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{
"id": "mp-1094065",
"created_at": "2022-09-04T14:39:08.097213Z",
"structure_string": "Sr2 Co2 O5\n1.0\n5.600331 0.000000 0.000000\n0.000000 5.600331 0.000000\n0.000000 0.000000 3.708674\nSr Co O\n2 2 5\ndirect\n0.500000 0.000000 0.000000 Sr\n0.000000 0.500000 0.000000 Sr\n0.000000 0.000000 0.500000 Co\n0.500000 0.500000 0.500000 Co\n0.728746 0.271254 0.500000 O\n0.271254 0.728746 0.500000 O\n0.000000 0.000000 0.000000 O\n0.728746 0.728746 0.500000 O\n0.271254 0.271254 0.500000 O\n",
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{
"id": "mp-759320",
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"structure_string": "Li9 Mn9 P12 O48\n1.0\n8.101257 0.000000 0.000000\n-0.003598 9.068907 0.000000\n-0.023082 -1.072805 13.380986\nLi Mn P O\n9 9 12 48\ndirect\n0.514754 0.342610 0.833894 Li\n0.484906 0.992193 0.498056 Li\n0.853877 0.442504 0.826600 Li\n0.352437 0.055272 0.175091 Li\n0.996014 0.820652 0.839689 Li\n0.008703 0.513449 0.498089 Li\n0.016716 0.156525 0.166371 Li\n0.147656 0.892266 0.505755 Li\n0.493034 0.681830 0.163051 Li\n0.144170 0.224163 0.831978 Mn\n0.857179 0.107948 0.501858 Mn\n0.348073 0.714532 0.844295 Mn\n0.350796 0.388800 0.499127 Mn\n0.644908 0.941727 0.835999 Mn\n0.645454 0.614641 0.496161 Mn\n0.641015 0.272921 0.168742 Mn\n0.152118 0.555903 0.171276 Mn\n0.849896 0.786832 0.155496 Mn\n0.803960 0.145962 0.945555 P\n0.302746 0.023457 0.719599 P\n0.701673 0.635165 0.944337 P\n0.698328 0.309276 0.613547 P\n0.202902 0.518952 0.721585 P\n0.193927 0.187171 0.385870 P\n0.797625 0.814794 0.612549 P\n0.801146 0.476118 0.277846 P\n0.298033 0.697171 0.388940 P\n0.302855 0.354648 0.054740 P\n0.703860 0.980625 0.279124 P\n0.200182 0.864221 0.055863 P\n0.132442 0.015875 0.775909 O\n0.633164 0.150782 0.889208 O\n0.933128 0.244417 0.898185 O\n0.292875 0.316583 0.942884 O\n0.343523 0.191693 0.750777 O\n0.636594 0.478802 0.927123 O\n0.656748 0.141610 0.582566 O\n0.703032 0.349744 0.723536 O\n0.082771 0.413147 0.768772 O\n0.710167 0.013954 0.391857 O\n0.067239 0.088592 0.436660 O\n0.378681 0.518058 0.772409 O\n0.864442 0.655631 0.891610 O\n0.366060 0.183380 0.442248 O\n0.867971 0.317669 0.556822 O\n0.569186 0.748450 0.898917 O\n0.204974 0.815046 0.941269 O\n0.570689 0.410764 0.560615 O\n0.208726 0.486098 0.608394 O\n0.582436 0.085844 0.231353 O\n0.156047 0.684620 0.753127 O\n0.202702 0.151012 0.275332 O\n0.154984 0.356650 0.416999 O\n0.136226 0.021130 0.072234 O\n0.841510 0.976338 0.918292 O\n0.841629 0.647412 0.581707 O\n0.789905 0.848496 0.725321 O\n0.842176 0.308350 0.251180 O\n0.429745 0.921744 0.771789 O\n0.790761 0.515540 0.390073 O\n0.429672 0.583519 0.436003 O\n0.791893 0.185822 0.057058 O\n0.431095 0.253648 0.101738 O\n0.134121 0.676626 0.440735 O\n0.622548 0.815417 0.560142 O\n0.131187 0.350209 0.109234 O\n0.631732 0.484320 0.222352 O\n0.918872 0.918755 0.565107 O\n0.297709 0.984428 0.609387 O\n0.931178 0.577828 0.231630 O\n0.296864 0.645294 0.275411 O\n0.362854 0.853225 0.407695 O\n0.343821 0.522780 0.084112 O\n0.658931 0.814443 0.246899 O\n0.706604 0.684697 0.058530 O\n0.068923 0.751276 0.101086 O\n0.364237 0.844385 0.107689 O\n0.878280 0.983570 0.226936 O\n",
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"elements": [
