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{
"id": "mp-753836",
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"structure_string": "Li4 Ti3 Ni2 Sn3 O16\n1.0\n3.044193 5.298961 0.000000\n-3.044193 5.298961 0.000000\n0.000000 0.082632 9.749327\nLi Ti Ni Sn O\n4 3 2 3 16\ndirect\n0.668494 0.668494 0.884823 Li\n0.991772 0.991772 0.996665 Li\n0.993411 0.993411 0.502134 Li\n0.334903 0.334903 0.389770 Li\n0.830979 0.830979 0.215334 Ti\n0.661871 0.169503 0.715170 Ti\n0.169503 0.661871 0.715170 Ti\n0.668997 0.668997 0.491347 Ni\n0.335636 0.335636 0.987435 Ni\n0.832172 0.338720 0.214762 Sn\n0.338720 0.832172 0.214762 Sn\n0.170017 0.170017 0.714077 Sn\n0.833036 0.316565 0.603670 O\n0.517930 0.517930 0.341139 O\n0.674493 0.674493 0.096707 O\n0.994107 0.994107 0.319393 O\n0.993445 0.993445 0.814309 O\n0.316565 0.833036 0.603670 O\n0.965784 0.528321 0.335919 O\n0.528321 0.965784 0.335919 O\n0.157590 0.157590 0.095434 O\n0.840396 0.840396 0.611405 O\n0.491311 0.037611 0.834918 O\n0.037611 0.491311 0.834918 O\n0.343328 0.343328 0.601506 O\n0.679810 0.149942 0.104702 O\n0.480254 0.480254 0.828108 O\n0.149942 0.679810 0.104702 O\n",
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{
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"structure_string": "Li4 Ti3 Ni3 Sn2 O16\n1.0\n5.919346 0.000000 0.000000\n2.949556 5.172823 0.000000\n0.086129 0.028518 9.757209\nLi Ti Ni Sn O\n4 3 3 2 16\ndirect\n0.666593 0.667941 0.892527 Li\n0.012798 0.997392 0.992620 Li\n0.002614 0.000078 0.494373 Li\n0.334848 0.327705 0.398895 Li\n0.823860 0.340450 0.216463 Ti\n0.829607 0.829797 0.214317 Ti\n0.661131 0.162748 0.714856 Ti\n0.342621 0.829252 0.213084 Ni\n0.170574 0.168576 0.711263 Ni\n0.170814 0.659444 0.715493 Ni\n0.658508 0.669509 0.494166 Sn\n0.320241 0.340391 0.988499 Sn\n0.820427 0.325121 0.597878 O\n0.966591 0.517448 0.334854 O\n0.691054 0.654720 0.103492 O\n0.988092 0.005918 0.307292 O\n0.995985 0.025039 0.807338 O\n0.844813 0.832967 0.606015 O\n0.529058 0.503978 0.341604 O\n0.532880 0.961664 0.343435 O\n0.668370 0.167751 0.103118 O\n0.312696 0.843658 0.603600 O\n0.503634 0.033961 0.844183 O\n0.472347 0.492568 0.833620 O\n0.344068 0.307487 0.606541 O\n0.149882 0.172879 0.100559 O\n0.036118 0.481239 0.829223 O\n0.149774 0.680020 0.098530 O\n",
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"formula_full": "Li4 Ti3 Ni3 Sn2 O16",
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{
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"structure_string": "Li4 Ti2 Ni3 Sn3 O16\n1.0\n3.050035 5.185247 0.000000\n-3.050035 5.185247 0.000000\n0.000000 0.357998 9.624933\nLi Ti Ni Sn O\n4 2 3 3 16\ndirect\n0.677188 0.677188 0.890746 Li\n0.979517 0.979517 0.989415 Li\n0.987500 0.987500 0.500564 Li\n0.333063 0.333063 0.402680 Li\n0.676451 0.676451 0.494177 Ti\n0.358056 0.358056 0.986084 Ti\n0.829074 0.829074 0.216597 Ni\n0.659474 0.175979 0.714352 Ni\n0.175979 0.659474 0.714352 Ni\n0.832419 0.339250 0.213665 Sn\n0.339250 0.832419 0.213665 Sn\n0.169694 0.169694 0.714847 Sn\n0.829369 0.324037 0.597439 O\n0.512189 0.512189 0.342539 O\n0.673434 0.673434 0.098222 O\n0.993827 0.993827 0.313425 O\n0.985529 0.985529 0.802010 O\n0.324037 0.829369 0.597439 O\n0.958791 0.512050 0.353089 O\n0.512050 0.958791 0.353089 O\n0.163871 0.163871 0.086362 O\n0.819236 0.819236 0.591337 O\n0.490737 0.046496 0.839134 O\n0.046496 0.490737 0.839134 O\n0.348142 0.348142 0.611488 O\n0.658776 0.176198 0.091233 O\n0.487142 0.487142 0.849607 O\n0.176198 0.658776 0.091233 O\n",
