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{
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{
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{
"id": "mp-755266",
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"structure_string": "Li4 Ti3 O8\n1.0\n2.979544 5.098226 0.000000\n-2.979544 5.098226 0.000000\n0.000000 3.520961 4.867633\nLi Ti O\n4 3 8\ndirect\n0.500000 0.500000 0.500000 Li\n0.000000 0.500000 0.000000 Li\n0.500000 0.000000 0.000000 Li\n0.000000 0.000000 0.000000 Li\n0.000000 0.500000 0.500000 Ti\n0.500000 0.000000 0.500000 Ti\n0.000000 0.000000 0.500000 Ti\n0.242709 0.242709 0.273949 O\n0.250105 0.250105 0.719408 O\n0.245332 0.783579 0.714755 O\n0.216421 0.754668 0.285245 O\n0.754668 0.216421 0.285245 O\n0.783579 0.245332 0.714755 O\n0.749895 0.749895 0.280592 O\n0.757291 0.757291 0.726051 O\n",
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{
"id": "mp-1035613",
"created_at": "2022-09-04T14:42:49.503254Z",
"structure_string": "Li1 Mg14 W1 O16\n1.0\n8.561173 0.000000 0.000000\n0.000000 8.608758 0.000000\n0.000000 0.000000 4.280565\nLi Mg W O\n1 14 1 16\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.000000 0.000000 Mg\n0.500000 0.500000 0.000000 Mg\n0.000000 0.233614 0.500000 Mg\n0.000000 0.766386 0.500000 Mg\n0.500000 0.247006 0.500000 Mg\n0.500000 0.752994 0.500000 Mg\n0.244755 0.000000 0.500000 Mg\n0.257296 0.500000 0.500000 Mg\n0.755245 0.000000 0.500000 Mg\n0.742704 0.500000 0.500000 Mg\n0.250473 0.240195 0.000000 Mg\n0.250473 0.759805 0.000000 Mg\n0.749527 0.240195 0.000000 Mg\n0.749527 0.759805 0.000000 Mg\n0.000000 0.500000 0.000000 W\n0.258604 0.000000 0.000000 O\n0.254038 0.500000 0.000000 O\n0.741396 0.000000 0.000000 O\n0.745962 0.500000 0.000000 O\n0.248807 0.252329 0.500000 O\n0.248807 0.747671 0.500000 O\n0.751193 0.252329 0.500000 O\n0.751193 0.747671 0.500000 O\n0.000000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.500000 O\n0.000000 0.250268 0.000000 O\n0.000000 0.749732 0.000000 O\n0.500000 0.252856 0.000000 O\n0.500000 0.747144 0.000000 O\n",
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{
"id": "mp-867726",
"created_at": "2022-09-04T14:41:09.098743Z",
"structure_string": "Li14 Co4 O12\n1.0\n2.562665 6.030483 0.000000\n-2.562665 6.030483 0.000000\n0.000000 2.833827 9.569095\nLi Co O\n14 4 12\ndirect\n0.327368 0.548819 0.169382 Li\n0.436991 0.226388 0.407398 Li\n0.548819 0.327368 0.669382 Li\n0.821455 0.727116 0.295865 Li\n0.226388 0.436991 0.907398 Li\n0.272884 0.178545 0.204135 Li\n0.727116 0.821455 0.795865 Li\n0.773612 0.563009 0.092602 Li\n0.178545 0.272884 0.704135 Li\n0.451181 0.672632 0.330618 Li\n0.563009 0.773612 0.592602 Li\n0.954551 0.045449 0.250000 Li\n0.672632 0.451181 0.830618 Li\n0.045449 0.954551 0.750000 Li\n0.825514 0.985988 0.031427 Co\n0.985988 0.825514 0.531427 Co\n0.014012 0.174486 0.468573 Co\n0.174486 0.014012 0.968573 Co\n0.143731 0.654521 0.369827 O\n0.626998 0.143686 0.198553 O\n0.654521 0.143731 0.869827 O\n0.054738 0.602257 0.085634 O\n0.143686 0.626998 0.698553 O\n0.397743 0.945262 0.414366 O\n0.602257 0.054738 0.585634 O\n0.856314 0.373002 0.301447 O\n0.945262 0.397743 0.914366 O\n0.345479 0.856269 0.130173 O\n0.373002 0.856314 0.801447 O\n0.856269 0.345479 0.630173 O\n",