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"chemical_system": "Li-Mn-O-P",
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"density_atomic": 0.07934126643520872,
"volume": 983.0949706820722,
"volume_molar": 7.590174735763478,
"formula_full": "Li9 Mn9 P12 O48",
"formula_reduced": "Li3Mn3(PO4)4",
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"spacegroup": 1
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{
"id": "mp-758147",
"created_at": "2022-09-04T14:39:08.177832Z",
"structure_string": "Li4 Cu4 P12 O36\n1.0\n7.978694 0.000000 0.000000\n0.000000 8.790893 0.000000\n0.000000 0.000000 12.391293\nLi Cu P O\n4 4 12 36\ndirect\n0.004215 0.363832 0.994709 Li\n0.495785 0.636168 0.494709 Li\n0.504215 0.136168 0.005291 Li\n0.995785 0.863832 0.505291 Li\n0.163266 0.207680 0.624472 Cu\n0.336734 0.792320 0.124472 Cu\n0.663266 0.292320 0.375528 Cu\n0.836734 0.707680 0.875528 Cu\n0.192457 0.002642 0.322342 P\n0.170659 0.491105 0.189515 P\n0.226602 0.681732 0.886525 P\n0.273398 0.318268 0.386525 P\n0.329341 0.508895 0.689515 P\n0.307543 0.997358 0.822342 P\n0.692457 0.497358 0.677658 P\n0.670659 0.008895 0.810485 P\n0.726602 0.818268 0.113475 P\n0.773398 0.181732 0.613475 P\n0.829341 0.991105 0.310485 P\n0.807543 0.502642 0.177658 P\n0.991972 0.578211 0.189049 O\n0.060909 0.599226 0.893826 O\n0.152953 0.399607 0.301583 O\n0.200124 0.386433 0.708907 O\n0.192951 0.845398 0.832139 O\n0.235594 0.938206 0.213265 O\n0.200998 0.908060 0.422476 O\n0.184321 0.384232 0.096239 O\n0.165577 0.300131 0.485423 O\n0.334423 0.699869 0.985423 O\n0.315679 0.615768 0.596239 O\n0.299002 0.091940 0.922476 O\n0.264406 0.061794 0.713265 O\n0.307049 0.154602 0.332139 O\n0.299876 0.613567 0.208907 O\n0.347047 0.600393 0.801583 O\n0.439091 0.400774 0.393826 O\n0.508028 0.421789 0.689049 O\n0.491972 0.921789 0.810951 O\n0.560909 0.900774 0.106174 O\n0.652953 0.100393 0.698417 O\n0.700124 0.113567 0.291093 O\n0.692951 0.654602 0.167861 O\n0.735594 0.561794 0.786735 O\n0.700998 0.591940 0.577524 O\n0.684321 0.115768 0.903761 O\n0.665577 0.199869 0.514577 O\n0.834423 0.800131 0.014577 O\n0.815679 0.884232 0.403761 O\n0.799002 0.408060 0.077524 O\n0.764406 0.438206 0.286735 O\n0.807049 0.345398 0.667861 O\n0.799876 0.886433 0.791093 O\n0.847047 0.899607 0.198417 O\n0.939091 0.099226 0.606174 O\n0.008028 0.078211 0.310951 O\n",
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"formula_full": "Li4 Cu4 P12 O36",
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"spacegroup": 19
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{
"id": "mp-776390",
"created_at": "2022-09-04T14:39:07.480866Z",
"structure_string": "Li4 Nb2 V3 Ni3 O16\n1.0\n5.942105 -0.015847 -0.018811\n-2.984807 5.166322 -0.003327\n-0.031542 -0.024675 9.710340\nLi Nb V Ni O\n4 2 3 3 16\ndirect\n0.323226 0.661420 0.898409 Li\n0.004320 0.000287 0.987917 Li\n0.006361 0.002233 0.494554 Li\n0.664597 0.334163 0.403727 Li\n0.330654 0.664048 0.501528 Nb\n0.695818 0.348152 0.987402 Nb\n0.188345 0.843015 0.220293 V\n0.185863 0.346911 0.218790 V\n0.349868 0.174003 0.726362 V\n0.663669 0.831909 0.207583 Ni\n0.825349 0.659337 0.711731 Ni\n0.825139 0.165523 0.711731 Ni\n0.173896 0.832913 0.591630 O\n0.038833 0.520199 0.335342 O\n0.305266 0.652968 0.104985 O\n0.011193 0.006726 0.304991 O\n0.019544 0.009630 0.799090 O\n0.173371 0.339670 0.591860 O\n0.465884 0.964137 0.337757 O\n0.464236 0.502312 0.337997 O\n0.330347 0.164959 0.102932 O\n0.666114 0.832551 0.583801 O\n0.503424 0.468728 0.850256 O\n0.503300 0.033578 0.849820 O\n0.631566 0.315825 0.608250 O\n0.845193 0.669753 0.096015 O\n0.957647 0.478885 0.847681 O\n0.846977 0.176466 0.095406 O\n",
