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{
"id": "mp-1206321",
"created_at": "2022-09-04T14:48:28.318652Z",
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{
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{
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"formula_full": "Rb2 Li1 Dy1 Cl6",
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"formula_anonymous": "ABC2D6",
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{
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"created_at": "2022-09-04T14:44:10.984870Z",
"structure_string": "Ni8 C32 O32\n1.0\n11.023518 0.000000 0.000000\n0.000000 11.023518 0.000000\n0.000000 0.000000 11.023518\nNi C O\n8 32 32\ndirect\n0.378123 0.621877 0.121877 Ni\n0.621877 0.121877 0.378123 Ni\n0.121877 0.378123 0.621877 Ni\n0.878123 0.878123 0.878123 Ni\n0.621877 0.378123 0.878123 Ni\n0.378123 0.878123 0.621877 Ni\n0.878123 0.621877 0.378123 Ni\n0.121877 0.121877 0.121877 Ni\n0.284108 0.715892 0.215892 C\n0.715892 0.215892 0.284108 C\n0.215892 0.284108 0.715892 C\n0.784108 0.784108 0.784108 C\n0.715892 0.284108 0.784108 C\n0.284108 0.784108 0.715892 C\n0.784108 0.715892 0.284108 C\n0.215892 0.215892 0.215892 C\n0.283794 0.526049 0.030314 C\n0.716206 0.026049 0.469686 C\n0.216206 0.473951 0.530314 C\n0.783794 0.973951 0.969686 C\n0.030314 0.283794 0.526049 C\n0.469686 0.716206 0.026049 C\n0.530314 0.216206 0.473951 C\n0.969686 0.783794 0.973951 C\n0.526049 0.030314 0.283794 C\n0.026049 0.469686 0.716206 C\n0.473951 0.530314 0.216206 C\n0.973951 0.969686 0.783794 C\n0.716206 0.473951 0.969686 C\n0.283794 0.973951 0.530314 C\n0.783794 0.526049 0.469686 C\n0.216206 0.026049 0.030314 C\n0.969686 0.716206 0.473951 C\n0.530314 0.283794 0.973951 C\n0.469686 0.783794 0.526049 C\n0.030314 0.216206 0.026049 C\n0.473951 0.969686 0.716206 C\n0.973951 0.530314 0.283794 C\n0.526049 0.469686 0.783794 C\n0.026049 0.030314 0.216206 C\n0.223684 0.776316 0.276316 O\n0.776316 0.276316 0.223684 O\n0.276316 0.223684 0.776316 O\n0.723684 0.723684 0.723684 O\n0.776316 0.223684 0.723684 O\n0.223684 0.723684 0.776316 O\n0.723684 0.776316 0.223684 O\n0.276316 0.276316 0.276316 O\n0.223567 0.463866 0.971446 O\n0.776433 0.963866 0.528554 O\n0.276433 0.536134 0.471446 O\n0.723567 0.036134 0.028554 O\n0.971446 0.223567 0.463866 O\n0.528554 0.776433 0.963866 O\n0.471446 0.276433 0.536134 O\n0.028554 0.723567 0.036134 O\n0.463866 0.971446 0.223567 O\n0.963866 0.528554 0.776433 O\n0.536134 0.471446 0.276433 O\n0.036134 0.028554 0.723567 O\n0.776433 0.536134 0.028554 O\n0.223567 0.036134 0.471446 O\n0.723567 0.463866 0.528554 O\n0.276433 0.963866 0.971446 O\n0.028554 0.776433 0.536134 O\n0.471446 0.223567 0.036134 O\n0.528554 0.723567 0.463866 O\n0.971446 0.276433 0.963866 O\n0.536134 0.028554 0.776433 O\n0.036134 0.471446 0.223567 O\n0.463866 0.528554 0.723567 O\n0.963866 0.971446 0.276433 O\n",
