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{
"id": "mp-735578",
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"structure_string": "Sr4 Mo4 As4 H12 O32\n1.0\n5.203103 7.817218 0.000000\n-5.203103 7.817218 0.000000\n0.000000 5.074804 8.520175\nSr Mo As H O\n4 4 4 12 32\ndirect\n0.639791 0.180425 0.125260 Sr\n0.819575 0.360209 0.374740 Sr\n0.360209 0.819575 0.874740 Sr\n0.180425 0.639791 0.625260 Sr\n0.060095 0.244068 0.728050 Mo\n0.755932 0.939905 0.771950 Mo\n0.939905 0.755932 0.271950 Mo\n0.244068 0.060095 0.228050 Mo\n0.229521 0.394416 0.322820 As\n0.605584 0.770479 0.177180 As\n0.770479 0.605584 0.677180 As\n0.394416 0.229521 0.822820 As\n0.368040 0.599418 0.178983 H\n0.400582 0.631960 0.321017 H\n0.631960 0.400582 0.821017 H\n0.599418 0.368040 0.678983 H\n0.749508 0.521522 0.035747 H\n0.478478 0.250492 0.464253 H\n0.250492 0.478478 0.964253 H\n0.521522 0.749508 0.535747 H\n0.888247 0.361361 0.027478 H\n0.638639 0.111753 0.472522 H\n0.111753 0.638639 0.972522 H\n0.361361 0.888247 0.527478 H\n0.243669 0.387429 0.491619 O\n0.612571 0.756331 0.008381 O\n0.756331 0.612571 0.508381 O\n0.387429 0.243669 0.991619 O\n0.051703 0.491514 0.280113 O\n0.508486 0.948297 0.219887 O\n0.948297 0.508486 0.719887 O\n0.491514 0.051703 0.780113 O\n0.320726 0.209431 0.292398 O\n0.790569 0.679274 0.207602 O\n0.679274 0.790569 0.707602 O\n0.209431 0.320726 0.792398 O\n0.378303 0.500652 0.162349 O\n0.499348 0.621697 0.337651 O\n0.621697 0.499348 0.837651 O\n0.500652 0.378303 0.662349 O\n0.946100 0.279728 0.607374 O\n0.720272 0.053900 0.892626 O\n0.053900 0.720272 0.392626 O\n0.279728 0.946100 0.107374 O\n0.208233 0.060291 0.713495 O\n0.939709 0.791767 0.786505 O\n0.791767 0.939709 0.286505 O\n0.060291 0.208233 0.213495 O\n0.925981 0.192216 0.921234 O\n0.807784 0.074019 0.578766 O\n0.074019 0.807784 0.078766 O\n0.192216 0.925981 0.421234 O\n0.785989 0.408065 0.097414 O\n0.591935 0.214011 0.402586 O\n0.214011 0.591935 0.902586 O\n0.408065 0.785989 0.597414 O\n",
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"spacegroup": 15
},
{
"id": "mp-1220596",
"created_at": "2022-09-04T14:45:26.663034Z",
"structure_string": "Nb4 Ag1 S8\n1.0\n-1.691261 -2.929351 0.000000\n3.382523 0.000000 -0.000000\n1.691261 -0.976451 27.196096\nNb Ag S\n4 1 8\ndirect\n0.536014 0.072027 0.391959 Nb\n0.036138 0.072276 0.891586 Nb\n0.962145 0.924290 0.113565 Nb\n0.463447 0.926893 0.609660 Nb\n0.579321 0.158642 0.262036 Ag\n0.609512 0.219024 0.171464 S\n0.110872 0.221744 0.667384 S\n0.888949 0.777897 0.333154 S\n0.388726 0.777453 0.833821 S\n0.647588 0.295175 0.057237 S\n0.149231 0.298461 0.552308 S\n0.850689 0.701378 0.447933 S\n0.350370 0.700739 0.948892 S\n",
"nsites": 13,
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],
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},
{
"id": "mp-1174880",