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"formula_full": "Li4 Ti2 Ni3 Sn3 O16",
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{
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"created_at": "2022-09-04T14:46:13.579634Z",
"structure_string": "Li8 Ti6 Ni6 Te4 O32\n1.0\n-2.991806 5.182067 0.000016\n0.033321 0.019258 10.053719\n8.943970 5.163895 0.035674\nLi Ti Ni Te O\n8 6 6 4 32\ndirect\n0.500014 0.909250 0.162517 Li\n0.000014 0.909248 0.662522 Li\n0.500011 0.983530 0.497276 Li\n0.000010 0.983535 0.997272 Li\n0.000030 0.490912 0.003512 Li\n0.500029 0.490918 0.503506 Li\n0.000012 0.403713 0.331445 Li\n0.500012 0.403712 0.831444 Li\n0.000014 0.724114 0.172847 Ti\n0.500014 0.724104 0.672849 Ti\n0.739169 0.218513 0.092773 Ti\n0.239173 0.218513 0.592777 Ti\n0.260864 0.218508 0.092778 Ti\n0.760860 0.218507 0.592782 Ti\n0.000018 0.201767 0.828492 Ni\n0.242692 0.720522 0.414503 Ni\n0.757290 0.720529 0.414510 Ni\n0.500017 0.201765 0.328493 Ni\n0.742679 0.720503 0.914505 Ni\n0.257301 0.720515 0.914512 Ni\n0.500014 0.510588 0.174434 Te\n0.000014 0.510578 0.674427 Te\n0.000008 0.985302 0.337180 Te\n0.500008 0.985294 0.837178 Te\n0.500019 0.316517 0.010571 O\n0.000019 0.316517 0.510573 O\n0.500020 0.103710 0.155434 O\n0.000020 0.103712 0.655435 O\n0.000020 0.293557 0.002077 O\n0.500020 0.293554 0.502074 O\n0.999994 0.803159 0.006549 O\n0.499999 0.803161 0.506553 O\n0.000017 0.088066 0.168842 O\n0.500018 0.088062 0.668842 O\n0.500003 0.597065 0.340693 O\n0.000003 0.597049 0.840697 O\n0.000000 0.610884 0.321467 O\n0.499997 0.610871 0.821472 O\n0.999998 0.855393 0.478884 O\n0.499997 0.855382 0.978887 O\n0.751089 0.612360 0.092715 O\n0.251094 0.612355 0.592710 O\n0.248944 0.612375 0.092720 O\n0.748940 0.612369 0.592716 O\n0.746204 0.322529 0.234835 O\n0.246204 0.322527 0.734837 O\n0.253815 0.322520 0.234837 O\n0.753815 0.322518 0.734838 O\n0.214945 0.857048 0.254272 O\n0.714944 0.857039 0.754274 O\n0.785075 0.857054 0.254274 O\n0.285074 0.857046 0.754276 O\n0.246024 0.084205 0.414778 O\n0.746021 0.084204 0.914775 O\n0.753996 0.084212 0.414782 O\n0.254000 0.084211 0.914779 O\n",
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"formula_full": "Li8 Ti6 Ni6 Te4 O32",
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{
"id": "mp-769613",
"created_at": "2022-09-04T14:39:37.020405Z",
"structure_string": "Li4 Ti3 Ni3 W2 O16\n1.0\n5.990599 0.011066 -0.047123\n-2.985901 5.145228 -0.014976\n-0.075956 -0.072051 9.748319\nLi Ti Ni W O\n4 3 3 2 16\ndirect\n0.324312 0.661041 0.899665 Li\n0.988151 0.994171 0.984245 Li\n0.004232 0.001363 0.496000 Li\n0.665911 0.335112 0.409042 Li\n0.183775 0.842912 0.216895 Ti\n0.175342 0.338619 0.214042 Ti\n0.343379 0.180213 0.719030 Ti\n0.659895 0.831153 0.209285 Ni\n0.838414 0.658659 0.710460 Ni\n0.836050 0.175583 0.710469 Ni\n0.343930 0.672747 0.491131 W\n0.681685 0.340850 0.982060 W\n0.173016 0.833762 0.593236 O\n0.042461 0.521179 0.340217 O\n0.310622 0.655792 0.107404 O\n0.007707 0.001406 0.305524 O\n0.011638 0.008444 0.799226 O\n0.181166 0.340445 0.595535 O\n0.467117 0.966906 0.341585 O\n0.467269 0.505761 0.338864 O\n0.331420 0.163511 0.105290 O\n0.663234 0.829579 0.582999 O\n0.506893 0.474665 0.847929 O\n0.500419 0.036734 0.857092 O\n0.641083 0.313799 0.607870 O\n0.839957 0.659225 0.095121 O\n0.963484 0.482025 0.850135 O\n0.847440 0.174644 0.097491 O\n",
