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{
"id": "jvasp-22534",
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"structure_string": "Cu4 Te8 Cl4\n1.0\n0.000000 8.245219 0.000117\n5.040777 0.000000 0.000000\n0.000000 -5.582873 -10.779231\nCu Te Cl\n4 8 4\ndirect\n0.827718 0.856894 0.252139 Cu\n0.172283 0.356894 0.247861 Cu\n0.172283 0.143107 0.747861 Cu\n0.827718 0.643107 0.752139 Cu\n0.581658 0.209173 0.139269 Te\n0.418342 0.709174 0.360730 Te\n0.418342 0.790827 0.860730 Te\n0.581658 0.290827 0.639269 Te\n0.264833 0.009767 0.133377 Te\n0.735167 0.509768 0.366623 Te\n0.735167 0.990233 0.866623 Te\n0.264833 0.490233 0.633377 Te\n0.089775 0.104905 0.378764 Cl\n0.910225 0.604905 0.121236 Cl\n0.910225 0.895096 0.621236 Cl\n0.089775 0.395096 0.878764 Cl\n",
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{
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"updated_at": "2022-09-04T14:36:46.254299Z",
"structure_string": "Li2 Dy4 Br10\n1.0\n6.154638 -0.000000 -2.605815\n-0.219932 7.698645 -0.519456\n0.032743 0.158753 8.648518\nLi Dy Br\n2 4 10\ndirect\n0.500000 0.499999 0.500000 Li\n-0.000000 -0.000000 0.500000 Li\n0.263549 0.071301 0.152485 Dy\n0.111064 0.428698 0.847515 Dy\n0.736451 0.928698 0.847515 Dy\n0.888936 0.571301 0.152484 Dy\n0.728657 0.170116 0.584691 Br\n0.143965 0.329883 0.415308 Br\n0.125679 0.750000 -0.000000 Br\n0.874322 0.250000 -0.000001 Br\n0.689203 0.905229 0.181919 Br\n0.507283 0.594770 0.818080 Br\n0.310797 0.094770 0.818080 Br\n0.492717 0.405229 0.181920 Br\n0.856035 0.670116 0.584691 Br\n0.271343 0.829883 0.415308 Br\n",
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{
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"created_at": "2022-09-04T14:37:05.010327Z",
"updated_at": "2022-09-04T14:37:05.010355Z",
"structure_string": "Mg2 Ti4 S10\n1.0\n0.000000 6.063757 -0.004163\n3.826184 0.000000 0.000000\n0.000000 -0.010660 -14.934026\nMg Ti S\n2 4 10\ndirect\n0.047183 0.500000 0.750007 Mg\n0.952824 0.000000 0.249997 Mg\n0.540721 0.000000 0.898915 Ti\n0.459272 0.500000 0.101084 Ti\n0.459279 0.500000 0.398917 Ti\n0.540729 0.000000 0.601081 Ti\n0.618581 0.500000 0.249998 S\n0.381417 0.000000 0.750001 S\n0.337522 0.500000 0.938255 S\n0.662469 0.000000 0.061745 S\n0.337528 0.500000 0.561740 S\n0.662478 0.000000 0.438259 S\n0.889167 0.000000 0.643765 S\n0.110838 0.500000 0.356237 S\n0.110832 0.500000 0.143759 S\n0.889162 0.000000 0.856241 S\n",
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{
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"structure_string": "Zn2 Ag4 Ge2 O8\n1.0\n0.000000 5.641364 -0.010798\n5.580096 0.000000 0.000000\n0.000000 -5.555581 -7.149651\nZn Ag Ge O\n2 4 2 8\ndirect\n0.994507 0.815389 0.497686 Zn\n0.994507 0.184611 0.997686 Zn\n0.525473 0.192568 0.513426 Ag\n0.525473 0.807433 0.013426 Ag\n0.734265 0.297065 0.234768 Ag\n0.734265 0.702935 0.734768 Ag\n0.249078 0.680016 0.249344 Ge\n0.249078 0.319985 0.749344 Ge\n0.596325 0.297515 0.784952 O\n0.596325 0.702486 0.284952 O\n0.289212 0.797591 0.447108 O\n0.289212 0.202409 0.947108 O\n0.142262 0.628099 0.723629 O\n0.966876 0.159385 0.541089 O\n0.142262 0.371902 0.223629 O\n0.966876 0.840615 0.041089 O\n",
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{
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"created_at": "2022-09-04T14:37:04.786835Z",
"updated_at": "2022-09-04T14:37:04.786858Z",
"structure_string": "H8 O8\n1.0\n3.280803 -0.000000 -0.000000\n-0.000000 3.280803 -0.000000\n-0.000000 -0.000000 11.287139\nH O\n8 8\ndirect\n0.649550 0.184210 0.492328 H\n0.350449 0.815789 0.992328 H\n0.184210 0.649550 0.507672 H\n0.684210 0.850449 0.242328 H\n0.315789 0.149550 0.742328 H\n0.850449 0.684210 0.757672 H\n0.149550 0.315789 0.257672 H\n0.815789 0.350449 0.007672 H\n0.964428 0.778457 0.211463 O\n0.035572 0.221542 0.711463 O\n0.778457 0.964428 0.788537 O\n0.278457 0.535571 0.961463 O\n0.721542 0.464428 0.461463 O\n0.535571 0.278457 0.038537 O\n0.464428 0.721542 0.538537 O\n0.221542 0.035572 0.288537 O\n",
