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{
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{
"id": "mp-1096608",
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{
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{
"id": "mp-781683",
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"structure_string": "Li4 Fe4 P8 H4 O28\n1.0\n6.607403 -0.122464 0.008753\n-0.991956 -0.160245 10.695280\n0.626399 -7.478392 0.216903\nLi Fe P H O\n4 4 8 4 28\ndirect\n0.116309 0.537240 0.316128 Li\n0.116448 0.037277 0.816221 Li\n0.883625 0.462756 0.683870 Li\n0.883630 0.962728 0.183881 Li\n0.351519 0.692177 0.589071 Fe\n0.648603 0.307996 0.410707 Fe\n0.351493 0.191759 0.089473 Fe\n0.648372 0.807832 0.910728 Fe\n0.159090 0.773781 0.993990 P\n0.159108 0.273772 0.494005 P\n0.840944 0.226265 0.006000 P\n0.840891 0.726227 0.505977 P\n0.389548 0.410152 0.766459 P\n0.389625 0.910160 0.266454 P\n0.610404 0.589837 0.233532 P\n0.610429 0.089849 0.733578 P\n0.164433 0.579527 0.925919 H\n0.164509 0.079523 0.425872 H\n0.835510 0.420510 0.074074 H\n0.835504 0.920485 0.574121 H\n0.086933 0.628826 0.023017 O\n0.086964 0.128813 0.522953 O\n0.913024 0.371233 0.976959 O\n0.913016 0.871189 0.477009 O\n0.016268 0.145529 0.028699 O\n0.016222 0.645497 0.528592 O\n0.983776 0.854531 0.971355 O\n0.983782 0.354511 0.471359 O\n0.238296 0.801872 0.182771 O\n0.238250 0.301828 0.682794 O\n0.761793 0.198142 0.817220 O\n0.761686 0.698158 0.317200 O\n0.276379 0.529541 0.755329 O\n0.276457 0.029556 0.255411 O\n0.723598 0.470466 0.244637 O\n0.723532 0.970434 0.744652 O\n0.331527 0.793453 0.842499 O\n0.331577 0.293483 0.342542 O\n0.668478 0.206571 0.157472 O\n0.668461 0.706524 0.657461 O\n0.393653 0.361516 0.957262 O\n0.393708 0.861490 0.457246 O\n0.606307 0.638465 0.042703 O\n0.606310 0.138501 0.542770 O\n0.407074 0.581103 0.352108 O\n0.407114 0.081135 0.852213 O\n0.592895 0.418893 0.647862 O\n0.592929 0.918886 0.147847 O\n",
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"formula_full": "Li4 Fe4 P8 H4 O28",
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"spacegroup": 2
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{
"id": "mp-1519752",
"created_at": "2022-09-04T14:44:11.947579Z",
"structure_string": "Ba4 Dy4 Sn4 Sb4 O24\n1.0\n8.456494 0.000000 0.000000\n0.000000 8.460036 0.000000\n0.000000 0.000000 8.400805\nBa Dy Sn Sb O\n4 4 4 4 24\ndirect\n0.000000 -0.000000 -0.000000 Ba\n0.500000 0.500000 0.500000 Ba\n0.500000 -0.000000 0.500000 Ba\n0.000000 0.500000 -0.000000 Ba\n0.750000 0.750000 0.750000 Dy\n0.250000 0.250000 0.750000 Dy\n0.250000 0.750000 0.250000 Dy\n0.750000 0.250000 0.250000 Dy\n0.000000 0.500000 0.500000 Sn\n0.500000 0.500000 -0.000000 Sn\n0.500000 -0.000000 0.000000 Sn\n0.000000 -0.000000 0.500000 Sn\n0.250000 0.250000 0.250000 Sb\n0.750000 0.750000 0.250000 Sb\n0.750000 0.250000 0.750000 Sb\n0.250000 0.750000 0.750000 Sb\n0.014438 0.209722 0.275589 O\n0.985562 0.790278 0.275589 O\n0.985562 0.209722 0.724411 O\n0.014438 0.790278 