O\n0.318286 0.188227 0.114603 O\n0.818286 0.311773 0.885397 O\n0.681714 0.811773 0.885397 O\n0.181714 0.688227 0.114603 O\n0.823094 0.675930 0.603687 O\n0.323094 0.824070 0.396313 O\n0.176906 0.324070 0.396313 O\n0.676906 0.175930 0.603687 O\n0.820115 0.330924 0.398093 O\n0.320115 0.169076 0.601907 O\n0.179885 0.669076 0.601907 O\n0.679885 0.830924 0.398093 O\n0.324806 0.813503 0.903630 O\n0.824806 0.686497 0.096370 O\n0.675194 0.186497 0.096370 O\n0.175194 0.313503 0.903630 O\n",
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]
}