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{
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"results": [
{
"id": "mp-1235093",
"created_at": "2022-09-04T14:44:52.183532Z",
"structure_string": "Ba6 Li1 Nb2 Ir1 Cl2 O12\n1.0\n6.033569 -0.015654 -0.234637\n-3.030323 5.212060 0.234121\n-0.532551 0.304554 15.394460\nBa Li Nb Ir Cl O\n6 1 2 1 2 12\ndirect\n0.310542 0.690406 0.366770 Ba\n0.347766 0.653387 0.782027 Ba\n0.668390 0.332794 0.636797 Ba\n0.696521 0.304481 0.905999 Ba\n0.378489 0.622487 0.034475 Ba\n0.628764 0.371173 0.223068 Ba\n0.205431 0.793360 0.173532 Li\n0.023645 0.977144 0.815949 Nb\n0.949706 0.050755 0.183904 Nb\n0.019587 0.980448 0.001250 Ir\n0.657594 0.343214 0.426454 Cl\n0.336422 0.664728 0.574822 Cl\n0.189732 0.283059 0.906718 O\n0.345452 0.137857 0.757728 O\n0.102996 0.395732 0.226769 O\n0.869500 0.655041 0.757971 O\n0.853777 0.140080 0.753030 O\n0.855253 0.714858 0.105162 O\n0.100629 0.901268 0.269847 O\n0.284610 0.145661 0.105209 O\n0.851046 0.147106 0.063473 O\n0.717494 0.807465 0.906770 O\n0.605080 0.896022 0.227087 O\n0.178657 0.824808 0.920188 O\n",
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{
"id": "mp-1193894",
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"structure_string": "Cs12 Sb4 S12\n1.0\n10.481500 0.000000 0.000000\n0.000000 10.481500 0.000000\n0.000000 0.000000 10.481500\nCs Sb S\n12 4 12\ndirect\n0.441993 0.941993 0.558007 Cs\n0.941993 0.558007 0.441993 Cs\n0.558007 0.441993 0.941993 Cs\n0.058007 0.058007 0.058007 Cs\n0.940572 0.440572 0.059428 Cs\n0.440572 0.059428 0.940572 Cs\n0.059428 0.940572 0.440572 Cs\n0.559428 0.559428 0.559428 Cs\n0.679483 0.179483 0.320517 Cs\n0.179483 0.320517 0.679483 Cs\n0.320517 0.679483 0.179483 Cs\n0.820517 0.820517 0.820517 Cs\n0.224618 0.724618 0.775382 Sb\n0.724618 0.775382 0.224618 Sb\n0.775382 0.224618 0.724618 Sb\n0.275382 0.275382 0.275382 Sb\n0.158222 0.949204 0.758372 S\n0.241628 0.658222 0.550796 S\n0.449204 0.741628 0.841778 S\n0.658222 0.550796 0.241628 S\n0.741628 0.841778 0.449204 S\n0.949204 0.758372 0.158222 S\n0.841778 0.449204 0.741628 S\n0.758372 0.158222 0.949204 S\n0.550796 0.241628 0.658222 S\n0.341778 0.050796 0.258372 S\n0.258372 0.341778 0.050796 S\n0.050796 0.258372 0.341778 S\n",
"nsites": 28,
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"elements": [
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],
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"volume": 1151.516899543375,
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"formula_full": "Cs12 Sb4 S12",
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},
{
"id": "mp-761179",
"created_at": "2022-09-04T14:44:52.294402Z",
"structure_string": "K4 Ni2 P8 H16 O32\n1.0\n-4.723559 0.990440 7.278605\n6.206454 -7.449588 -0.072287\n7.732925 7.347270 -0.085643\nK Ni P H O\n4 2 8 16 32\ndirect\n0.297486 0.838200 0.574777 K\n0.297511 0.338093 0.074654 K\n0.702609 0.661929 0.925275 K\n0.702451 0.161743 0.425273 K\n0.499873 0.749816 0.249956 Ni\n0.500082 0.250096 0.749944 Ni\n0.243342 0.149207 0.419198 P\n0.243342 0.649202 0.919197 P\n0.756665 0.350810 0.080810 P\n0.756663 0.850807 0.580808 P\n0.757117 0.100695 0.909611 P\n0.757151 0.600689 0.409632 P\n0.242889 0.399358 0.590378 P\n0.242834 0.899302 0.090363 P\n0.076418 0.930053 0.199044 H\n0.076478 0.430070 0.699055 H\n0.923559 0.569965 0.300942 H\n0.923570 0.069969 0.800943 H\n0.473334 0.339117 0.384354 H\n0.473342 0.839140 0.884369 H\n0.526722 0.160886 0.115679 H\n0.526717 0.660882 0.615676 H\n0.708236 0.454058 0.639625 H\n0.708062 0.953929 0.139605 H\n0.291938 0.046073 0.860401 H\n0.291769 0.545957 0.360376 