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{
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"structure_string": "Nb20 Ge12 N36\n1.0\n6.818246 -0.380923 0.000000\n-7.672235 7.156193 0.000000\n0.000000 0.000000 20.800488\nNb Ge N\n20 12 36\ndirect\n0.000000 0.456459 0.860913 Nb\n0.000000 0.543541 0.139087 Nb\n0.000000 0.043541 0.360913 Nb\n0.000000 0.956459 0.639087 Nb\n0.325084 0.854536 0.892366 Nb\n0.325084 0.470548 0.107634 Nb\n0.325084 0.970548 0.392366 Nb\n0.325084 0.354536 0.607634 Nb\n0.674916 0.145464 0.107634 Nb\n0.674916 0.529452 0.892366 Nb\n0.674916 0.029452 0.607634 Nb\n0.674916 0.645464 0.392366 Nb\n0.000000 0.441055 0.592671 Nb\n0.000000 0.558945 0.407329 Nb\n0.000000 0.058945 0.092671 Nb\n0.000000 0.941055 0.907329 Nb\n0.589390 0.294694 0.000000 Nb\n0.589390 0.794694 0.500000 Nb\n0.410610 0.705306 0.000000 Nb\n0.410610 0.205306 0.500000 Nb\n0.000000 0.767786 0.067847 Ge\n0.000000 0.232214 0.932153 Ge\n0.000000 0.732214 0.567847 Ge\n0.000000 0.267786 0.432153 Ge\n0.000000 0.186493 0.743972 Ge\n0.000000 0.813507 0.256028 Ge\n0.000000 0.313507 0.243972 Ge\n0.000000 0.686493 0.756028 Ge\n0.500000 0.694132 0.750000 Ge\n0.500000 0.805868 0.250000 Ge\n0.500000 0.305868 0.250000 Ge\n0.500000 0.194132 0.750000 Ge\n0.000000 0.311453 0.665906 N\n0.000000 0.688547 0.334094 N\n0.000000 0.188547 0.165906 N\n0.000000 0.811453 0.834094 N\n0.000000 0.278061 0.836664 N\n0.000000 0.721939 0.163336 N\n0.000000 0.221939 0.336664 N\n0.000000 0.778061 0.663336 N\n0.678439 0.400677 0.810716 N\n0.678439 0.277762 0.189284 N\n0.678439 0.777762 0.310716 N\n0.678439 0.900677 0.689284 N\n0.321561 0.599323 0.189284 N\n0.321561 0.722238 0.810716 N\n0.321561 0.222238 0.689284 N\n0.321561 0.099323 0.310716 N\n0.395309 0.054814 0.941792 N\n0.395309 0.340495 0.058208 N\n0.395309 0.840495 0.441792 N\n0.395309 0.554814 0.558208 N\n0.604691 0.945186 0.058208 N\n0.604691 0.659505 0.941792 N\n0.604691 0.159505 0.558208 N\n0.604691 0.445186 0.441792 N\n0.301350 0.051777 0.072596 N\n0.301350 0.249572 0.927404 N\n0.301350 0.749572 0.572596 N\n0.301350 0.551778 0.427404 N\n0.698650 0.948222 0.927404 N\n0.698650 0.750428 0.072596 N\n0.698650 0.250428 0.427404 N\n0.698650 0.448223 0.572596 N\n0.000000 0.589023 0.946257 N\n0.000000 0.410977 0.053743 N\n0.000000 0.910977 0.446257 N\n0.000000 0.089023 0.553743 N\n",
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"spacegroup": 64
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{
"id": "mp-776113",
"created_at": "2022-09-04T14:48:16.790544Z",
"structure_string": "Li8 Ti1 Mn7 P12 O48\n1.0\n8.563246 0.000000 0.000000\n0.214062 8.829878 0.000000\n0.023430 0.012955 11.987442\nLi Ti Mn P O\n8 1 7 12 48\ndirect\n0.214699 0.276583 0.819554 Li\n0.216281 0.220730 0.181595 Li\n0.282580 0.780021 0.680758 Li\n0.284212 0.724859 0.317294 Li\n0.715786 0.275825 0.681807 Li\n0.716818 0.221196 0.317855 Li\n0.782875 0.779065 0.819194 Li\n0.784094 0.723593 0.179653 Li\n0.753614 0.537855 0.387330 Ti\n0.250044 0.035747 0.386215 Mn\n0.248063 0.461948 0.613558 Mn\n0.251536 0.964009 0.885307 Mn\n0.251887 0.537033 0.112263 Mn\n0.748166 0.461997 0.886413 Mn\n0.749392 0.035015 0.113376 Mn\n0.751122 0.964657 0.614572 Mn\n0.036819 0.748627 0.500517 P\n0.464787 0.252065 0.999723 P\n0.534248 0.746272 0.000690 P\n0.967091 0.250858 0.499857 P\n0.106235 0.606153 0.851488 P\n0.105359 0.894350 0.143489 P\n0.392815 0.394287 0.351732 P\n0.395965 0.105186 0.647693 P\n0.605223 0.897083 0.354600 P\n0.604122 0.605999 0.650162 P\n0.894832 0.395608 0.145806 P\n0.895167 0.104682 0.853141 P\n0.060002 0.357112 0.575719 O\n0.061011 0.143697 0.424043 O\n0.075796 0.103660 0.841416 O\n0.076105 0.398881 0.155793 O\n0.140770 0.829062 0.417445 O\n0.143204 0.657722 0.584345 O\n0.155592 0.561145 0.970704 O\n0.153079 0.933654 0.024954 O\n0.157710 0.763858 0.817841 O\n0.160109 0.730630 0.177101 O\n0.180122 0.482223 0.773110 O\n0.175251 0.012619 