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"formula_full": "Ni8 C32 O32",
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{
"id": "mp-560088",
"created_at": "2022-09-04T14:48:05.586173Z",
"structure_string": "Cs2 Li3 F5\n1.0\n2.067304 -10.206328 0.000000\n2.067304 10.206328 0.000000\n0.000000 0.000000 4.050390\nCs Li F\n2 3 5\ndirect\n0.731717 0.268283 0.000000 Cs\n0.381543 0.618457 0.500000 Cs\n0.576883 0.423117 0.000000 Li\n0.986110 0.013890 0.000000 Li\n0.122701 0.877299 0.500000 Li\n0.085188 0.914812 0.000000 F\n0.890113 0.109887 0.000000 F\n0.220045 0.779955 0.500000 F\n0.609393 0.390607 0.500000 F\n0.487038 0.512962 0.000000 F\n",
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{
"id": "mp-562779",
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"structure_string": "Er4 Co4 O12\n1.0\n5.125022 0.000000 0.000000\n0.000000 5.480152 0.000000\n0.000000 0.000000 7.362637\nEr Co O\n4 4 12\ndirect\n0.021793 0.923742 0.750000 Er\n0.478207 0.423742 0.750000 Er\n0.521793 0.576258 0.250000 Er\n0.978207 0.076258 0.250000 Er\n0.500000 0.000000 0.500000 Co\n0.500000 0.000000 0.000000 Co\n0.000000 0.500000 0.500000 Co\n0.000000 0.500000 0.000000 Co\n0.893847 0.531622 0.750000 O\n0.809996 0.803079 0.052474 O\n0.190004 0.196921 0.552474 O\n0.106153 0.468378 0.250000 O\n0.393847 0.968378 0.250000 O\n0.690004 0.303079 0.447526 O\n0.309996 0.696921 0.947526 O\n0.606153 0.031622 0.750000 O\n0.190004 0.196921 0.947526 O\n0.809996 0.803079 0.447526 O\n0.309996 0.696921 0.552474 O\n0.690004 0.303079 0.052474 O\n",
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{
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{
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"structure_string": "Ga40 Mo8 S1\n1.0\n2.671955 9.260567 0.000000\n-2.671955 9.260567 0.000000\n0.000000 0.064572 18.489501\nGa Mo S\n40 8 1\ndirect\n0.394562 0.394562 0.531694 Ga\n0.878759 0.878759 0.037502 Ga\n0.121241 0.121241 0.962498 Ga\n0.605438 0.605438 0.468306 Ga\n0.532197 0.532197 0.605011 Ga\n0.037997 0.037997 0.121693 Ga\n0.962003 0.962003 0.878307 Ga\n0.467803 0.467803 0.394989 Ga\n0.367564 0.367564 0.923377 Ga\n0.869258 0.869258 0.425516 Ga\n0.130742 0.130742 0.574484 Ga\n0.632436 0.632436 0.076623 Ga\n0.924613 0.924613 0.629331 Ga\n0.424051 0.424051 0.132607 Ga\n0.575949 0.575949 0.867393 Ga\n0.075387 0.075387 0.370669 Ga\n0.000000 0.500000 0.000000 Ga\n0.500000 0.000000 0.500000 Ga\n0.500000 0.000000 0.000000 Ga\n0.000000 0.500000 0.500000 Ga\n0.748512 0.253553 0.748167 Ga\n0.251488 0.746447 0.251833 Ga\n0.253553 0.748512 0.748167 Ga\n0.746447 0.251488 0.251833 Ga\n0.897956 0.400459 0.713286 Ga\n0.402809 0.897386 0.216131 Ga\n0.102614 0.597191 0.783869 Ga\n0.599541 0.102044 0.286714 Ga\n0.464886 0.963744 0.849283 Ga\n0.965793 0.463866 0.351429 Ga\n0.536134 0.034207 0.648571 