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{
"id": "jvasp-11683",
"created_at": "2022-09-04T14:37:58.991246Z",
"updated_at": "2022-09-04T14:37:58.991271Z",
"structure_string": "K1 Sc1 Mo2 O8\n1.0\n2.909763 -5.039856 -0.000000\n2.909763 5.039856 0.000000\n0.000000 0.000000 7.108926\nK Sc Mo O\n1 1 2 8\ndirect\n0.000000 0.000000 0.500000 K\n0.000000 0.000000 0.000000 Sc\n0.333332 0.666667 0.740203 Mo\n0.666667 0.333332 0.259797 Mo\n0.330195 0.165097 0.179054 O\n0.834902 0.669804 0.179054 O\n0.834902 0.165097 0.179054 O\n0.165097 0.330195 0.820947 O\n0.333332 0.666667 0.496328 O\n0.666667 0.333332 0.503673 O\n0.165097 0.834902 0.820947 O\n0.669804 0.834902 0.820947 O\n",
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{
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"structure_string": "Tm4 In1 Ni2 Ge4\n1.0\n4.029514 0.000000 -1.102865\n-0.586228 6.615108 -2.141885\n0.008949 -0.001418 7.945398\nTm In Ni Ge\n4 1 2 4\ndirect\n0.344235 0.063084 0.688469 Tm\n0.655764 0.936916 0.311530 Tm\n0.408219 0.609125 0.816438 Tm\n0.591780 0.390875 0.183561 Tm\n0.000000 0.000000 0.000000 In\n0.218001 0.637613 0.436003 Ni\n0.781997 0.362387 0.563996 Ni\n0.066231 0.662868 0.132463 Ge\n0.933768 0.337132 0.867536 Ge\n0.201552 0.262323 0.403105 Ge\n0.798447 0.737677 0.596894 Ge\n",
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{
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"structure_string": "Pr2 Cu1 Si3 Rh2\n1.0\n8.815481 0.028685 0.000000\n-7.795927 4.115463 0.000000\n0.000000 0.000000 4.125782\nPr Cu Si Rh\n2 1 3 2\ndirect\n0.895238 0.104764 -0.000000 Pr\n0.109445 0.890554 0.500000 Pr\n0.668303 0.331698 -0.000000 Cu\n0.317753 0.682247 0.500000 Si\n0.535386 0.464615 -0.000000 Si\n0.463014 0.536986 0.500000 Si\n0.254826 0.745173 -0.000000 Rh\n0.756035 0.243966 0.500000 Rh\n",
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{
"id": "jvasp-42717",
"created_at": "2022-09-04T14:37:56.610482Z",
"updated_at": "2022-09-04T14:37:56.610520Z",
"structure_string": "Li2 Mn4 B4 O12\n1.0\n5.265734 -0.054061 -0.005311\n0.244580 5.917744 0.010781\n0.276426 1.122394 7.595279\nLi Mn B O\n2 4 4 12\ndirect\n0.901736 0.631728 0.697654 Li\n0.098264 0.368271 0.302346 Li\n0.413790 0.426527 0.823530 Mn\n0.095560 0.062845 0.682518 Mn\n0.904440 0.937154 0.317482 Mn\n0.586210 0.573472 0.176470 Mn\n0.418234 0.752304 0.495020 B\n0.924126 0.270037 0.991331 B\n0.075873 0.729962 0.008669 B\n0.581766 0.247695 0.504980 B\n0.959527 0.670375 0.177028 O\n0.840130 0.191057 0.478303 O\n0.438157 0.351535 0.369792 O\n0.464393 0.185038 0.670775 O\n0.535607 0.814961 0.329225 O\n0.323099 0.649323 0.988749 O\n0.159870 0.808942 0.521697 O\n0.040472 0.329623 0.822973 O\n0.943241 0.836405 0.870561 O\n0.056759 0.163594 0.129439 O\n0.561843 0.648464 0.630208 O\n0.676901 0.350675 0.011251 O\n",
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"formula_full": "Li2 Mn4 B4 O12",
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{
"id": "jvasp-56861",
"created_at": "2022-09-04T14:37:57.282680Z",
"updated_at": "2022-09-04T14:37:57.282695Z",