H\n0.852028 0.451564 0.774351 H\n0.851888 0.951452 0.274336 H\n0.148047 0.048486 0.725691 H\n0.147860 0.548356 0.225654 H\n0.081270 0.990859 0.330359 O\n0.081264 0.490851 0.830351 O\n0.918730 0.509148 0.169644 O\n0.918732 0.009158 0.669641 O\n0.338413 0.246204 0.327134 O\n0.338416 0.746208 0.827146 O\n0.661624 0.253799 0.172886 O\n0.661663 0.753818 0.672911 O\n0.937817 0.114117 0.898545 O\n0.937854 0.614117 0.398563 O\n0.062173 0.385910 0.601432 O\n0.062152 0.885893 0.101450 O\n0.666112 0.458359 0.465568 O\n0.666104 0.958362 0.965552 O\n0.333900 0.041651 0.034446 O\n0.334019 0.541685 0.534467 O\n0.387960 0.145090 0.541798 O\n0.387949 0.645072 0.041806 O\n0.612035 0.354918 0.958188 O\n0.612030 0.854898 0.458192 O\n0.628950 0.110493 0.780186 O\n0.629061 0.610479 0.280168 O\n0.370944 0.389522 0.719828 O\n0.370925 0.889477 0.219788 O\n0.148601 0.240944 0.469667 O\n0.148546 0.740880 0.969670 O\n0.851441 0.259117 0.030320 O\n0.851447 0.759115 0.530324 O\n0.273365 0.058669 0.765841 O\n0.273220 0.558590 0.265828 O\n0.726703 0.441375 0.734162 O\n0.726597 0.941317 0.234163 O\n",
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],
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"volume": 745.657760837127,
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"formula_full": "K4 Ni2 P8 H16 O32",
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"spacegroup": 2
},
{
"id": "mp-672233",
"created_at": "2022-09-04T14:44:51.914297Z",
"structure_string": "N4\n1.0\n2.021595 -3.501506 0.000000\n2.021595 3.501506 0.000000\n0.000000 0.000000 6.670694\nN\n4\ndirect\n0.333333 0.666667 0.333512 N\n0.333333 0.666667 0.166488 N\n0.666667 0.333333 0.833512 N\n0.666667 0.333333 0.666488 N\n",
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},
{
"id": "mp-1234273",
"created_at": "2022-09-04T14:44:51.773296Z",
"structure_string": "Ba6 Mg1 P6 O21\n1.0\n0.000000 0.000000 -7.291605\n-5.103503 -9.353036 0.000000\n-4.195577 8.787902 0.000000\nBa Mg P O\n6 1 6 21\ndirect\n0.500000 0.393145 0.357690 Ba\n0.500000 0.908667 0.613362 Ba\n0.500000 0.686162 0.997414 Ba\n-0.000000 0.252040 0.976702 Ba\n-0.000000 0.696351 0.699688 Ba\n-0.000000 0.985258 0.300752 Ba\n0.500000 0.320100 0.909247 Mg\n0.215198 0.625679 0.284178 P\n0.784802 0.625679 0.284178 P\n0.212832 0.382301 0.677193 P\n0.787168 0.382301 0.677193 P\n0.282145 0.996852 0.995305 P\n0.717855 0.996852 0.995305 P\n0.308034 0.470364 0.154497 O\n0.235465 0.669372 0.464421 O\n0.265314 0.761433 0.276052 O\n0.691966 0.470364 0.154497 O\n0.764535 0.669372 0.464421 O\n0.734686 0.761433 0.276052 O\n0.299310 0.416630 0.840061 O\n0.212537 0.213415 0.526845 O\n0.285838 0.496219 0.640954 O\n0.700690 0.416630 0.840061 O\n0.787463 0.213415 0.526845 O\n0.714162 0.496219 0.640954 O\n0.216699 0.873491 0.020240 O\n0.253344 0.162061 0.150945 O\n0.204493 0.966340 0.831705 O\n0.783301 0.873491 0.020240 O\n0.746656 0.162061 0.150945 O\n0.795507 0.966340 0.831705 O\n-0.000000 0.442477 0.737608 O\n-0.000000 0.581046 0.225802 O\n0.500000 0.952352 0.950451 O\n",
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"spacegroup": 6
},
{
"id": "mp-768960",