Ga\n0.036256 0.535114 0.150717 Ga\n0.597191 0.102614 0.783869 Ga\n0.102044 0.599541 0.286714 Ga\n0.400459 0.897956 0.713286 Ga\n0.897386 0.402809 0.216131 Ga\n0.034207 0.536134 0.648571 Ga\n0.535114 0.036256 0.150717 Ga\n0.963744 0.464886 0.849283 Ga\n0.463866 0.965793 0.351429 Ga\n0.095180 0.095180 0.821555 Mo\n0.592962 0.592962 0.326598 Mo\n0.407038 0.407038 0.673402 Mo\n0.904820 0.904820 0.178445 Mo\n0.822126 0.822126 0.904065 Mo\n0.325613 0.325613 0.406881 Mo\n0.674387 0.674387 0.593119 Mo\n0.177874 0.177874 0.095935 Mo\n0.000000 0.000000 0.000000 S\n",
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],
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"spacegroup": 12
},
{
"id": "mp-760170",
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"structure_string": "Sn26 O20 F12\n1.0\n3.574345 7.551980 0.000000\n-3.574345 7.551980 0.000000\n0.000000 1.409041 22.993754\nSn O F\n26 20 12\ndirect\n0.130686 0.665089 0.293710 Sn\n0.726558 0.191669 0.014031 Sn\n0.771405 0.929417 0.417038 Sn\n0.993551 0.836141 0.134693 Sn\n0.160386 0.376251 0.437308 Sn\n0.407386 0.264372 0.154626 Sn\n0.665089 0.130686 0.793710 Sn\n0.191669 0.726558 0.514031 Sn\n0.929417 0.771405 0.917038 Sn\n0.836141 0.993551 0.634693 Sn\n0.376251 0.160386 0.937308 Sn\n0.735628 0.592614 0.345374 Sn\n0.264372 0.407386 0.654626 Sn\n0.623749 0.839614 0.062692 Sn\n0.163859 0.006449 0.365307 Sn\n0.070583 0.228595 0.082962 Sn\n0.808331 0.273442 0.485969 Sn\n0.334911 0.869314 0.206290 Sn\n0.592614 0.735628 0.845374 Sn\n0.839614 0.623749 0.562692 Sn\n0.006449 0.163859 0.865307 Sn\n0.778358 0.221642 0.250000 Sn\n0.228595 0.070583 0.582962 Sn\n0.273442 0.808331 0.985969 Sn\n0.869314 0.334911 0.706290 Sn\n0.221642 0.778358 0.750000 Sn\n0.021979 0.970866 0.441501 O\n0.962515 0.984078 0.316134 O\n0.970866 0.021979 0.941501 O\n0.984078 0.962515 0.816134 O\n0.971173 0.681372 0.482482 O\n0.951319 0.654857 0.361234 O\n0.667120 0.056129 0.098034 O\n0.681372 0.971173 0.982482 O\n0.654857 0.951319 0.861234 O\n0.056129 0.667120 0.598034 O\n0.943871 0.332880 0.401966 O\n0.345143 0.048681 0.138766 O\n0.318628 0.028827 0.017518 O\n0.332880 0.943871 0.901966 O\n0.048681 0.345143 0.638766 O\n0.028827 0.318628 0.517518 O\n0.015922 0.037485 0.183866 O\n0.029134 0.978021 0.058499 O\n0.037485 0.015922 0.683866 O\n0.978021 0.029134 0.558499 O\n0.336074 0.590268 0.358572 F\n0.590268 0.336074 0.858572 F\n0.697569 0.015154 0.223952 F\n0.232006 0.385284 0.070985 F\n0.015154 0.697569 0.723952 F\n0.614716 0.767994 0.429015 F\n0.385284 0.232006 0.570985 F\n0.984846 0.302431 0.276048 F\n0.767994 0.614716 0.929015 F\n0.302431 0.984846 0.776048 F\n0.409732 0.663926 0.141428 F\n0.663926 0.409732 0.641428 F\n",
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"formula_full": "Sn26 O20 F12",
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"spacegroup": 15
},
{
