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{
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{
"id": "mp-561158",
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{
"id": "mp-1042779",
"created_at": "2022-09-04T14:46:17.185345Z",
"structure_string": "Ca8 Ni8 Bi8 O40\n1.0\n5.611035 0.000000 0.000000\n0.000000 11.051092 0.000000\n0.000000 0.000000 15.598582\nCa Ni Bi O\n8 8 8 40\ndirect\n0.512508 0.359258 0.551040 Ca\n0.012508 0.140742 0.551040 Ca\n0.012508 0.640742 0.948960 Ca\n0.987492 0.359258 0.051040 Ca\n0.487492 0.140742 0.051040 Ca\n0.987492 0.859258 0.448960 Ca\n0.487492 0.640742 0.448960 Ca\n0.512508 0.859258 0.948960 Ca\n0.988852 0.404684 0.404260 Ni\n0.511148 0.904684 0.595740 Ni\n0.011148 0.595316 0.595740 Ni\n0.488852 0.095316 0.404260 Ni\n0.011148 0.095316 0.904260 Ni\n0.988852 0.904684 0.095740 Ni\n0.511148 0.404684 0.904260 Ni\n0.488852 0.595316 0.095740 Ni\n0.933431 0.841504 0.764849 Bi\n0.066569 0.158496 0.235151 Bi\n0.566569 0.341504 0.235151 Bi\n0.066569 0.658496 0.264849 Bi\n0.433431 0.158496 0.735151 Bi\n0.433431 0.658496 0.764849 Bi\n0.566569 0.841504 0.264849 Bi\n0.933431 0.341504 0.735151 Bi\n0.900945 0.308181 0.307676 O\n0.295184 0.039527 0.936230 O\n0.204816 0.539527 0.063770 O\n0.236821 0.781056 0.844744 O\n0.263178 0.281056 0.155256 O\n0.900945 0.808181 0.192324 O\n0.263178 0.781056 0.344744 O\n0.599055 0.808181 0.692324 O\n0.295184 0.539527 0.563770 O\n0.099055 0.691819 0.692324 O\n0.599055 0.308181 0.807676 O\n0.651954 0.181794 0.478837 O\n0.795184 0.960473 0.563770 O\n0.763178 0.718944 0.344744 O\n0.193802 0.017213 0.150843 O\n0.795184 0.460473 0.936230 O\n0.099055 0.191819 0.807676 O\n0.736822 0.218944 0.655256 O\n0.151954 0.818206 0.021163 O\n0.204816 0.039527 0.436230 O\n0.348046 0.818206 0.521163 O\n0.806198 0.982787 0.849157 O\n0.763178 0.218944 0.155256 O\n0.693802 0.982787 0.349157 O\n0.348046 0.318206 0.978837 O\n0.151954 0.318206 0.478837 O\n0.704816 0.460473 0.436230 O\n0.704816 0.960473 0.063770 O\n0.693802 0.482787 0.150843 O\n0.848046 0.681794 0.521163 O\n0.848046 0.181794 0.978837 O\n0.651954 0.681794 0.021163 O\n0.806198 0.482787 0.650843 O\n0.736822 0.718944 0.844744 O\n0.236821 0.281056 0.655256 O\n0.193802 0.517213 0.349157 O\n0.306198 0.517213 0.849157 O\n0.400945 0.191819 0.307676 O\n0.306198 0.017213 0.650843 O\n0.400945 0.691819 0.192324 O\n",
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"formula_full": "Ca8 Ni8 Bi8 O40",
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"updated_at": "2021-11-28T01:37:27.659000Z",
"spacegroup": 61
},
{
"id": "mp-677391",
"created_at": "2022-09-04T14:46:02.203884Z",
"structure_string": "Tm8 Zr6 O24\n1.0\n6.376086 0.000000 0.000000\n-1.040527 6.318731 0.000000\n-2.087428 -2.401999 12.377720\nTm Zr O\n8 6 24\ndirect\n0.390447 0.862532 0.096524 Tm\n0.312518 0.609058 0.819184 Tm\n0.302248 0.610336 0.319282 Tm\n0.859663 0.689775 0.446181 Tm\n0.687482 0.390942 0.180816 Tm\n0.140337 0.310225 0.553819 Tm\n0.609553 0.137468 0.903476 Tm\n0.697752 0.389664 0.680718 Tm\n0.993625 0.993855 0.248057 Zr\n0.389883 0.857040 0.594018 Zr\n0.006375 0.006145 0.751943 Zr\n0.856739 0.681311 0.945128 Zr\n0.143261 0.318689 0.054872 Zr\n0.610117 0.142960 0.405982 Zr\n0.320795 0.942946 0.787345 O\n0.042672 0.904218 0.088346 O\n0.319532 0.957035 0.295588 O\n0.071307 0.919955 0.592406 O\n0.586321 0.819581 0.962808 