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"formula_full": "Li14 Co4 O12",
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{
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"structure_string": "Li6 Co8 Sn2 O16\n1.0\n-3.477339 -4.221453 -2.520836\n-5.158091 4.813183 -7.710159\n1.788769 -2.631607 -5.172708\nLi Co Sn O\n6 8 2 16\ndirect\n0.998135 0.499652 0.996049 Li\n0.501871 0.000343 0.503957 Li\n0.250005 0.250005 0.750005 Li\n0.750007 0.749999 0.249997 Li\n0.007181 0.490514 0.511124 Li\n0.492808 0.009484 0.988874 Li\n0.749989 0.750001 0.749997 Co\n0.250005 0.250019 0.249971 Co\n0.000733 0.996734 0.001664 Co\n0.499283 0.503240 0.498364 Co\n0.749992 0.250011 0.250007 Co\n0.250001 0.749992 0.750037 Co\n0.000983 0.000578 0.501958 Co\n0.498996 0.499413 0.998027 Co\n0.749954 0.250036 0.750016 Sn\n0.250006 0.750002 0.249951 Sn\n0.140211 0.637335 0.093006 O\n0.639931 0.127638 0.618387 O\n0.860060 0.372352 0.881618 O\n0.359814 0.862692 0.406969 O\n0.915182 0.864309 0.856609 O\n0.370611 0.365814 0.357357 O\n0.129373 0.134176 0.142657 O\n0.584816 0.635705 0.643366 O\n0.888530 0.872841 0.369779 O\n0.382103 0.369396 0.872173 O\n0.124203 0.623058 0.607345 O\n0.627226 0.125844 0.115552 O\n0.872761 0.374134 0.384489 O\n0.375779 0.876940 0.892672 O\n0.117975 0.130577 0.627817 O\n0.611477 0.627165 0.130208 O\n",
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{
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{
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"structure_string": "Li12 Ni4 C8 S2 O32\n1.0\n0.000000 6.587697 6.587697\n6.587697 0.000000 6.587697\n6.587697 6.587697 0.000000\nLi Ni C S O\n12 4 8 2 32\ndirect\n0.530775 0.969225 0.969225 Li\n0.530775 0.530775 0.969225 Li\n0.969225 0.530775 0.969225 Li\n0.530775 0.969225 0.530775 Li\n0.280775 0.280775 0.719225 Li\n0.280775 0.719225 0.719225 Li\n0.969225 0.530775 0.530775 Li\n0.969225 0.969225 0.530775 Li\n0.719225 0.280775 0.719225 Li\n0.280775 0.719225 0.280775 Li\n0.719225 0.280775 0.280775 Li\n0.719225 0.719225 0.280775 Li\n0.625000 0.125000 0.125000 Ni\n0.125000 0.625000 0.125000 Ni\n0.125000 0.125000 0.125000 Ni\n0.125000 0.125000 0.625000 Ni\n0.348213 0.348213 0.955360 C\n0.348213 0.955360 0.348213 C\n0.348213 0.348213 0.348213 C\n0.955360 0.348213 0.348213 C\n0.294640 0.901787 0.901787 C\n0.901787 0.901787 0.901787 C\n0.901787 0.294640 0.901787 C\n0.901787 0.901787 0.294640 C\n0.500000 0.500000 0.500000 S\n0.750000 0.750000 0.750000 S\n0.565552 0.565552 0.303343 O\n0.565552 0.565552 0.565552 O\n0.565552 0.303343 0.565552 O\n0.303343 0.565552 0.565552 O\n0.492993 0.214935 0.954253 O\n0.337819 0.492993 0.954253 O\n0.492993 0.337819 0.214935 O\n0.214935 0.337819 0.954253 O\n0.492993 0.954253 0.337819 O\n0.337819 0.954253 0.214935 O\n0.214935 0.492993 0.337819 O\n0.337819 0.214935 0.492993 O\n0.954253 0.492993 0.214935 O\n0.214935 0.954253 0.492993 O\n0.954253 0.214935 0.337819 O\n0.295747 0.912181 0.757007 O\n0.954253 0.337819 0.492993 O\n0.295747 0.035065 0.912181 O\n0.035065 0.295747 0.757007 O\n0.295747 0.757007 0.035065 O\n0.912181 0.035065 0.757007 O\n0.035065 0.757007 0.912181 O\n0.912181 0.295747 0.035065 O\n0.757007 0.295747 0.912181 O\n0.035065 0.912181 0.295747 O\n0.757007 0.912181 0.035065 O\n0.912181 0.757007 0.295747 O\n0.757007 0.035065 0.295747 O\n0.946657 0.684448 0.684448 O\n0.684448 0.946657 0.684448 O\n0.684448 0.684448 0.684448 O\n0.684448 0.684448 0.946657 O\n",
