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{
"id": "jvasp-118110",
"created_at": "2022-09-04T14:38:50.693789Z",
"updated_at": "2022-09-04T14:38:50.693814Z",
"structure_string": "Cl1 O1\n1.0\n3.041790 0.000000 0.000000\n-0.000000 3.041790 0.000000\n0.000000 0.000000 3.370220\nCl O\n1 1\ndirect\n0.000000 0.000000 0.000000 Cl\n0.500001 0.500001 0.000000 O\n",
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{
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"structure_string": "Ca1 Ga1 H1\n1.0\n4.862712 -0.000000 -0.000000\n-2.431356 4.211232 -0.000000\n0.000000 0.000000 3.279421\nCa Ga H\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ca\n0.333333 0.666666 0.000000 Ga\n0.666666 0.333333 0.000000 H\n",
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{
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"updated_at": "2022-09-04T14:38:32.691564Z",
"structure_string": "K3 Ca1 P2 O8\n1.0\n5.726410 -0.027128 0.158575\n2.882777 4.947939 0.158575\n-0.214140 -0.122397 7.399958\nK Ca P O\n3 1 2 8\ndirect\n0.000000 0.000000 0.000000 K\n0.333404 0.333403 0.687889 K\n0.666597 0.666597 0.312113 K\n0.000000 -0.000000 0.500000 Ca\n0.333177 0.333177 0.241302 P\n0.666823 0.666822 0.758700 P\n0.332980 0.332980 0.033839 O\n0.667021 0.667019 0.966163 O\n0.186176 0.186176 0.313874 O\n0.813825 0.813824 0.686128 O\n0.186247 0.627348 0.313764 O\n0.627349 0.186247 0.313764 O\n0.813753 0.372651 0.686237 O\n0.372652 0.813753 0.686237 O\n",
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{
"id": "jvasp-100079",
"created_at": "2022-09-04T14:36:35.870472Z",
"updated_at": "2022-09-04T14:36:35.870488Z",
"structure_string": "K2 Li1 Eu1 Cl6\n1.0\n6.302756 0.000000 3.638898\n2.100918 5.942296 3.638898\n-0.000000 -0.000000 7.277796\nK Li Eu Cl\n2 1 1 6\ndirect\n0.750000 0.750001 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Eu\n0.742677 0.257323 0.257323 Cl\n0.257323 0.257323 0.742677 Cl\n0.257323 0.742677 0.742677 Cl\n0.257323 0.742677 0.257323 Cl\n0.742677 0.257323 0.742677 Cl\n0.742677 0.742677 0.257323 Cl\n",
"nsites": 10,
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"volume": 272.57414200615307,
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"formula_full": "K2 Li1 Eu1 Cl6",
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{
"id": "jvasp-117053",
"created_at": "2022-09-04T14:38:45.987667Z",
"updated_at": "2022-09-04T14:38:45.987717Z",
"structure_string": "Mg2 Al3 Cr1 S8\n1.0\n6.236646 0.000093 3.600822\n2.078715 5.909057 3.600770\n0.000023 0.000055 7.201671\nMg Al Cr S\n2 3 1 8\ndirect\n0.874277 0.877166 0.874281 Mg\n0.125723 0.122835 0.125718 Mg\n0.500001 0.500000 0.499999 Al\n0.499998 0.499999 0.000001 Al\n-0.000000 0.500000 0.499999 Al\n0.500001 0.999999 0.499999 Cr\n0.737714 0.738557 0.737708 S\n0.262287 0.261442 0.713977 S\n0.261743 0.714780 0.261738 S\n0.713977 0.261450 0.262286 S\n0.738256 0.285219 0.738262 S\n0.286024 0.738549 0.737713 S\n0.262288 0.261438 0.262296 S\n0.737712 0.738556 0.286025 S\n",
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{
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"created_at": "2022-09-04T14:38:03.020727Z",
"updated_at": "2022-09-04T14:38:03.020751Z",
"structure_string": "Na8 Zn4 S8\n1.0\n0.000000 6.853022 0.031372\n7.055452 0.000000 0.000000\n0.000000 -0.529329 -8.799031\nNa Zn S\n8 4 8\ndirect\n0.546607 0.674967 0.678225 Na\n0.953392 0.174967 0.321775 Na\n0.453392 0.325033 0.321775 Na\n0.046607 0.825033 0.678225 Na\n0.512219 0.764262 0.052873 Na\n0.987781 0.264263 0.947127 Na\n0.487781 0.235737 0.947127 Na\n0.012219 0.735737 0.052873 Na\n0.344237 0.903463 0.370420 Zn\n0.155762 0.403463 0.629580 Zn\n0.655762 0.096536 0.629580 Zn\n0.844237 0.596536 0.370420 Zn\n0.302624 0.106654 0.591571 S\n0.197375 0.606654 0.408429 S\n0.697375 0.893346 0.408430 S\n0.802624 0.393346 0.591571 S\n0.246252 0.044452 0.143656 S\n0.253748 0.544452 0.856344 S\n0.753748 0.955547 0.856344 S\n0.746252 0.455547 0.143657 S\n",
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"elements": [
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"density": 2.74100536206762,
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"formula_full": "Na8 Zn4 S8",
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{
"id": "jvasp-97879",
"created_at": "2022-09-04T14:35:41.327949Z",
"updated_at": "2022-09-04T14:35:41.327979Z",