"structure_string": "Sr2 C1 N2 Cl2\n1.0\n4.242814 0.000000 0.000000\n-2.121407 4.804322 -0.674457\n0.000000 -0.025833 7.264811\nSr C N Cl\n2 1 2 2\ndirect\n0.682537 0.365077 0.270076 Sr\n0.317462 0.634924 0.729923 Sr\n0.000000 0.000000 0.500000 C\n0.114917 0.229833 0.445517 N\n0.885082 0.770167 0.554483 N\n0.371304 0.742608 0.148939 Cl\n0.628695 0.257392 0.851061 Cl\n",
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{
"id": "jvasp-22176",
"created_at": "2022-09-04T14:37:46.740067Z",
"updated_at": "2022-09-04T14:37:46.740098Z",
"structure_string": "K4 Li2 Al2 F12\n1.0\n5.387175 0.001929 8.147248\n2.451439 4.797093 8.147248\n0.003151 0.001929 9.767256\nK Li Al F\n4 2 2 12\ndirect\n0.127722 0.127721 0.127721 K\n0.280927 0.280926 0.280927 K\n0.719074 0.719073 0.719074 K\n0.872279 0.872278 0.872279 K\n0.597348 0.597348 0.597348 Li\n0.402652 0.402652 0.402652 Li\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.271864 0.807080 0.807080 F\n0.610709 0.160049 0.610709 F\n0.610709 0.610708 0.160049 F\n0.160049 0.610708 0.610709 F\n0.192921 0.728136 0.192920 F\n0.389292 0.839950 0.389292 F\n0.389292 0.389291 0.839951 F\n0.807080 0.271864 0.807080 F\n0.807081 0.807080 0.271864 F\n0.192920 0.192920 0.728136 F\n0.728137 0.192920 0.192920 F\n0.839952 0.389291 0.389291 F\n",
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{
"id": "jvasp-30761",
"created_at": "2022-09-04T14:37:57.089699Z",
"updated_at": "2022-09-04T14:37:57.089721Z",
"structure_string": "Mg2 Ge4 W2 O12\n1.0\n4.912577 -0.327746 0.743434\n0.481891 7.589628 1.607857\n-0.875216 0.979134 7.661279\nMg Ge W O\n2 4 2 12\ndirect\n0.750000 0.387111 0.612889 Mg\n0.250000 0.612888 0.387112 Mg\n0.688325 0.426831 0.197302 Ge\n0.811675 0.802697 0.573169 Ge\n0.311674 0.573168 0.802698 Ge\n0.188325 0.197302 0.426831 Ge\n0.750000 0.895629 0.104371 W\n0.249999 0.104370 0.895629 W\n0.541311 0.961516 0.857833 O\n0.958689 0.142167 0.038483 O\n0.555539 0.676416 0.182137 O\n0.944461 0.817863 0.323584 O\n0.444461 0.323583 0.817863 O\n0.014979 0.569613 0.652329 O\n0.985020 0.430386 0.347671 O\n0.514979 0.652328 0.569614 O\n0.041311 0.857832 0.961517 O\n0.485020 0.347671 0.430387 O\n0.055539 0.182136 0.676416 O\n0.458689 0.038483 0.142167 O\n",
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{
"id": "jvasp-25788",
"created_at": "2022-09-04T14:37:38.416250Z",
"updated_at": "2022-09-04T14:37:38.416270Z",
"structure_string": "As4 S4 Cl12 F24\n1.0\n7.705037 0.000000 0.000000\n0.000000 8.512965 0.000000\n0.000000 0.000000 12.061162\nAs S Cl F\n4 4 12 24\ndirect\n0.301974 0.532211 0.684597 As\n0.698026 0.032211 0.815402 As\n0.801975 0.967788 0.315402 As\n0.198026 0.467789 0.184598 As\n0.151793 0.021975 0.024572 S\n0.348207 0.978025 0.524572 S\n0.848207 0.521974 0.475428 S\n0.651793 0.478025 0.975428 S\n0.213745 0.174308 0.905822 Cl\n0.343632 0.183262 0.444221 Cl\n0.865386 0.492111 0.879981 Cl\n0.656368 0.683262 0.055778 Cl\n0.634614 0.507888 0.379981 Cl\n0.286255 0.825692 0.405823 Cl\n0.786255 0.674307 0.594177 Cl\n0.365386 0.007888 0.120018 Cl\n0.134614 0.992111 0.620018 Cl\n0.843633 0.316737 0.555778 Cl\n0.156368 0.816737 0.944221 Cl\n0.713746 0.325692 0.094177 Cl\n0.701497 0.148996 0.280562 F\n0.880219 0.133831 0.759785 F\n0.902586 0.958773 0.183578 F\n0.402585 0.541227 0.816421 F\n0.298503 0.648995 0.219438 F\n0.481666 0.430645 