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{
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"structure_string": "Nb6 Cl16\n1.0\n3.396725 -5.883299 0.000000\n3.396725 5.883299 0.000000\n0.000000 0.000000 12.281528\nNb Cl\n6 16\ndirect\n0.527892 0.055786 0.246310 Nb\n0.944213 0.472106 0.246310 Nb\n0.527892 0.472107 0.246310 Nb\n0.472106 0.944213 0.753691 Nb\n0.472107 0.527892 0.753691 Nb\n0.055786 0.527892 0.753691 Nb\n0.167869 0.832129 0.618668 Cl\n0.832129 0.664258 0.381332 Cl\n0.832129 0.167869 0.381332 Cl\n0.335741 0.167870 0.381332 Cl\n0.835831 0.671663 0.864347 Cl\n0.328336 0.164168 0.864347 Cl\n0.835831 0.164167 0.864347 Cl\n0.671663 0.835831 0.135653 Cl\n0.164167 0.835831 0.135653 Cl\n0.664258 0.832129 0.618668 Cl\n0.666666 0.333332 0.642839 Cl\n0.333332 0.666666 0.357161 Cl\n0.333332 0.666666 0.904666 Cl\n0.666666 0.333332 0.095334 Cl\n0.164168 0.328336 0.135653 Cl\n0.167870 0.335741 0.618668 Cl\n",
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"structure_string": "Yb10 Sn6\n1.0\n9.238505 -0.000051 0.000000\n-4.619296 8.000814 0.000000\n0.000000 0.000000 6.640898\nYb Sn\n10 6\ndirect\n0.333329 0.666670 0.000000 Yb\n0.666669 0.333330 0.500000 Yb\n0.666669 0.333330 -0.000000 Yb\n0.333329 0.666670 0.500000 Yb\n0.274489 0.000010 0.250000 Yb\n0.725510 0.999990 0.750000 Yb\n0.000010 0.274487 0.250000 Yb\n0.725546 0.725546 0.250000 Yb\n0.274452 0.274453 0.750000 Yb\n0.999989 0.725512 0.750000 Yb\n0.617532 0.000005 0.250000 Sn\n0.382467 0.999994 0.750000 Sn\n0.000005 0.617531 0.250000 Sn\n0.382502 0.382502 0.250000 Sn\n0.617497 0.617497 0.750000 Sn\n-0.000006 0.382468 0.750000 Sn\n",
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"structure_string": "K4 B4 S14\n1.0\n6.408078 -0.000000 2.208989\n2.920458 7.289569 1.927139\n-0.035559 0.050369 10.502274\nK B S\n4 4 14\ndirect\n0.869322 0.315565 0.477694 K\n0.130678 0.684436 0.522306 K\n0.662580 0.184436 0.022306 K\n0.337421 0.815565 0.977694 K\n0.841257 0.617431 0.149087 B\n0.607774 0.882569 0.350912 B\n0.158744 0.382569 0.850912 B\n0.392226 0.117431 0.649087 B\n0.095543 0.112116 0.730501 S\n0.061840 0.612116 0.230501 S\n0.148791 0.624859 0.839127 S\n0.387223 0.124859 0.339127 S\n0.851209 0.375141 0.160873 S\n0.612777 0.875141 0.660873 S\n0.841029 0.757650 0.973794 S\n0.572474 0.742350 0.526206 S\n0.457597 0.250000 0.750000 S\n0.427526 0.257650 0.473794 S\n0.904458 0.887884 0.269499 S\n0.938160 0.387884 0.769498 S\n0.542404 0.750000 0.250000 S\n0.158971 0.242350 0.026206 S\n",
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"created_at": "2022-09-04T14:37:05.035577Z",
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"structure_string": "K4 B4 S14\n1.0\n6.408078 -0.000000 2.208989\n2.920458 7.289569 1.927139\n-0.035559 0.050369 10.502274\nK B S\n4 4 14\ndirect\n0.869322 0.315565 0.477694 K\n0.130678 0.684436 0.522306 K\n0.662580 0.184436 0.022306 K\n0.337421 0.815565 0.977694 K\n0.841257 0.617431 0.149087 B\n0.607774 0.882569 0.350912 B\n0.158744 0.382569 0.850912 B\n0.392226 0.117431 0.649087 B\n0.095543 0.112116 0.730501 S\n0.061840 0.612116 0.230501 S\n0.148791 0.624859 0.839127 S\n0.387223 0.124859 0.339127 S\n0.851209 0.375141 0.160873 S\n0.612777 0.875141 0.660873 S\n0.841029 0.757650 0.973794 S\n0.572474 0.742350 0.526206 S\n0.457597 0.250000 0.750000 S\n0.427526 0.257650 0.473794 S\n0.904458 0.887884 0.269499 S\n0.938160 0.387884 0.769498 S\n0.542404 0.750000 0.250000 S\n0.158971 0.242350 0.026206 S\n",