"structure_string": "Rb2 Na10 Be16 O22\n1.0\n6.457864 0.031670 0.077671\n3.154905 7.962608 4.104760\n-0.020299 0.046367 10.612109\nRb Na Be O\n2 10 16 22\ndirect\n0.751682 0.235332 0.061678 Rb\n0.248318 0.764668 0.938322 Rb\n0.749096 0.945441 0.973555 Na\n0.127773 0.860002 0.627967 Na\n0.741185 0.732834 0.539901 Na\n0.247729 0.553555 0.517846 Na\n0.909685 0.636830 0.857428 Na\n0.258815 0.267167 0.460099 Na\n0.090315 0.363171 0.142572 Na\n0.752270 0.446446 0.482153 Na\n0.872227 0.139999 0.372033 Na\n0.250903 0.054560 0.026445 Na\n0.505613 0.592378 0.746558 Be\n0.276360 0.386975 0.851882 Be\n0.039950 0.656231 0.215630 Be\n0.960050 0.343770 0.784370 Be\n0.093910 0.155204 0.701707 Be\n0.333023 0.718859 0.240433 Be\n0.218060 0.890409 0.355782 Be\n0.666976 0.281141 0.759567 Be\n0.614837 0.785037 0.272424 Be\n0.385163 0.214963 0.727575 Be\n0.781940 0.109591 0.644218 Be\n0.723640 0.613026 0.148118 Be\n0.446824 0.087830 0.275632 Be\n0.553176 0.912171 0.724368 Be\n0.906090 0.844797 0.298293 Be\n0.494387 0.407623 0.253442 Be\n0.516017 0.769336 0.137752 O\n0.564323 0.265636 0.623289 O\n0.711896 0.435693 0.208433 O\n0.694803 0.459509 0.720229 O\n0.305197 0.540491 0.279771 O\n0.930216 0.151887 0.823339 O\n0.785513 0.927336 0.716091 O\n0.068301 0.355392 0.914693 O\n0.288104 0.564308 0.791567 O\n0.931699 0.644609 0.085307 O\n0.638225 0.960853 0.243970 O\n0.530425 0.758686 0.718461 O\n0.877025 0.657368 0.335883 O\n0.122975 0.342633 0.664117 O\n0.361775 0.039148 0.756030 O\n0.018008 0.851303 0.428592 O\n0.469575 0.241315 0.281539 O\n0.069783 0.848113 0.176661 O\n0.483983 0.230665 0.862248 O\n0.435677 0.734364 0.376711 O\n0.214486 0.072665 0.283909 O\n0.981992 0.148698 0.571408 O\n",
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"formula_full": "Rb2 Na10 Be16 O22",
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{
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"created_at": "2022-09-04T14:38:08.476010Z",
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"structure_string": "Li8 Ni1 O4 F2\n1.0\n5.186941 -0.032537 -0.022480\n-1.759166 4.997155 0.051959\n-2.386640 -0.913549 5.066458\nLi Ni O F\n8 1 4 2\ndirect\n0.187155 0.444630 0.291042 Li\n0.071782 0.200607 0.625276 Li\n0.429292 0.862197 0.634518 Li\n0.588075 0.243215 -0.047340 Li\n0.411924 0.756785 0.047341 Li\n0.570708 0.137803 0.365483 Li\n0.928217 0.799394 0.374724 Li\n0.812845 0.555370 0.708959 Li\n0.000000 0.000000 0.000000 Ni\n0.845469 0.097305 0.229761 O\n0.208966 0.806328 0.251004 O\n0.791034 0.193672 0.748997 O\n0.154531 0.902695 0.770240 O\n0.421348 0.509443 0.710534 F\n0.578652 0.490558 0.289467 F\n",
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{
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"updated_at": "2022-09-04T14:38:45.782439Z",
"structure_string": "Na1 Li1 As1\n1.0\n4.851444 0.000000 -0.000000\n-2.425722 4.201474 0.000000\n-0.000000 -0.000000 3.115589\nNa Li As\n1 1 1\ndirect\n0.666666 0.333333 0.000000 Na\n0.333333 0.666665 0.000000 Li\n0.000000 0.000000 0.000000 As\n",
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{
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"created_at": "2022-09-04T14:38:48.716347Z",
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"structure_string": "Na1 Zn1\n1.0\n4.203716 0.000000 0.000000\n0.000000 4.203716 -0.000000\n0.000000 -0.000000 3.029508\nNa Zn\n1 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.000000 Zn\n",
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{
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"structure_string": "Rb4 Ga4 Cl16\n1.0\n7.028187 0.000000 0.000000\n-0.000000 9.261600 0.000000\n0.000000 0.000000 11.053057\nRb Ga Cl\n4 4 16\ndirect\n0.750000 0.819842 0.682749 Rb\n0.250000 0.180158 0.317251 Rb\n0.250000 0.319842 0.817251 Rb\n0.750000 0.680158 0.182749 Rb\n0.250000 0.810475 0.931827 Ga\n0.750000 0.189525 0.068174 Ga\n0.750000 0.310475 0.568174 Ga\n0.250000 0.689525 0.431826 Ga\n-0.001786 0.830740 0.422941 Cl\n0.498214 0.169260 0.577059 Cl\n-0.001786 0.669260 0.922941 Cl\n0.498214 0.330740 0.077059 Cl\n0.001786 0.169260 0.577059 Cl\n0.501786 0.830740 0.422941 Cl\n0.250000 0.550974 0.270769 Cl\n0.250000 0.568315 0.602325 Cl\n0.750000 0.050974 0.229231 Cl\n0.250000 0.949026 0.770769 Cl\n0.501786 0.669260 0.922941 Cl\n0.750000 0.431685 0.397675 Cl\n0.750000 0.068315 0.897675 Cl\n0.250000 0.931685 0.102325 Cl\n0.750000 0.449026 0.729231 Cl\n0.001786 0.330740 0.077059 Cl\n",
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{
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]
}