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"structure_string": "Li40 B8 O32\n1.0\n4.960694 0.000000 0.000000\n0.000000 8.644079 0.000000\n0.000000 0.000000 15.180502\nLi B O\n40 8 32\ndirect\n0.918475 0.944425 0.435628 Li\n0.581525 0.944425 0.935628 Li\n0.399846 0.924354 0.751323 Li\n0.100154 0.924354 0.251323 Li\n0.087682 0.840160 0.004037 Li\n0.412318 0.840160 0.504037 Li\n0.896286 0.827333 0.827783 Li\n0.603714 0.827333 0.327783 Li\n0.422838 0.798564 0.139580 Li\n0.077162 0.798564 0.639580 Li\n0.922838 0.701436 0.139580 Li\n0.577162 0.701436 0.639580 Li\n0.396286 0.672667 0.827783 Li\n0.103714 0.672667 0.327783 Li\n0.587682 0.659840 0.004037 Li\n0.912318 0.659840 0.504037 Li\n0.600154 0.575646 0.251323 Li\n0.899846 0.575646 0.751323 Li\n0.081525 0.555575 0.935628 Li\n0.418475 0.555575 0.435628 Li\n0.918475 0.444425 0.064372 Li\n0.581525 0.444425 0.564372 Li\n0.100154 0.424354 0.248677 Li\n0.399846 0.424354 0.748677 Li\n0.412318 0.340160 0.995963 Li\n0.087682 0.340160 0.495963 Li\n0.603714 0.327333 0.172217 Li\n0.896286 0.327333 0.672217 Li\n0.422838 0.298564 0.360420 Li\n0.077162 0.298564 0.860420 Li\n0.922838 0.201436 0.360420 Li\n0.577162 0.201436 0.860420 Li\n0.396286 0.172667 0.672217 Li\n0.103714 0.172667 0.172217 Li\n0.587682 0.159840 0.495963 Li\n0.912318 0.159840 0.995963 Li\n0.899846 0.075646 0.748677 Li\n0.600154 0.075646 0.248677 Li\n0.081525 0.055575 0.564372 Li\n0.418475 0.055575 0.064372 Li\n0.824755 0.959864 0.125031 B\n0.675245 0.959864 0.625031 B\n0.324755 0.540136 0.125031 B\n0.175245 0.540136 0.625031 B\n0.824755 0.459864 0.374969 B\n0.675245 0.459864 0.874969 B\n0.324755 0.040136 0.374969 B\n0.175245 0.040136 0.874969 B\n0.125110 0.953985 0.120414 O\n0.374890 0.953985 0.620414 O\n0.735270 0.877320 0.209005 O\n0.764730 0.877320 0.709005 O\n0.699460 0.875988 0.048230 O\n0.800540 0.875988 0.548230 O\n0.234624 0.871700 0.373215 O\n0.265376 0.871700 0.873215 O\n0.734624 0.628300 0.373215 O\n0.765376 0.628300 0.873215 O\n0.199460 0.624012 0.048230 O\n0.300540 0.624012 0.548230 O\n0.264730 0.622680 0.709005 O\n0.235270 0.622680 0.209005 O\n0.625110 0.546015 0.120414 O\n0.874890 0.546015 0.620414 O\n0.125110 0.453985 0.379586 O\n0.374890 0.453985 0.879586 O\n0.764730 0.377320 0.790995 O\n0.735270 0.377320 0.290995 O\n0.800540 0.375988 0.951770 O\n0.699460 0.375988 0.451770 O\n0.234624 0.371700 0.126785 O\n0.265376 0.371700 0.626785 O\n0.765376 0.128300 0.626785 O\n0.734624 0.128300 0.126785 O\n0.199460 0.124012 0.451770 O\n0.300540 0.124012 0.951770 O\n0.264730 0.122680 0.790995 O\n0.235270 0.122680 0.290995 O\n0.625110 0.046015 0.379586 O\n0.874890 0.046015 0.879586 O\n",
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"formula_full": "Li40 B8 O32",
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{
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"structure_string": "Sr1 Hf1 In1 Sb1 O6\n1.0\n0.000000 -4.100713 -4.100713\n4.100713 0.000000 -4.100713\n4.100713 -4.100713 0.000000\nSr Hf In Sb O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.000000 0.000000 0.000000 Hf\n0.750000 0.750000 0.750000 In\n0.500000 0.500000 0.500000 Sb\n0.745495 0.254505 0.254505 O\n0.254505 0.745495 0.745495 O\n0.745495 0.254505 0.745495 O\n0.254505 0.745495 0.254505 O\n0.745495 0.745495 0.254505 O\n0.254505 0.254505 0.745495 O\n",
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{
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"structure_string": "Rb4 Fe4 O8\n1.0\n-0.000005 5.931971 0.000010\n0.000002 0.000014 8.120472\n5.961922 -0.000005 0.000002\nRb Fe O\n4 4 8\ndirect\n0.014176 0.622316 0.063509 Rb\n0.514179 0.122315 0.436490 Rb\n0.014176 0.877685 0.563486 Rb\n0.514177 0.377685 0.936514 Rb\n0.000787 0.373679 0.546936 Fe\n0.500786 0.873679 0.953062 Fe\n0.000789 0.126322 0.046926 Fe\n0.500789 0.626320 0.453077 Fe\n0.702947 0.048797 0.007066 O\n0.202948 0.548797 0.492934 O\n0.702909 0.451221 0.507067 O\n0.202910 0.951221 0.992933 O\n0.542225 0.694262 0.151626 O\n0.042225 0.194261 0.348374 O\n0.542229 0.805720 0.651588 O\n0.042230 0.305721 0.848412 O\n",
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}