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{
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"structure_string": "Li4 Mn8 N6\n1.0\n4.594395 0.000000 0.000000\n0.000000 5.289243 0.000000\n0.000000 0.741573 7.302079\nLi Mn N\n4 8 6\ndirect\n0.794162 0.467436 0.739187 Li\n0.205838 0.532564 0.260813 Li\n0.705838 0.967436 0.739187 Li\n0.294162 0.032564 0.260813 Li\n0.801239 0.815399 0.398817 Mn\n0.793560 0.131261 0.059819 Mn\n0.206440 0.868739 0.940181 Mn\n0.198761 0.184601 0.601183 Mn\n0.706440 0.631261 0.059819 Mn\n0.698761 0.315399 0.398817 Mn\n0.293560 0.368739 0.940181 Mn\n0.301239 0.684601 0.601183 Mn\n0.519735 0.335953 0.161121 N\n0.480265 0.664047 0.838879 N\n0.500000 0.000000 0.500000 N\n0.980265 0.835953 0.161121 N\n0.019735 0.164047 0.838879 N\n0.000000 0.500000 0.500000 N\n",
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],
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},
{
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"structure_string": "Li2 Mn1 Fe3 O8\n1.0\n5.045480 -2.892776 0.000000\n5.045480 2.892776 0.000000\n3.386936 0.000000 4.727969\nLi Mn Fe O\n2 1 3 8\ndirect\n0.126558 0.126558 0.126558 Li\n0.873442 0.873442 0.873442 Li\n0.500000 0.500000 0.500000 Mn\n0.500000 0.000000 0.500000 Fe\n0.000000 0.500000 0.500000 Fe\n0.500000 0.500000 0.000000 Fe\n0.263910 0.263910 0.263910 O\n0.262667 0.262667 0.709015 O\n0.709015 0.262667 0.262667 O\n0.262667 0.709015 0.262667 O\n0.737333 0.290985 0.737333 O\n0.290985 0.737333 0.737333 O\n0.737333 0.737333 0.290985 O\n0.736090 0.736090 0.736090 O\n",
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"formula_full": "Li2 Mn1 Fe3 O8",
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},
{
"id": "mp-761152",
"created_at": "2022-09-04T14:45:58.205330Z",
"structure_string": "Li4 Ni4 O4 F8\n1.0\n4.909995 0.000000 0.000000\n0.000000 4.959664 0.000000\n0.000000 4.692131 8.096327\nLi Ni O F\n4 4 4 8\ndirect\n0.968234 0.276880 0.756219 Li\n0.468234 0.723120 0.743781 Li\n0.531766 0.276880 0.256219 Li\n0.031766 0.723120 0.243781 Li\n0.500000 0.000000 0.000000 Ni\n0.500000 0.500000 0.500000 Ni\n0.000000 0.500000 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.898056 0.061650 0.037058 O\n0.398056 0.938350 0.462942 O\n0.601944 0.061650 0.537058 O\n0.101944 0.938350 0.962942 O\n0.415325 0.644731 0.254917 F\n0.856646 0.729458 0.416696 F\n0.356646 0.270542 0.083304 F\n0.915325 0.355269 0.245083 F\n0.084675 0.644731 0.754917 F\n0.643354 0.729458 0.916696 F\n0.143354 0.270542 0.583304 F\n0.584675 0.355269 0.745083 F\n",
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},
{
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"created_at": "2022-09-04T14:46:24.843760Z",