0.724411 O\n0.288461 0.014357 0.223316 O\n0.288461 0.985643 0.776684 O\n0.711539 0.985643 0.223316 O\n0.711539 0.014357 0.776684 O\n0.222280 0.268287 0.013634 O\n0.777720 0.268287 0.986366 O\n0.222280 0.731713 0.986366 O\n0.777720 0.731713 0.013634 O\n0.485562 0.290278 0.224412 O\n0.514438 0.709722 0.224412 O\n0.514438 0.290278 0.775589 O\n0.485562 0.709722 0.775589 O\n0.211539 0.485643 0.276684 O\n0.211539 0.514357 0.723316 O\n0.788461 0.514357 0.276684 O\n0.788461 0.485643 0.723316 O\n0.277720 0.231713 0.486366 O\n0.722280 0.231713 0.513634 O\n0.277720 0.768287 0.513634 O\n0.722280 0.768287 0.486366 O\n",
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"formula_full": "Ba4 Dy4 Sn4 Sb4 O24",
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{
"id": "mp-758989",
"created_at": "2022-09-04T14:44:12.092823Z",
"structure_string": "P8 H4 N4 F16\n1.0\n4.814789 0.000000 0.000000\n0.000000 8.895149 0.000000\n0.000000 7.143666 12.068564\nP H N F\n8 4 4 16\ndirect\n0.086936 0.302923 0.848887 P\n0.140748 0.716974 0.339517 P\n0.586936 0.697077 0.651113 P\n0.359252 0.716974 0.839517 P\n0.640748 0.283026 0.160483 P\n0.413064 0.302923 0.348887 P\n0.859252 0.283026 0.660483 P\n0.913064 0.697077 0.151113 P\n0.196280 0.918297 0.146759 H\n0.696280 0.081703 0.353241 H\n0.303720 0.918297 0.646759 H\n0.803720 0.081703 0.853241 H\n0.101774 0.801947 0.201004 N\n0.398226 0.801947 0.701004 N\n0.601774 0.198053 0.298996 N\n0.898226 0.198053 0.798996 N\n0.250482 0.136955 0.947032 F\n0.474835 0.738158 0.342570 F\n0.860549 0.314836 0.930019 F\n0.360549 0.685164 0.569981 F\n0.069316 0.889498 0.345667 F\n0.569316 0.110502 0.154333 F\n0.750482 0.863045 0.552968 F\n0.974835 0.261842 0.157430 F\n0.025165 0.738158 0.842570 F\n0.249518 0.136955 0.447032 F\n0.430684 0.889498 0.845667 F\n0.930684 0.110502 0.654333 F\n0.639451 0.314836 0.430019 F\n0.139451 0.685164 0.069981 F\n0.525165 0.261842 0.657430 F\n0.749518 0.863045 0.052968 F\n",
"nsites": 32,
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},
{
"id": "mp-1177936",
"created_at": "2022-09-04T14:44:14.559327Z",
"structure_string": "Li8 Mn4 Se8 O24\n1.0\n0.000582 -6.409988 -5.933085\n8.325070 -4.806437 -0.001903\n-5.551479 -3.204360 5.932941\nLi Mn Se O\n8 4 8 24\ndirect\n0.269364 0.153868 0.730761 Li\n0.519476 0.653713 0.980558 Li\n0.769256 0.153830 0.230672 Li\n0.019335 0.653796 0.480729 Li\n0.230525 0.846211 0.769411 Li\n0.480640 0.346172 0.019369 Li\n0.730737 0.846138 0.269361 Li\n0.980865 0.345965 0.519191 Li\n0.499752 0.999734 0.499681 Mn\n0.750129 0.500130 0.749897 Mn\n0.999503 0.000035 0.999565 Mn\n0.250540 0.499982 0.250646 Mn\n0.431240 0.379193 0.568847 Se\n0.681163 0.879364 0.818807 Se\n0.931143 0.379320 0.068932 Se\n0.180992 0.879317 0.318862 Se\n0.068921 0.620703 0.931222 Se\n0.318849 0.120719 0.181095 Se\n0.568854 0.620698 0.431169 Se\n0.818718 0.120750 0.681159 Se\n0.250870 0.499153 0.995486 O\n0.500952 0.999276 0.245573 O\n0.750953 0.499073 0.495170 O\n0.000814 0.999367 0.745727 O\n0.372262 