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"structure_string": "Na8 Nb8 O24\n1.0\n5.559064 -0.000000 0.000000\n-0.000000 5.641841 0.000000\n0.000000 0.000000 15.648914\nNa Nb O\n8 8 24\ndirect\n0.257357 0.250000 0.000000 Na\n0.742642 0.750000 0.500000 Na\n0.742642 0.750000 0.000000 Na\n0.257357 0.250000 0.500000 Na\n0.259491 0.203803 0.250000 Na\n0.259491 0.296196 0.750000 Na\n0.740509 0.703803 0.250000 Na\n0.740509 0.796196 0.750000 Na\n0.243986 0.725855 0.374728 Nb\n0.243986 0.774144 0.625271 Nb\n0.756013 0.274145 0.874728 Nb\n0.756013 0.225855 0.125272 Nb\n0.756013 0.225855 0.374728 Nb\n0.243986 0.774144 0.874728 Nb\n0.243986 0.725855 0.125272 Nb\n0.756013 0.274145 0.625271 Nb\n0.544149 0.536866 0.644325 O\n0.175285 0.722821 0.750000 O\n0.175285 0.777179 0.250000 O\n0.677565 0.250000 0.500000 O\n0.322434 0.750000 0.000000 O\n0.322434 0.750000 0.500000 O\n0.677565 0.250000 0.000000 O\n0.455851 0.463134 0.144325 O\n0.455851 0.036866 0.855674 O\n0.544149 0.963134 0.355674 O\n0.544149 0.536866 0.855674 O\n0.956003 0.953326 0.893399 O\n0.455851 0.036866 0.644325 O\n0.455851 0.463134 0.355674 O\n0.043996 0.046673 0.106600 O\n0.043996 0.453327 0.893399 O\n0.956003 0.546673 0.393399 O\n0.956003 0.953326 0.606600 O\n0.824714 0.277179 0.250000 O\n0.956003 0.546673 0.106600 O\n0.043996 0.453327 0.606600 O\n0.043996 0.046673 0.393399 O\n0.544149 0.963134 0.144325 O\n0.824714 0.222821 0.750000 O\n",
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{
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"structure_string": "Tb6 Sb8 Au6\n1.0\n-4.969147 4.969147 4.969147\n4.969147 -4.969147 4.969147\n4.969147 4.969147 -4.969147\nTb Sb Au\n6 8 6\ndirect\n0.750001 0.875001 0.625000 Tb\n0.875001 0.750001 0.125000 Tb\n0.625000 0.250000 0.375000 Tb\n0.125000 0.375000 0.250000 Tb\n0.375000 0.125000 0.750001 Tb\n0.250000 0.625000 0.875001 Tb\n0.500000 0.500000 0.680186 Sb\n0.000000 0.180186 0.500000 Sb\n0.819815 0.319815 0.819815 Sb\n0.680186 0.000000 0.000000 Sb\n0.000000 0.680186 0.500000 Sb\n0.319815 0.819815 0.319815 Sb\n0.180186 0.000000 0.000000 Sb\n0.500000 0.500000 0.180186 Sb\n0.750001 0.375000 0.125000 Au\n0.250000 0.125000 0.375000 Au\n0.375000 0.750001 0.625000 Au\n0.125000 0.250000 0.875001 Au\n0.625000 0.875001 0.250000 Au\n0.875001 0.625000 0.750001 Au\n",
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"structure_string": "Rb4 H16 S4 N4 O16\n1.0\n6.080665 -0.000000 0.000000\n0.000000 7.612053 0.000000\n0.000000 0.000000 10.603413\nRb H S N O\n4 16 4 4 16\ndirect\n0.750001 0.822823 0.601463 Rb\n0.250000 0.677177 0.101463 Rb\n0.750001 0.322823 0.898537 Rb\n0.250000 0.177177 0.398537 Rb\n0.250000 0.587718 0.654251 H\n0.750001 0.514756 0.201867 H\n0.113377 0.392724 0.676197 H\n0.613377 0.107276 0.176197 H\n0.250000 0.485244 0.798132 H\n0.750001 0.912282 0.154251 H\n0.113377 0.892724 0.823803 H\n0.750001 0.412282 0.345749 H\n0.613377 0.607276 0.323803 H\n0.886624 0.607276 0.323803 H\n0.886624 0.107276 0.176197 H\n0.250000 0.087718 0.845749 H\n0.250000 0.985244 0.701867 H\n0.386623 0.892724 0.823803 H\n0.750001 0.014756 0.298132 H\n0.386623 0.392724 0.676197 H\n0.750001 0.766709 0.927245 S\n0.250000 0.733291 0.427245 S\n0.750001 0.266709 0.572754 S\n0.250000 0.233291 0.072754 S\n0.250000 0.967261 0.798162 N\n0.750001 0.532738 0.298162 N\n0.750001 0.032739 0.201837 N\n0.250000 0.467261 0.701837 N\n0.450333 0.308530 0.133847 O\n0.750001 0.959443 0.913527 O\n0.250000 0.284045 0.936133 O\n0.049667 0.308530 0.133847 O\n0.750001 0.459443 0.586473 O\n0.750001 0.715954 0.063866 O\n0.549667 0.191470 0.633847 O\n0.450333 0.808529 0.366153 O\n0.250000 0.784045 0.563866 O\n0.549667 0.691470 0.866153 O\n0.950334 0.191470 0.633847 O\n0.250000 0.540557 0.413527 O\n0.950334 0.691470 0.866153 O\n0.750001 0.215955 0.436134 O\n0.250000 0.040557 0.086473 O\n0.049667 0.808529 0.366153 O\n",
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"elements": [
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"formula_reduced": "Tl2SO4",
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{
"id": "jvasp-30024",
"created_at": "2022-09-04T14:38:08.598936Z",
"updated_at": "2022-09-04T14:38:08.598964Z",
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}