"structure_string": "Si4 Ni4 H48 O24 F24\n1.0\n6.394840 -0.013518 -0.013174\n-0.693389 6.355506 -0.014186\n2.936016 3.264905 25.217147\nSi Ni H O F\n4 4 48 24 24\ndirect\n0.374991 0.374996 0.125007 Si\n0.125042 0.125068 0.374773 Si\n0.875000 0.875000 0.625000 Si\n0.624970 0.624939 0.875223 Si\n0.500010 0.500115 0.500051 Ni\n0.249967 0.249870 0.749957 Ni\n0.999997 0.000004 0.999954 Ni\n0.749989 0.749964 0.250044 Ni\n0.007184 0.347855 0.050378 H\n0.757209 0.097806 0.300401 H\n0.507134 0.848031 0.550408 H\n0.257102 0.598120 0.800385 H\n0.101949 0.958022 0.099586 H\n0.851884 0.708070 0.349625 H\n0.602066 0.457976 0.599646 H\n0.352171 0.207929 0.849604 H\n0.383913 0.187237 0.014412 H\n0.133930 0.937223 0.264420 H\n0.884152 0.687251 0.514406 H\n0.634186 0.437265 0.764387 H\n0.366042 0.562767 0.235589 H\n0.115828 0.312741 0.485609 H\n0.865842 0.062748 0.735590 H\n0.616102 0.812771 0.985581 H\n0.648036 0.791995 0.150419 H\n0.397844 0.542075 0.400394 H\n0.147936 0.292032 0.650352 H\n0.898119 0.041914 0.900370 H\n0.742814 0.402079 0.199618 H\n0.492898 0.151893 0.449612 H\n0.242871 0.901963 0.699589 H\n0.992796 0.652242 0.949602 H\n0.984779 0.486076 0.201286 H\n0.734800 0.236004 0.451246 H\n0.484817 0.986013 0.701266 H\n0.234836 0.736078 0.951300 H\n0.116689 0.735895 0.078145 H\n0.866688 0.485634 0.328165 H\n0.616821 0.235707 0.578196 H\n0.366866 0.985905 0.828183 H\n0.109100 0.991345 0.203520 H\n0.859185 0.741546 0.453517 H\n0.609320 0.491459 0.703487 H\n0.359293 0.241322 0.953475 H\n0.640898 0.758649 0.046489 H\n0.390712 0.508696 0.296520 H\n0.140683 0.258540 0.546513 H\n0.890806 0.008442 0.796481 H\n0.633294 0.014119 0.171855 H\n0.383143 0.764095 0.421815 H\n0.133182 0.514297 0.671802 H\n0.883327 0.264349 0.921838 H\n0.765200 0.263914 0.048716 H\n0.515195 0.013928 0.298698 H\n0.265183 0.763988 0.548732 H\n0.015200 0.514011 0.798753 H\n0.840195 0.482635 0.219287 O\n0.590261 0.232428 0.469293 O\n0.340276 0.981917 0.719381 O\n0.090251 0.732322 0.969350 O\n0.048179 0.866020 0.074544 O\n0.798618 0.616098 0.324516 O\n0.548146 0.365797 0.574654 O\n0.297641 0.115598 0.824713 O\n0.063180 0.887546 0.235171 O\n0.813621 0.637462 0.485134 O\n0.563292 0.387713 0.735115 O\n0.312788 0.137949 0.985148 O\n0.686933 0.862356 0.014827 O\n0.437102 0.612148 0.264856 O\n0.186714 0.362280 0.514883 O\n0.936351 0.112541 0.764866 O\n0.701892 0.884044 0.175442 O\n0.452347 0.634391 0.425291 O\n0.201855 0.384204 0.675345 O\n0.951331 0.133852 0.925494 O\n0.909781 0.267288 0.030720 O\n0.659777 0.017760 0.280640 O\n0.409724 0.768059 0.530621 O\n0.159736 0.517582 0.780705 O\n0.190262 0.474590 0.088416 F\n0.940278 0.224670 0.338221 F\n0.690337 0.974571 0.588396 F\n0.440320 0.724459 0.838578 F\n0.212700 0.137824 0.140719 F\n0.962700 0.887931 0.390506 F\n0.712702 0.637896 0.640730 F\n0.462697 0.387794 0.890946 F\n0.256604 0.466172 0.180324 F\n0.006771 0.216222 0.430129 F\n0.756720 0.966185 0.680328 F\n0.506572 0.716181 0.930506 F\n0.493378 0.283817 0.069691 F\n0.243442 0.033833 0.319486 F\n0.993284 0.783817 0.569672 F\n0.743239 0.533792 0.819864 F\n0.537292 0.612163 0.109296 F\n0.287316 0.362214 0.359051 F\n0.037298 0.112107 0.609269 F\n0.787308 0.862078 0.859490 F\n0.559718 0.275399 0.161602 F\n0.309688 0.025548 0.411415 F\n0.059662 0.775434 0.661604 F\n0.809740 0.525342 0.911771 F\n",
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}
]
}