0.629357 F\n0.697102 0.972288 0.447128 F\n0.018334 0.569355 0.129357 F\n0.097415 0.458773 0.316422 F\n0.600570 0.215211 0.851174 F\n0.802898 0.027711 0.947127 F\n0.798503 0.851004 0.780562 F\n0.597415 0.041227 0.683578 F\n0.899430 0.784789 0.351174 F\n0.380219 0.366169 0.240215 F\n0.619781 0.866169 0.259785 F\n0.119781 0.633831 0.740215 F\n0.518334 0.930644 0.870643 F\n0.302898 0.472288 0.052872 F\n0.201497 0.351004 0.719438 F\n0.981667 0.069355 0.370643 F\n0.197102 0.527711 0.552872 F\n0.399430 0.715210 0.648825 F\n0.100570 0.284789 0.148825 F\n",
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{
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"created_at": "2022-09-04T14:37:52.882432Z",
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"structure_string": "In1 Cu1 Sn1 Se4\n1.0\n5.286043 0.060963 -4.639820\n-1.044669 5.182146 -4.639820\n-0.049316 -0.060963 7.033331\nIn Cu Sn Se\n1 1 1 4\ndirect\n0.749999 0.250000 0.499999 In\n0.249999 0.750001 0.500000 Cu\n0.500000 0.500000 -0.000000 Sn\n0.640343 0.670883 0.547884 Se\n0.122998 0.092459 0.452115 Se\n0.907540 0.359656 0.030538 Se\n0.329116 0.877003 0.969461 Se\n",
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{
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"created_at": "2022-09-04T14:37:46.718242Z",
"updated_at": "2022-09-04T14:37:46.718263Z",
"structure_string": "Rb2 Sc1 Tl1 I6\n1.0\n7.529679 -0.000000 4.347262\n2.509893 7.099049 4.347262\n-0.000000 -0.000000 8.694524\nRb Sc Tl I\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500000 Tl\n0.766394 0.233606 0.233606 I\n0.233606 0.233606 0.766393 I\n0.233606 0.766394 0.766393 I\n0.233606 0.766394 0.233606 I\n0.766394 0.233606 0.766393 I\n0.766394 0.766394 0.233606 I\n",
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{
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"created_at": "2022-09-04T14:37:37.103873Z",
"updated_at": "2022-09-04T14:37:37.103894Z",
"structure_string": "Tb1 Bi2 I1 O4\n1.0\n3.948732 -0.000000 -0.000000\n0.000000 3.948732 -0.000000\n0.000000 -0.000000 9.643401\nTb Bi I O\n1 2 1 4\ndirect\n0.000000 0.000000 0.000000 Tb\n0.500000 0.500000 0.258436 Bi\n0.500000 0.500000 0.741564 Bi\n0.000000 0.000000 0.500000 I\n0.000000 0.500000 0.856897 O\n0.500000 0.000000 0.856897 O\n0.000000 0.500000 0.143103 O\n0.500000 0.000000 0.143103 O\n",
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{
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"created_at": "2022-09-04T14:37:59.063689Z",
"updated_at": "2022-09-04T14:37:59.063735Z",
"structure_string": "Li3 Mn1 V3 O8\n1.0\n3.997977 -0.000100 0.000179\n-1.998907 5.977154 0.004453\n-0.000463 -1.905868 6.275021\nLi Mn V O\n3 1 3 8\ndirect\n0.937199 0.874394 0.638332 Li\n0.831153 0.662313 0.995266 Li\n0.061549 0.123093 0.363652 Li\n0.281929 0.563860 0.695892 Mn\n0.705161 0.410319 0.288205 V\n0.390111 0.780227 0.298242 V\n0.606848 0.213688 0.711817 V\n0.357359 0.714723 0.015023 O\n0.879981 0.759969 0.311311 O\n0.438393 0.876792 0.633977 O\n0.772361 0.544724 0.669172 O\n0.226997 0.453989 0.332750 O\n0.559993 0.119977 0.365605 O\n0.654671 0.309339 -0.000399 O\n0.109186 0.218367 0.675479 O\n",
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]
}