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"structure_string": "Li7 Mn2 Co3 O12\n1.0\n3.025143 0.000000 0.000000\n-1.256503 4.969887 0.000000\n-1.056502 -1.773135 14.642262\nLi Mn Co O\n7 2 3 12\ndirect\n0.006491 0.246623 0.752629 Li\n0.666353 0.409379 0.915701 Li\n0.333647 0.590621 0.084299 Li\n0.993509 0.753377 0.247371 Li\n0.664412 0.913195 0.418492 Li\n0.335588 0.086805 0.581508 Li\n0.000000 0.000000 0.000000 Li\n0.663797 0.668654 0.669424 Mn\n0.336203 0.331346 0.330576 Mn\n0.349800 0.839198 0.841854 Co\n0.650200 0.160802 0.158146 Co\n0.000000 0.500000 0.500000 Co\n0.355201 0.940338 0.717976 O\n0.016912 0.095703 0.872521 O\n0.674130 0.290323 0.053985 O\n0.347231 0.437941 0.209266 O\n0.035008 0.613525 0.378711 O\n0.640848 0.773082 0.545774 O\n0.652769 0.562059 0.790734 O\n0.325870 0.709677 0.946015 O\n0.983088 0.904297 0.127479 O\n0.644799 0.059662 0.282024 O\n0.359152 0.226918 0.454226 O\n0.964992 0.386475 0.621289 O\n",
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{
"id": "mp-1207145",
"created_at": "2022-09-04T14:45:26.710174Z",
"structure_string": "Sm2 P2 Os4 C2\n1.0\n1.950195 -5.541643 0.000000\n1.950195 5.541643 0.000000\n0.000000 0.000000 7.100071\nSm P Os C\n2 2 4 2\ndirect\n0.545232 0.454768 0.250000 Sm\n0.454768 0.545232 0.750000 Sm\n0.268753 0.731247 0.250000 P\n0.731247 0.268753 0.750000 P\n0.833152 0.166848 0.053120 Os\n0.166848 0.833152 0.946880 Os\n0.166848 0.833152 0.553120 Os\n0.833152 0.166848 0.446880 Os\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
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{
"id": "mp-1184175",
"created_at": "2022-09-04T14:45:26.715272Z",
"structure_string": "Er2 As6\n1.0\n2.991277 -5.181044 0.000000\n2.991277 5.181044 0.000000\n0.000000 0.000000 5.467685\nEr As\n2 6\ndirect\n0.333333 0.666667 0.750000 Er\n0.666667 0.333333 0.250000 Er\n0.181638 0.363276 0.250000 As\n0.636724 0.818362 0.250000 As\n0.181638 0.818362 0.250000 As\n0.818362 0.636724 0.750000 As\n0.363276 0.181638 0.750000 As\n0.818362 0.181638 0.750000 As\n",
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{
"id": "mp-505145",
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"structure_string": "Ag24 Bi8 O24\n1.0\n-7.231687 7.231687 4.454785\n7.231687 -7.231687 4.454785\n7.231687 7.231687 -4.454785\nAg Bi O\n24 8 24\ndirect\n0.078463 0.713675 0.064684 Ag\n0.308265 0.346154 0.855152 Ag\n0.032403 0.177132 0.022442 Ag\n0.683209 0.528827 0.449770 Ag\n0.865692 0.638278 0.770870 Ag\n0.648991 0.013779 0.935316 Ag\n0.259961 0.782403 0.355271 Ag\n0.821223 0.707709 0.065415 Ag\n0.427132 0.904690 0.644729 Ag\n0.778827 0.829057 0.345618 Ag\n0.344822 0.615692 0.727414 Ag\n0.957709 0.392294 0.386485 Ag\n0.154690 0.009961 0.977558 Ag\n0.642294 0.755808 0.934585 Ag\n0.888278 0.617408 0.272586 Ag\n0.596154 0.241002 0.537889 Ag\n0.263779 0.828463 0.864788 Ag\n0.491002 0.453113 0.144848 Ag\n0.867408 