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"formula_full": "Li4 Nb2 V3 Ni3 O16",
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{
"id": "mp-1226032",
"created_at": "2022-09-04T14:39:08.254527Z",
"structure_string": "Co3 Sn2\n1.0\n-2.111244 -3.657364 0.000000\n-2.111244 3.657364 0.000000\n0.000000 0.000000 -5.066854\nCo Sn\n3 2\ndirect\n0.000011 0.999989 0.503643 Co\n0.000011 0.999989 0.996357 Co\n0.666642 0.333358 0.250000 Co\n0.666695 0.333305 0.750000 Sn\n0.333342 0.666658 0.250000 Sn\n",
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{
"id": "mp-1201959",
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"structure_string": "Mn1 Tl2 P4 H8 O16\n1.0\n6.746332 0.001194 2.062150\n0.199892 7.573973 1.175696\n-0.115996 -0.029170 7.829361\nMn Tl P H O\n1 2 4 8 16\ndirect\n0.500000 0.500000 0.000000 Mn\n0.891862 0.276500 0.208393 Tl\n0.108138 0.723500 0.791607 Tl\n0.250704 0.807149 0.247933 P\n0.749296 0.192851 0.752067 P\n0.665914 0.737514 0.258782 P\n0.334086 0.262486 0.741218 P\n0.944104 0.733354 0.411056 H\n0.055896 0.266646 0.588944 H\n0.740598 0.959388 0.036970 H\n0.259402 0.040612 0.963030 H\n0.374398 0.301066 0.354895 H\n0.625602 0.698934 0.645105 H\n0.386983 0.174880 0.206811 H\n0.613017 0.825120 0.793189 H\n0.263005 0.998350 0.156448 O\n0.736995 0.001650 0.843552 O\n0.073540 0.782576 0.422358 O\n0.926460 0.217424 0.577642 O\n0.255390 0.669668 0.126492 O\n0.744610 0.330332 0.873508 O\n0.430705 0.771306 0.342718 O\n0.569295 0.228694 0.657281 O\n0.745320 0.674328 0.419037 O\n0.254680 0.325672 0.580963 O\n0.752089 0.923987 0.167223 O\n0.247911 0.076013 0.832777 O\n0.698244 0.612722 0.119022 O\n0.301756 0.387278 0.880978 O\n0.442485 0.281835 0.229506 O\n0.557515 0.718165 0.770494 O\n",
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"formula_full": "Mn1 Tl2 P4 H8 O16",
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{
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"created_at": "2022-09-04T14:39:07.493379Z",
"structure_string": "Sm8 I12 O2\n1.0\n4.943030 -8.561579 0.000000\n4.943030 8.561579 0.000000\n0.000000 0.000000 8.474979\nSm I O\n8 12 2\ndirect\n0.201754 0.798246 0.068938 Sm\n0.798246 0.596491 0.568938 Sm\n0.596491 0.798246 0.068938 Sm\n0.666667 0.333333 0.260955 Sm\n0.403509 0.201754 0.568938 Sm\n0.333333 0.666667 0.760955 Sm\n0.798246 0.201754 0.568938 Sm\n0.201754 0.403509 0.068938 Sm\n0.472743 0.945486 0.386281 I\n0.134936 0.865064 0.698560 I\n0.134936 0.269872 0.698560 I\n0.865064 0.134936 0.198560 I\n0.054514 0.527257 0.386281 I\n0.269872 0.134936 0.198560 I\n0.865064 0.730128 0.198560 I\n0.945486 0.472743 0.886281 I\n0.527257 0.054514 0.886281 I\n0.527257 0.472743 0.886281 I\n0.472743 0.527257 0.386281 I\n0.730128 0.865064 0.698560 I\n0.666667 0.333333 0.545619 O\n0.333333 0.666667 0.045619 O\n",
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{
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