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{
"id": "jvasp-63762",
"created_at": "2022-09-04T14:36:17.501124Z",
"updated_at": "2022-09-04T14:36:17.501151Z",
"structure_string": "Rb3 B12 H12 I1\n1.0\n4.827283 -5.143993 -0.001822\n4.827283 5.143993 -0.001822\n-0.651550 -0.000000 7.024159\nRb B H I\n3 12 12 1\ndirect\n0.000000 0.500000 0.500000 Rb\n0.500000 0.500000 0.000000 Rb\n0.500000 0.000000 0.500000 Rb\n0.121406 0.121406 0.841311 B\n0.121406 0.841310 0.121406 B\n0.841310 0.121406 0.121406 B\n0.878594 0.158689 0.878594 B\n0.233159 0.060309 0.060309 B\n0.158689 0.878594 0.878594 B\n0.939691 0.939691 0.766841 B\n0.939691 0.766840 0.939692 B\n0.766840 0.939691 0.939692 B\n0.060309 0.060309 0.233160 B\n0.060309 0.233159 0.060309 B\n0.878594 0.878594 0.158690 B\n0.208987 0.208987 0.729672 H\n0.208987 0.729672 0.208987 H\n0.729672 0.208987 0.208987 H\n0.791012 0.270328 0.791013 H\n0.102977 0.102977 0.398921 H\n0.270328 0.791012 0.791013 H\n0.102977 0.398921 0.102977 H\n0.398921 0.102977 0.102977 H\n0.897022 0.601079 0.897023 H\n0.601079 0.897022 0.897023 H\n0.791012 0.791012 0.270328 H\n0.897022 0.897022 0.601080 H\n0.500000 0.500000 0.500000 I\n",
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"structure_string": "Sr4 Mg2\n1.0\n4.145157 -0.000000 0.000000\n-2.072578 3.589810 -0.000000\n-0.000000 0.000000 17.812764\nSr Mg\n4 2\ndirect\n0.333333 0.666667 0.901992 Sr\n0.333333 0.666667 0.598007 Sr\n0.666667 0.333333 0.401992 Sr\n0.666667 0.333333 0.098007 Sr\n0.666667 0.333333 0.750000 Mg\n0.333333 0.666667 0.250000 Mg\n",
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{
"id": "jvasp-19087",
"created_at": "2022-09-04T14:37:00.247620Z",
"updated_at": "2022-09-04T14:37:00.247648Z",
"structure_string": "Na8 N8 O8\n1.0\n0.000000 5.115398 0.017769\n9.187041 0.000000 0.000000\n0.000000 -0.936573 -5.994172\nNa N O\n8 8 8\ndirect\n0.212841 0.247113 0.068422 Na\n0.787159 0.747113 0.431577 Na\n0.787159 0.752887 0.931577 Na\n0.212842 0.252887 0.568422 Na\n0.318644 0.935622 0.220474 Na\n0.681356 0.435622 0.279526 Na\n0.681357 0.064378 0.779526 Na\n0.318644 0.564378 0.720473 Na\n0.095483 0.571792 0.246893 N\n0.786024 0.171179 0.347246 N\n0.786024 0.328821 0.847245 N\n0.213977 0.828821 0.652754 N\n0.904517 0.071792 0.253107 N\n0.904518 0.428207 0.753106 N\n0.095483 0.928207 0.746893 N\n0.213977 0.671179 0.152754 N\n0.471083 0.848026 0.631175 O\n0.471082 0.651974 0.131175 O\n0.528918 0.151974 0.368824 O\n0.528918 0.348026 0.868824 O\n0.231202 0.450607 0.323195 O\n0.768799 0.950607 0.176805 O\n0.768799 0.549393 0.676805 O\n0.231202 0.049393 0.823195 O\n",
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{
"id": "jvasp-8399",
"created_at": "2022-09-04T14:37:07.708286Z",
"updated_at": "2022-09-04T14:37:07.708322Z",
"structure_string": "Ti2 S4\n1.0\n4.930232 -0.000000 -2.242322\n-1.019831 4.823600 -2.242322\n-0.085826 -0.105869 6.352547\nTi S\n2 4\ndirect\n0.250000 0.750000 0.500000 Ti\n0.000000 0.000000 0.000000 Ti\n0.880582 0.875000 0.250001 S\n0.624999 0.119418 0.750000 S\n0.369417 0.375000 0.250000 S\n0.124999 0.630582 0.750000 S\n",
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{
"id": "jvasp-24901",
"created_at": "2022-09-04T14:37:43.575146Z",
"updated_at": "2022-09-04T14:37:43.575177Z",
"structure_string": "Sb2 S2 Cl18\n1.0\n7.054386 -0.005294 -1.919556\n-3.361993 6.487411 -0.244130\n-0.073651 -0.021869 13.751012\nSb S Cl\n2 2 18\ndirect\n0.000000 0.000000 0.000000 Sb\n0.000000 0.500000 0.500000 Sb\n0.565827 0.150494 0.716320 S\n0.434174 0.849507 0.283680 S\n0.172936 0.794870 0.967807 Cl\n0.891640 0.701235 0.592873 Cl\n0.148111 0.036970 0.185080 Cl\n0.827065 0.205130 0.032193 Cl\n0.384352 0.211870 0.596222 Cl\n0.772368 0.431132 0.802215 Cl\n0.366333 0.687910 0.612857 Cl\n0.693161 0.693161 -0.000000 Cl\n0.615649 0.788131 0.403778 Cl\n0.306840 0.306840 -0.000000 Cl\n0.108362 0.298765 0.407127 Cl\n0.075052 0.753475 0.387142 Cl\n0.628918 0.970152 0.197784 Cl\n0.924950 0.246526 0.612857 Cl\n0.633668 0.312090 0.387142 Cl\n0.227633 0.568868 0.197785 Cl\n0.371084 0.029848 0.802215 Cl\n0.851891 0.963031 0.814920 Cl\n",
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{