0.222599 O\n0.325874 0.986358 0.728457 O\n0.320241 0.518687 0.273101 O\n0.342120 0.237160 0.317488 O\n0.341256 0.268896 0.680406 O\n0.343662 0.438207 0.471465 O\n0.345226 0.061139 0.531496 O\n0.357471 0.168256 0.919657 O\n0.356225 0.341799 0.083817 O\n0.424188 0.897877 0.343426 O\n0.423474 0.603445 0.657468 O\n0.441312 0.855084 0.925502 O\n0.439880 0.639716 0.075956 O\n0.558070 0.358032 0.923691 O\n0.559002 0.143650 0.074673 O\n0.574164 0.402167 0.344730 O\n0.576886 0.103862 0.659447 O\n0.642124 0.657251 0.915766 O\n0.640053 0.829025 0.081940 O\n0.653803 0.938976 0.472260 O\n0.657865 0.563391 0.529924 O\n0.656778 0.763425 0.682395 O\n0.660526 0.732713 0.324251 O\n0.678066 0.481565 0.727231 O\n0.676762 0.014140 0.274115 O\n0.824887 0.985727 0.773216 O\n0.823794 0.518200 0.226354 O\n0.839942 0.267988 0.820181 O\n0.843338 0.238522 0.181131 O\n0.845062 0.438436 0.026574 O\n0.845002 0.061742 0.970363 O\n0.857350 0.344495 0.418558 O\n0.858006 0.169001 0.579723 O\n0.923975 0.894711 0.154884 O\n0.925179 0.603269 0.841991 O\n0.942390 0.857723 0.574664 O\n0.933465 0.639800 0.432988 O\n",
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"formula_full": "Li8 Ti1 Mn7 P12 O48",
"formula_reduced": "Li8TiMn7(PO4)12",
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{
"id": "mp-766682",
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"structure_string": "Li6 V8 P12 O48\n1.0\n8.426687 0.000000 0.000000\n-0.023377 8.719976 0.000000\n-0.134422 -0.042346 11.957895\nLi V P O\n6 8 12 48\ndirect\n0.809803 0.214199 0.820497 Li\n0.683137 0.712554 0.680183 Li\n0.570013 0.407924 0.195521 Li\n0.184915 0.786624 0.179961 Li\n0.083449 0.087706 0.690413 Li\n0.076313 0.504342 0.343767 Li\n0.747498 0.974386 0.111392 V\n0.751001 0.533664 0.890021 V\n0.744795 0.474957 0.394291 V\n0.742004 0.032463 0.606113 V\n0.252353 0.969786 0.387270 V\n0.245182 0.527452 0.614989 V\n0.246294 0.465014 0.112156 V\n0.257366 0.026102 0.891768 V\n0.968852 0.751592 0.507753 P\n0.883592 0.618478 0.149207 P\n0.885196 0.892800 0.854454 P\n0.608607 0.114483 0.345635 P\n0.613281 0.391153 0.647411 P\n0.537256 0.249836 0.991210 P\n0.463901 0.751320 0.007636 P\n0.385961 0.612904 0.358634 P\n0.391244 0.881107 0.647190 P\n0.112946 0.109627 0.145277 P\n0.108441 0.382276 0.848545 P\n0.038598 0.247768 0.491817 P\n0.935160 0.099143 0.108578 O\n0.941615 0.129957 0.559642 O\n0.945625 0.333042 0.400981 O\n0.930138 0.414758 0.822437 O\n0.911866 0.637509 0.417906 O\n0.871712 0.793631 0.156661 O\n0.858150 0.569224 0.023215 O\n0.865972 0.006557 0.751907 O\n0.830431 0.731043 0.816995 O\n0.821811 0.823896 0.566701 O\n0.765394 0.528173 0.220494 O\n0.777662 0.955274 0.946664 O\n0.722015 0.021529 0.272863 O\n0.724010 0.449460 0.556069 O\n0.680273 0.323333 0.929353 O\n0.663625 0.227300 0.682973 O\n0.650805 0.075837 0.472776 O\n0.624520 0.289407 0.332391 O\n0.639736 0.504350 0.748405 O\n0.606773 0.141866 0.080917 O\n0.568747 0.836984 0.096154 O\n0.569087 0.917297 0.675404 O\n0.556977 0.619630 0.399645 O\n0.562939 0.629755 0.947573 O\n0.450436 0.372379 0.058024 O\n0.436583 0.399076 0.611741 O\n0.436060 0.067046 0.323947 O\n0.430632 0.169728 0.901746 O\n0.397231 0.860518 0.916684 O\n0.372463 0.506476 0.254619 O\n0.377729 0.705949 0.661367 O\n0.360827 0.929334 0.526010 O\n0.320730 0.773836 0.322061 O\n0.320708 0.679980 0.067909 O\n0.267042 0.550832 0.446847 O\n0.278836 0.974117 0.724325 O\n0.220844 0.052186 0.048918 O\n0.217145 0.475831 0.770963 O\n0.178179 0.161499 0.436865 O\n0.156754 0.273398 0.179026 O\n0.137813 0.993288 0.241633 O\n0.144348 0.423406 0.969470 O\n0.126118 0.204253 0.829916 O\n0.110205 0.353653 0.583246 O\n0.056991 0.581528 0.185601 O\n0.069498 0.668067 0.600306 O\n0.064803 0.875959 0.449638 O\n0.062749 0.897852 0.887922 O\n",
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{
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{
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