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{
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"created_at": "2022-09-04T14:36:57.855418Z",
"updated_at": "2022-09-04T14:36:57.855437Z",
"structure_string": "Ga4 H4 O8\n1.0\n4.496189 3.364691 0.000000\n0.000000 3.364691 4.625671\n4.496189 0.000000 4.625671\nGa H O\n4 4 8\ndirect\n0.097364 0.095643 0.596726 Ga\n0.710267 0.596726 0.095643 Ga\n0.904357 0.902636 0.289733 Ga\n0.403274 0.289733 0.902636 Ga\n0.550266 0.009214 0.642638 H\n0.357362 0.702117 0.449735 H\n-0.009214 0.449734 0.702117 H\n0.297883 0.642638 0.009214 H\n0.027262 0.836438 -0.008875 O\n0.645175 -0.008876 0.836439 O\n0.008875 0.354825 0.972738 O\n0.163561 0.972738 0.354825 O\n0.527025 0.021949 0.490085 O\n0.509915 0.539058 0.472976 O\n-0.021949 0.472975 0.539058 O\n0.460942 0.490085 0.021949 O\n",
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{
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"created_at": "2022-09-04T14:37:04.841575Z",
"updated_at": "2022-09-04T14:37:04.841603Z",
"structure_string": "Li4 Mn4 O8\n1.0\n5.656905 0.089712 -0.303192\n0.089712 5.656905 -0.303192\n-2.879414 -2.879414 5.120217\nLi Mn O\n4 4 8\ndirect\n0.000000 0.000000 0.500000 Li\n0.000000 0.000000 0.000000 Li\n0.198564 0.801435 0.250000 Li\n0.801436 0.198565 0.750001 Li\n0.000000 0.500000 0.500000 Mn\n0.500000 0.500000 0.500001 Mn\n0.500000 -0.000000 0.000000 Mn\n0.500000 0.500000 0.000000 Mn\n0.260644 0.745260 0.976092 O\n0.248281 0.251718 0.478092 O\n0.254741 0.739357 0.523909 O\n0.251718 0.248281 0.978092 O\n0.748282 0.751719 0.021909 O\n0.745259 0.260643 0.476092 O\n0.751719 0.748282 0.521909 O\n0.739356 0.254740 0.023909 O\n",
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{
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"structure_string": "Yb10 Pb6\n1.0\n9.309505 -0.000000 0.000000\n-4.654752 8.062267 -0.000000\n-0.000000 -0.000000 6.717387\nYb Pb\n10 6\ndirect\n0.000000 0.727432 0.750000 Yb\n0.727432 0.727432 0.250000 Yb\n0.272568 0.272568 0.750000 Yb\n0.727432 0.000000 0.750000 Yb\n0.333333 0.666667 0.500000 Yb\n0.272568 0.000000 0.250000 Yb\n0.000000 0.272568 0.250000 Yb\n0.666667 0.333333 0.500000 Yb\n0.333333 0.666667 0.000000 Yb\n0.666667 0.333333 0.000000 Yb\n0.383164 0.383164 0.250000 Pb\n0.000000 0.383164 0.750000 Pb\n0.616836 0.616836 0.750000 Pb\n0.000000 0.616836 0.250000 Pb\n0.616836 0.000000 0.250000 Pb\n0.383164 0.000000 0.750000 Pb\n",
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"structure_string": "Fe4 H4 O8\n1.0\n-4.954550 4.954550 1.438394\n4.954550 -4.954550 1.438394\n4.954550 4.954550 -1.438394\nFe H O\n4 4 8\ndirect\n0.355592 0.845280 0.200826 Fe\n0.644456 0.154768 0.799174 Fe\n0.154718 0.355544 0.510312 Fe\n0.845230 0.644405 0.489687 Fe\n0.078657 0.859743 0.938159 H\n0.921584 0.140498 0.061841 H\n0.140257 0.078415 0.218914 H\n-0.140498 -0.078656 0.781086 H\n0.154538 0.796162 0.950611 O\n0.845548 0.203925 0.049389 O\n0.203838 0.154451 0.358377 O\n0.796072 0.845460 0.641623 O\n0.538352 0.838715 0.377104 O\n0.461613 0.161251 0.622896 O\n0.161283 0.538387 0.699638 O\n0.838748 0.461645 0.300362 O\n",
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{
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{
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"structure_string": "Li4 V2 O2 F8\n1.0\n5.034966 -0.001563 0.001049\n-2.516000 5.029524 -0.052708\n-0.002022 -2.521075 6.611908\nLi V O F\n4 2 2 8\ndirect\n0.368730 0.726189 0.262421 Li\n0.359059 0.726185 0.762420 Li\n0.660416 0.283633 0.233002 Li\n0.624842 0.283643 0.733001 Li\n0.977772 0.997050 0.529400 V\n0.020896 0.997064 0.029406 V\n0.154385 0.993853 0.244230 O\n0.841054 0.993816 0.744221 O\n0.594592 0.829316 0.041221 F\n0.236311 0.829290 0.541207 F\n0.662831 0.634204 0.349237 F\n0.031527 0.363495 0.136007 F\n0.972991 0.634211 0.849254 F\n0.333570 0.363485 0.636023 F\n0.760438 0.169264 0.450140 F\n0.410434 0.169263 0.950128 F\n",
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]
}