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"created_at": "2022-09-04T14:36:42.463592Z",
"updated_at": "2022-09-04T14:36:42.463625Z",
"structure_string": "Ca2 O2\n1.0\n-2.345153 -2.345070 0.000000\n-2.345153 2.345070 0.000000\n2.345153 0.000000 -6.769702\nCa O\n2 2\ndirect\n0.094885 0.228186 0.323072 Ca\n0.771813 0.905115 0.676927 Ca\n0.268397 0.401694 0.670091 O\n0.598305 0.731602 0.329909 O\n",
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{
"id": "jvasp-29401",
"created_at": "2022-09-04T14:37:58.244342Z",
"updated_at": "2022-09-04T14:37:58.244359Z",
"structure_string": "Al2 H6 O6\n1.0\n4.949894 -0.014454 -0.751816\n-2.790081 3.976574 -1.541081\n0.127782 -0.208857 5.355357\nAl H O\n2 6 6\ndirect\n0.169234 0.335488 0.002736 Al\n0.830765 0.664511 0.997264 Al\n0.562252 0.876166 0.792359 H\n0.090849 0.665239 0.426147 H\n0.437747 0.123833 0.207640 H\n0.909150 0.334760 0.573852 H\n0.670830 0.792460 0.425732 H\n0.329169 0.207539 0.574267 H\n0.240064 0.120023 0.212209 O\n0.037613 0.503283 0.776359 O\n0.962386 0.496716 0.223641 O\n0.400389 0.239768 0.770723 O\n0.759935 0.879976 0.787791 O\n0.599610 0.760232 0.229277 O\n",
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{
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"created_at": "2022-09-04T14:37:11.479564Z",
"updated_at": "2022-09-04T14:37:11.479583Z",
"structure_string": "Ca2 Zn2\n1.0\n5.135146 0.000000 0.000000\n-2.567573 4.447166 0.000000\n-0.000000 0.000000 6.131903\nCa Zn\n2 2\ndirect\n0.333334 0.666668 0.062499 Ca\n0.666668 0.333333 0.562499 Ca\n0.333334 0.666668 0.562501 Zn\n0.666668 0.333333 0.062501 Zn\n",
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{
"id": "jvasp-117307",
"created_at": "2022-09-04T14:38:26.115167Z",
"updated_at": "2022-09-04T14:38:26.115193Z",
"structure_string": "Tc1 Cl6 O6\n1.0\n5.234097 -0.500147 2.758365\n-0.188394 6.035822 1.207440\n-0.309646 0.214372 8.446478\nTc Cl O\n1 6 6\ndirect\n0.001983 0.953655 0.003931 Tc\n0.320357 0.943880 0.728613 Cl\n0.681194 0.953710 0.281598 Cl\n0.936843 0.304704 0.880127 Cl\n0.714507 0.788872 0.935440 Cl\n0.291102 0.116199 0.072006 Cl\n0.073836 0.604510 0.127997 Cl\n0.267806 0.345247 0.427105 O\n0.485522 0.417555 0.312170 O\n0.543738 0.500680 0.645120 O\n0.697944 0.366697 0.603697 O\n-0.037083 0.920757 0.510134 O\n0.086254 0.761529 0.491064 O\n",
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{
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"created_at": "2022-09-04T14:36:48.849326Z",
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{
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"structure_string": "K4 Na8 Be4 O10\n1.0\n5.959840 0.000000 0.000000\n0.000000 5.959840 0.000000\n0.000000 0.000000 10.020967\nK Na Be O\n4 8 4 10\ndirect\n0.319396 0.319396 0.000000 K\n0.180604 0.819396 0.500000 K\n0.819396 0.180604 0.500000 K\n0.680604 0.680604 0.000000 K\n0.500000 0.000000 0.750000 Na\n0.500000 0.000000 0.250000 Na\n0.000000 0.500000 0.750000 Na\n0.000000 0.500000 0.250000 Na\n0.000000 0.000000 0.226009 Na\n0.500000 0.500000 0.726009 Na\n0.500000 0.500000 0.273991 Na\n0.000000 0.000000 0.773991 Na\n0.187756 0.812244 0.000000 Be\n0.812244 0.187756 0.000000 Be\n0.687756 0.687756 0.500000 Be\n0.312244 0.312244 0.500000 Be\n0.724989 0.275011 0.861714 O\n0.224989 0.224989 0.361714 O\n0.275011 0.724989 0.861714 O\n0.775011 0.775011 0.638286 O\n0.724989 0.275011 0.138286 O\n0.275011 0.724989 0.138286 O\n0.224989 0.224989 0.638286 O\n0.775011 0.775011 0.361714 O\n0.000000 0.000000 0.000000 O\n0.500000 0.500000 0.500000 O\n",
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"formula_full": "K4 Na8 Be4 O10",
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{
"id": "jvasp-117759",
"created_at": "2022-09-04T14:38:49.631330Z",
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"structure_string": "Ca1 Br1 O1\n1.0\n4.740988 0.000000 0.000000\n-2.370494 4.105816 -0.000000\n0.000000 -0.000000 4.635342\nCa Br O\n1 1 1\ndirect\n0.333334 0.666668 0.000000 Ca\n0.000000 0.000000 0.000000 Br\n0.666668 0.333334 0.000000 O\n",
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}
]
}