0.254078 0.627389 O\n0.622585 0.754149 0.877658 O\n0.872344 0.254156 0.127722 O\n0.122351 0.754100 0.377709 O\n0.495549 0.500859 0.750809 O\n0.745630 0.000717 0.000954 O\n0.995414 0.500915 0.250943 O\n0.245594 0.000680 0.501016 O\n0.004524 0.499325 0.748981 O\n0.254589 0.999153 0.999137 O\n0.504345 0.499314 0.249165 O\n0.754497 0.999127 0.499193 O\n0.249119 0.500707 0.504453 O\n0.499125 0.000844 0.754512 O\n0.749114 0.500665 0.004124 O\n0.999023 0.000929 0.254678 O\n0.127553 0.746060 0.872512 O\n0.377622 0.245991 0.122465 O\n0.627430 0.745887 0.372210 O\n0.877733 0.245836 0.622472 O\n",
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"formula_full": "Li8 Mn4 Se8 O24",
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{
"id": "mp-1100319",
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"structure_string": "Ni15 O16\n1.0\n9.840812 -2.973248 0.000000\n9.840812 2.973248 0.000000\n8.942492 0.000000 5.070860\nNi O\n15 16\ndirect\n0.000000 0.000000 0.500000 Ni\n0.000000 0.500000 0.500000 Ni\n0.755553 0.246136 0.755553 Ni\n0.750242 0.750242 0.750242 Ni\n0.000000 0.500000 0.000000 Ni\n0.500000 0.000000 0.000000 Ni\n0.500000 0.500000 0.000000 Ni\n0.755553 0.755553 0.246136 Ni\n0.249758 0.249758 0.249758 Ni\n0.753864 0.244447 0.244447 Ni\n0.244447 0.753864 0.244447 Ni\n0.500000 0.500000 0.500000 Ni\n0.500000 0.000000 0.500000 Ni\n0.246136 0.755553 0.755553 Ni\n0.244447 0.244447 0.753864 Ni\n0.873203 0.375748 0.375748 O\n0.867554 0.867554 0.396526 O\n0.624971 0.624971 0.624971 O\n0.624252 0.126797 0.624252 O\n0.875018 0.875018 0.875018 O\n0.375748 0.375748 0.873203 O\n0.396526 0.867554 0.867554 O\n0.867554 0.396526 0.867554 O\n0.132446 0.603474 0.132446 O\n0.603474 0.132446 0.132446 O\n0.124982 0.124982 0.124982 O\n0.624252 0.624252 0.126797 O\n0.375748 0.873203 0.375748 O\n0.375029 0.375029 0.375029 O\n0.132446 0.132446 0.603474 O\n0.126797 0.624252 0.624252 O\n",
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{
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"structure_string": "Sm8 Se12\n1.0\n4.129598 0.000000 0.000000\n0.000000 11.132574 0.000000\n0.000000 0.000000 11.403291\nSm Se\n8 12\ndirect\n0.250000 0.997792 0.693642 Sm\n0.750000 0.002208 0.306358 Sm\n0.750000 0.497792 0.806358 Sm\n0.250000 0.502208 0.193642 Sm\n0.250000 0.312921 0.511685 Sm\n0.750000 0.687079 0.488315 Sm\n0.750000 0.812921 0.988315 Sm\n0.250000 0.187079 0.011685 Sm\n0.750000 0.055682 0.880053 Se\n0.250000 0.944318 0.119947 Se\n0.250000 0.555682 0.619947 Se\n0.750000 0.444318 0.380053 Se\n0.250000 0.874672 0.455212 Se\n0.750000 0.125328 0.544788 Se\n0.750000 0.374672 0.044788 Se\n0.250000 0.625328 0.955212 Se\n0.250000 0.302125 0.772211 Se\n0.750000 0.697875 0.227789 Se\n0.750000 0.802125 0.727789 Se\n0.250000 0.197875 0.272211 Se\n",
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{
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{
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{
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}