"id": "mp-1096825",
"created_at": "2022-09-04T14:46:42.788231Z",
"structure_string": "B6 Pb1\n1.0\n4.221809 0.000000 0.000000\n0.000000 4.221809 0.000000\n0.000000 0.000000 4.221809\nB Pb\n6 1\ndirect\n0.203003 0.500000 0.500000 B\n0.500000 0.500000 0.796997 B\n0.500000 0.500000 0.203003 B\n0.500000 0.203003 0.500000 B\n0.500000 0.796997 0.500000 B\n0.796997 0.500000 0.500000 B\n0.000000 0.000000 0.000000 Pb\n",
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],
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{
"id": "mp-731160",
"created_at": "2022-09-04T14:43:51.905628Z",
"structure_string": "H6 Ru6 Rh2 C24 O24\n1.0\n8.392743 0.000000 0.000000\n3.367367 8.710409 0.000000\n2.306597 1.025743 13.612596\nH Ru Rh C O\n6 6 2 24 24\ndirect\n0.614648 0.856608 0.383867 H\n0.385352 0.143392 0.616133 H\n0.800992 0.578453 0.361198 H\n0.199008 0.421547 0.638802 H\n0.496814 0.683499 0.309613 H\n0.503186 0.316501 0.690387 H\n0.487139 0.879522 0.284157 Ru\n0.512861 0.120478 0.715843 Ru\n0.838104 0.758576 0.340379 Ru\n0.161896 0.241424 0.659621 Ru\n0.702287 0.550175 0.263287 Ru\n0.297713 0.449825 0.736713 Ru\n0.780687 0.789718 0.143657 Rh\n0.219313 0.210282 0.856343 Rh\n0.806600 0.987947 0.113472 C\n0.193400 0.012053 0.886528 C\n0.655432 0.792446 0.039616 C\n0.344568 0.207554 0.960384 C\n0.003874 0.657954 0.090084 C\n0.996126 0.342046 0.909916 C\n0.472460 0.089621 0.261323 C\n0.527540 0.910379 0.738677 C\n0.341125 0.899820 0.188056 C\n0.658875 0.100180 0.811944 C\n0.305189 0.909129 0.390987 C\n0.694811 0.090871 0.609013 C\n0.852122 0.723980 0.478298 C\n0.147878 0.276020 0.521702 C\n0.073984 0.642901 0.301423 C\n0.926016 0.357099 0.698577 C\n0.873245 0.951864 0.323046 C\n0.126755 0.048136 0.676954 C\n0.592315 0.514831 0.163195 C\n0.407685 0.485169 0.836805 C\n0.622247 0.420055 0.362403 C\n0.377753 0.579945 0.637597 C\n0.917173 0.398438 0.219673 C\n0.082827 0.601562 0.780327 C\n0.826491 0.104932 0.090742 O\n0.173509 0.895068 0.909258 O\n0.586003 0.798556 0.972653 O\n0.413997 0.201444 0.027347 O\n0.134845 0.581950 0.050875 O\n0.865155 0.418050 0.949125 O\n0.462377 0.217596 0.250002 O\n0.537623 0.782404 0.749998 O\n0.246622 0.912224 0.132529 O\n0.753378 0.087776 0.867471 O\n0.191829 0.927065 0.454432 O\n0.808171 0.072935 0.545568 O\n0.864295 0.700486 0.561716 O\n0.135705 0.299514 0.438284 O\n0.218463 0.570364 0.281683 O\n0.781537 0.429636 0.718317 O\n0.895870 0.068759 0.314043 O\n0.104130 0.931241 0.685957 O\n0.523789 0.491868 0.103945 O\n0.476211 0.508132 0.896055 O\n0.567604 0.345577 0.422889 O\n0.432396 0.654423 0.577111 O\n0.047602 0.304703 0.194391 O\n0.952398 0.695297 0.805609 O\n",
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"volume": 995.1382694092064,
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"formula_full": "H6 Ru6 Rh2 C24 O24",
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}
]
}