O\n0.921919 0.688506 0.788375 O\n0.174436 0.575264 0.965438 O\n0.569857 0.828223 0.463107 O\n0.408870 0.566906 0.158527 O\n0.922612 0.680259 0.277833 O\n0.591130 0.433094 0.841473 O\n0.183883 0.590740 0.468264 O\n0.825564 0.424736 0.034562 O\n0.425050 0.581453 0.658784 O\n0.078081 0.311494 0.211625 O\n0.574950 0.418547 0.341216 O\n0.413679 0.180419 0.037192 O\n0.816117 0.409260 0.531736 O\n0.077388 0.319741 0.722167 O\n0.430143 0.171777 0.536893 O\n0.957328 0.095782 0.911654 O\n0.679205 0.057054 0.212655 O\n0.928693 0.080045 0.407594 O\n0.680468 0.042965 0.704412 O\n",
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},
{
"id": "mp-780136",
"created_at": "2022-09-04T14:45:12.786781Z",
"structure_string": "Li6 Mn8 B8 O24\n1.0\n-5.271131 0.000000 0.000000\n-0.006742 -9.146990 0.000000\n2.466560 4.173714 10.380868\nLi Mn B O\n6 8 8 24\ndirect\n0.010001 0.990998 0.838843 Li\n0.209968 0.217330 0.587886 Li\n0.235746 0.258888 0.341477 Li\n0.515383 0.490158 0.832781 Li\n0.462061 0.467515 0.104631 Li\n0.728424 0.748456 0.332034 Li\n0.021092 0.343082 0.871593 Mn\n0.231529 0.573966 0.616308 Mn\n0.261647 0.934574 0.365669 Mn\n0.519852 0.847115 0.868747 Mn\n0.465901 0.131895 0.120736 Mn\n0.737112 0.049156 0.618685 Mn\n0.757253 0.426298 0.369202 Mn\n0.969796 0.658250 0.111068 Mn\n0.013410 0.682010 0.865174 B\n0.253421 0.907399 0.638974 B\n0.255392 0.601219 0.363718 B\n0.529616 0.186768 0.880354 B\n0.460553 0.805224 0.113855 B\n0.729977 0.382505 0.615869 B\n0.777601 0.103971 0.378787 B\n0.980400 0.329716 0.138304 B\n0.041753 0.130181 0.396534 O\n0.252239 0.653652 0.826600 O\n0.096341 0.707916 0.330738 O\n0.403223 0.075055 0.912060 O\n0.150420 0.495529 0.408766 O\n0.424233 0.328637 0.894747 O\n0.124784 0.216045 0.159576 O\n0.341728 0.002321 0.581981 O\n0.063972 0.427096 0.082552 O\n0.424186 0.806707 0.681295 O\n0.240422 0.848032 0.160183 O\n0.480859 0.396539 0.635381 O\n0.510675 0.594836 0.354737 O\n0.758143 0.151529 0.838646 O\n0.605775 0.200573 0.334621 O\n0.900826 0.571070 0.900270 O\n0.673370 0.983183 0.406022 O\n0.895754 0.815567 0.869600 O\n0.591977 0.682038 0.130582 O\n0.834709 0.470659 0.556208 O\n0.554002 0.897306 0.054088 O\n0.893748 0.281786 0.657161 O\n0.735560 0.351732 0.176887 O\n0.007820 0.908171 0.655417 O\n",
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"formula_full": "Li6 Mn8 B8 O24",
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},
{
"id": "mp-1201551",
"created_at": "2022-09-04T14:41:52.400192Z",
"structure_string": "Zn2 Sb8 H36 S14 N12\n1.0\n7.313892 0.000000 0.000000\n-2.064881 11.933252 0.000000\n-0.030679 -3.063004 12.695490\nZn Sb H S N\n2 8 36 14 12\ndirect\n0.327299 0.256443 0.151764 Zn\n0.672701 0.743557 0.848236 Zn\n0.241187 0.979644 0.502009 Sb\n0.758813 0.020356 0.497991 Sb\n0.214702 0.799677 0.220685 Sb\n0.785298 0.200323 0.779315 Sb\n0.691124 0.725287 0.320443 Sb\n0.308876 0.274713 0.679557 Sb\n0.114207 0.619407 0.446339 Sb\n0.885793 0.380593 0.553661 Sb\n0.564070 0.431266 0.092004 H\n0.435930 0.568734 0.907996 H\n0.676694 0.390544 0.181585 H\n0.323306 0.609456 0.818415 H\n0.652913 0.312223 0.058489 H\n0.347087 0.687777 0.941511 H\n0.088743 0.065468 0.180598 H\n0.911257 0.934532 0.819402 H\n0.027779 0.177871 0.262397 H\n0.972221 0.822129 0.737603 H\n0.970016 0.148223 0.134284 H\n0.029984 0.851777 0.865716 H\n0.162679 0.143473 0.960549 H\n0.837321 0.856527 0.039451 