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{
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"structure_string": "Li2 Ti2 P2 C2 O14\n1.0\n6.447695 0.000000 0.000000\n0.000000 5.243688 0.000000\n0.000000 1.129391 8.165135\nLi Ti P C O\n2 2 2 2 14\ndirect\n0.250000 0.754670 0.099213 Li\n0.750000 0.245330 0.900787 Li\n0.750000 0.795985 0.315701 Ti\n0.250000 0.204015 0.684299 Ti\n0.250000 0.750644 0.424019 P\n0.750000 0.249356 0.575981 P\n0.750000 0.686305 0.034654 C\n0.250000 0.313695 0.965346 C\n0.750000 0.929838 0.070720 O\n0.250000 0.375428 0.104957 O\n0.750000 0.520129 0.170191 O\n0.060976 0.800843 0.308431 O\n0.439024 0.800843 0.308431 O\n0.750000 0.080761 0.437765 O\n0.250000 0.464991 0.503648 O\n0.750000 0.535009 0.496352 O\n0.250000 0.919239 0.562235 O\n0.939024 0.199157 0.691569 O\n0.560976 0.199157 0.691569 O\n0.250000 0.479871 0.829809 O\n0.750000 0.624572 0.895043 O\n0.250000 0.070162 0.929280 O\n",
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"formula_full": "Li2 Ti2 P2 C2 O14",
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{
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"structure_string": "Li4 Ti2 P2 C2 O14\n1.0\n6.399122 0.000000 0.000000\n0.000000 5.114681 0.000000\n0.000000 0.521189 8.581733\nLi Ti P C O\n4 2 2 2 14\ndirect\n0.009095 0.750742 0.779027 Li\n0.990905 0.249258 0.220973 Li\n0.509095 0.249258 0.220973 Li\n0.490905 0.750742 0.779027 Li\n0.750000 0.794575 0.342052 Ti\n0.250000 0.205425 0.657948 Ti\n0.250000 0.712825 0.423315 P\n0.750000 0.287175 0.576685 P\n0.750000 0.731063 0.054061 C\n0.250000 0.268937 0.945939 C\n0.750000 0.530710 0.160201 O\n0.750000 0.961480 0.114213 O\n0.250000 0.469290 0.839799 O\n0.943905 0.182926 0.668353 O\n0.556095 0.182926 0.668353 O\n0.750000 0.181160 0.410715 O\n0.250000 0.818840 0.589285 O\n0.443905 0.817074 0.331647 O\n0.056095 0.817074 0.331647 O\n0.250000 0.408597 0.436646 O\n0.750000 0.700593 0.909343 O\n0.250000 0.299407 0.090657 O\n0.750000 0.591403 0.563354 O\n0.250000 0.038520 0.885787 O\n",
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{
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"structure_string": "Li6 Ti2 P2 C2 O14\n1.0\n6.602265 0.000000 0.000000\n0.000000 4.993704 0.000000\n0.000000 1.010244 8.561823\nLi Ti P C O\n6 2 2 2 14\ndirect\n0.022470 0.734164 0.717093 Li\n0.977530 0.265836 0.282907 Li\n0.750000 0.794297 0.108793 Li\n0.250000 0.205703 0.891207 Li\n0.522470 0.265836 0.282907 Li\n0.477530 0.734164 0.717093 Li\n0.250000 0.792481 0.319649 Ti\n0.750000 0.207519 0.680351 Ti\n0.750000 0.728503 0.411801 P\n0.250000 0.271497 0.588199 P\n0.250000 0.672761 0.031337 C\n0.750000 0.327239 0.968663 C\n0.750000 0.509957 0.846239 O\n0.250000 0.922556 0.059584 O\n0.250000 0.166499 0.427106 O\n0.250000 0.490043 0.153761 O\n0.433366 0.160656 0.691418 O\n0.750000 0.833501 0.572894 O\n0.066634 0.160656 0.691418 O\n0.566634 0.839344 0.308582 O\n0.933366 0.839344 0.308582 O\n0.750000 0.413759 0.432090 O\n0.250000 0.605733 0.891165 O\n0.750000 0.394267 0.108835 O\n0.250000 0.586241 0.567910 O\n0.750000 0.077444 0.940416 O\n",
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"formula_full": "Li1 Ti2 P4 H3 O16",
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{
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"created_at": "2022-09-04T14:42:29.257087Z",
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{
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}