0.094822 0.229130 Ag\n0.703113 0.058265 0.462111 Ag\n0.079057 0.233438 0.550230 Ag\n0.963675 0.398991 0.135212 Ag\n0.483438 0.433209 0.654382 Ag\n0.005808 0.571223 0.613515 Ag\n0.594587 0.276228 0.879057 Bi\n0.146710 0.973310 0.628874 Bi\n0.526228 0.147171 0.181641 Bi\n0.767836 0.896710 0.673401 Bi\n0.223310 0.094436 0.326599 Bi\n0.344436 0.517836 0.371126 Bi\n0.965530 0.344587 0.818359 Bi\n0.397171 0.715530 0.120943 Bi\n0.276128 0.935404 0.248860 O\n0.870306 0.756811 0.630459 O\n0.871763 0.496488 0.881201 O\n0.482137 0.311138 0.264435 O\n0.006811 0.876353 0.386506 O\n0.690447 0.245177 0.373096 O\n0.467703 0.232137 0.671000 O\n0.185404 0.436544 0.159276 O\n0.126353 0.239847 0.369541 O\n0.615287 0.990562 0.118799 O\n0.277268 0.026128 0.840724 O\n0.169239 0.803132 0.565005 O\n0.854234 0.919239 0.866107 O\n0.489847 0.620306 0.613494 O\n0.567351 0.440447 0.945270 O\n0.046703 0.217703 0.735565 O\n0.495177 0.622081 0.054730 O\n0.561138 0.796703 0.329000 O\n0.053132 0.988127 0.133893 O\n0.686544 0.027268 0.751140 O\n0.238127 0.604234 0.434995 O\n0.872081 0.317351 0.626904 O\n0.240562 0.621763 0.875275 O\n0.746488 0.365287 0.124725 O\n",
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{
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{
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"structure_string": "Li4 Fe8 B8 O24\n1.0\n5.253622 0.000000 0.000000\n-2.600555 4.584540 0.000000\n-0.103035 -0.243424 20.158136\nLi Fe B O\n4 8 8 24\ndirect\n0.673893 0.649348 0.329374 Li\n0.643401 0.670569 0.081843 Li\n0.668502 0.643830 0.831042 Li\n0.345160 0.353902 0.457001 Li\n0.011930 0.673286 0.189662 Fe\n0.995071 0.671003 0.691393 Fe\n0.315708 0.012227 0.063746 Fe\n0.324901 0.997722 0.567667 Fe\n0.679100 0.004483 0.440525 Fe\n0.675037 0.013884 0.940589 Fe\n0.008793 0.319322 0.312622 Fe\n0.010797 0.314457 0.812561 Fe\n0.996987 0.341216 0.064063 B\n0.996622 0.338150 0.565174 B\n0.669866 0.007551 0.186701 B\n0.660348 0.002258 0.688067 B\n0.341321 0.997898 0.313127 B\n0.341785 0.996109 0.814012 B\n0.008122 0.667281 0.439966 B\n0.007744 0.669750 0.937001 B\n0.892244 0.273437 0.209731 O\n0.885082 0.271332 0.709266 O\n0.744421 0.082684 0.042463 O\n0.965410 0.579367 0.085202 O\n0.724259 0.109591 0.546511 O\n0.014379 0.598802 0.587212 O\n0.400585 0.978382 0.168907 O\n0.746004 0.664530 0.430735 O\n0.394495 0.985485 0.667854 O\n0.774607 0.715970 0.928716 O\n0.712563 0.772576 0.178869 O\n0.692244 0.761752 0.688266 O\n0.351365 0.261286 0.317781 O\n0.354547 0.259021 0.814607 O\n0.262837 0.356866 0.064944 O\n0.584020 0.971506 0.331134 O\n0.241615 0.309941 0.558347 O\n0.580891 0.967358 0.835886 O\n0.029745 0.421970 0.423662 O\n0.977190 0.401566 0.918562 O\n0.256114 0.919502 0.464601 O\n0.272877 0.888356 0.961659 O\n0.079621 0.745932 0.291669 O\n0.086015 0.741703 0.791716 O\n",
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