H\n0.384618 0.187983 0.941399 H\n0.615382 0.812017 0.058601 H\n0.322345 0.072095 0.988563 H\n0.677655 0.927905 0.011437 H\n0.469731 0.348621 0.354531 H\n0.530269 0.651379 0.645469 H\n0.369098 0.445064 0.318088 H\n0.630902 0.554936 0.681912 H\n0.242581 0.337301 0.358222 H\n0.757419 0.662699 0.641778 H\n0.063993 0.327477 0.045312 H\n0.936007 0.672523 0.954688 H\n0.080593 0.410276 0.165855 H\n0.919407 0.589724 0.834145 H\n0.233256 0.439748 0.081217 H\n0.766744 0.560252 0.918783 H\n0.615663 0.139246 0.151833 H\n0.384337 0.860754 0.848167 H\n0.531717 0.147554 0.270603 H\n0.468283 0.852446 0.729397 H\n0.426031 0.051673 0.167761 H\n0.573969 0.948327 0.832239 H\n0.194387 0.858493 0.059839 S\n0.805613 0.141507 0.940161 S\n0.964937 0.783193 0.521819 S\n0.035063 0.216807 0.478181 S\n0.442348 0.664578 0.167487 S\n0.557652 0.335422 0.832513 S\n0.779119 0.926970 0.305935 S\n0.220881 0.073030 0.694065 S\n0.932133 0.642545 0.202517 S\n0.067867 0.357455 0.797483 S\n0.150801 0.547505 0.610913 S\n0.849199 0.452495 0.389087 S\n0.469863 0.859155 0.523148 S\n0.530137 0.140845 0.476852 S\n0.586398 0.360651 0.117066 N\n0.413602 0.639349 0.882934 N\n0.072762 0.149387 0.188197 N\n0.927238 0.850613 0.811803 N\n0.295864 0.152628 0.990894 N\n0.704136 0.847372 0.009106 N\n0.354831 0.359174 0.315234 N\n0.645169 0.640826 0.684766 N\n0.156372 0.372835 0.106001 N\n0.843628 0.627165 0.893999 N\n0.495832 0.134972 0.192197 N\n0.504168 0.865028 0.807803 N\n",
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"formula_full": "Zn2 Sb8 H36 S14 N12",
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},
{
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"structure_string": "Li6 Mn8 B8 O24\n1.0\n5.905070 0.000000 0.000000\n-1.722901 8.103899 0.000000\n-0.121738 -0.095309 10.571847\nLi Mn B O\n6 8 8 24\ndirect\n0.935098 0.267675 0.080377 Li\n0.962479 0.273748 0.579734 Li\n0.541812 0.223440 0.670503 Li\n0.458188 0.776560 0.329497 Li\n0.064902 0.732325 0.919623 Li\n0.037521 0.726252 0.420266 Li\n0.805647 0.566119 0.163288 Mn\n0.827270 0.581453 0.658878 Mn\n0.661951 0.913957 0.090014 Mn\n0.670748 0.920449 0.595737 Mn\n0.338049 0.086043 0.909986 Mn\n0.329252 0.079551 0.404263 Mn\n0.194353 0.433881 0.836712 Mn\n0.172730 0.418547 0.341122 Mn\n0.845387 0.107408 0.841027 B\n0.836593 0.087307 0.335737 B\n0.677137 0.410767 0.908141 B\n0.664310 0.406294 0.418490 B\n0.322863 0.589233 0.091859 B\n0.335690 0.593706 0.581510 B\n0.154613 0.892592 0.158973 B\n0.163407 0.912693 0.664263 B\n0.843327 0.100724 0.207230 O\n0.825124 0.124703 0.712249 O\n0.956904 0.810002 0.090295 O\n0.986417 0.816419 0.588540 O\n0.858748 0.515204 0.845878 O\n0.841564 0.515039 0.356276 O\n0.682520 0.384813 0.034450 O\n0.686364 0.376996 0.546021 O\n0.490018 0.321817 0.833907 O\n0.472112 0.323411 0.351467 O\n0.338485 0.977003 0.087830 O\n0.661515 0.022997 0.912170 O\n0.343988 0.018872 0.602191 O\n0.656012 0.981128 0.397809 O\n0.509982 0.678183 0.166093 O\n0.527888 0.676589 0.648533 O\n0.317480 0.615187 0.965550 O\n0.313636 0.623004 0.453979 O\n0.141252 0.484796 0.154122 O\n0.158436 0.484961 0.643724 O\n0.043096 0.189998 0.909705 O\n0.013583 0.183581 0.411460 O\n0.156673 0.899276 0.792770 O\n0.174876 0.875297 0.287751 O\n",
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"updated_at": "2021-11-28T01:35:58.262000Z",
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}
]
}