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{
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{
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{
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"structure_string": "Ba6 Ca2 Ir4 O18\n1.0\n5.940578 -0.002137 -0.038606\n-2.968083 5.145966 -0.038606\n0.049977 0.086483 14.669669\nBa Ca Ir O\n6 2 4 18\ndirect\n0.334599 0.667985 0.088251 Ba\n0.332016 0.665402 0.411748 Ba\n0.999831 0.000168 0.250000 Ba\n0.000170 0.999831 0.750000 Ba\n0.667985 0.334597 0.588251 Ba\n0.665403 0.332014 0.911748 Ba\n0.000000 0.000000 0.000000 Ca\n0.000000 -0.000000 0.500000 Ca\n0.336097 0.669332 0.663211 Ir\n0.663904 0.330668 0.336788 Ir\n0.669332 0.336096 0.163211 Ir\n0.330669 0.663904 0.836788 Ir\n0.981192 0.490772 0.251871 O\n0.509228 0.018809 0.248129 O\n0.018810 0.509228 0.748129 O\n0.351151 0.172985 0.410032 O\n0.490730 0.509270 0.750000 O\n0.173134 0.816560 0.911899 O\n0.183441 0.826867 0.588100 O\n0.826867 0.183439 0.088100 O\n0.816561 0.173133 0.411899 O\n0.637811 0.816348 0.913932 O\n0.183653 0.362190 0.586068 O\n0.362190 0.183652 0.086068 O\n0.816349 0.637810 0.413932 O\n0.172985 0.351151 0.910032 O\n0.648850 0.827015 0.589967 O\n0.827016 0.648849 0.089967 O\n0.509271 0.490729 0.250000 O\n0.490773 0.981191 0.751871 O\n",
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{
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"structure_string": "Ba3 Ca1 O4\n1.0\n5.447673 -0.000000 -0.000000\n-0.000000 5.447673 0.000000\n0.000000 0.000000 5.447673\nBa Ca O\n3 1 4\ndirect\n0.000000 0.000000 0.500000 Ba\n0.000000 0.500000 0.000000 Ba\n0.500000 0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 O\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
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{
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"created_at": "2022-09-04T14:38:43.020795Z",
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{
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"structure_string": "Ba3 Cd2 As4\n1.0\n-0.000000 4.639002 0.000000\n0.034570 0.000000 7.362847\n7.955988 -2.319500 -3.232837\nBa Cd As\n3 2 4\ndirect\n0.857403 0.419229 0.714807 Ba\n0.142596 0.580771 0.285193 Ba\n0.000000 0.000000 0.000000 Ba\n0.668079 0.972454 0.336158 Cd\n0.331921 0.027546 0.663843 Cd\n0.792459 0.805216 0.584919 As\n0.207540 0.194784 0.415081 As\n0.503839 0.674929 0.007679 As\n0.496161 0.325071 0.992321 As\n",
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{
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"created_at": "2022-09-04T14:38:55.498597Z",
"updated_at": "2022-09-04T14:38:55.498624Z",
"structure_string": "Ba3 Cd1 Si2 O8\n1.0\n5.774166 -0.000000 0.000000\n-2.887083 5.000575 0.000000\n-0.000000 -0.000000 7.444768\nBa Cd Si O\n3 1 2 8\ndirect\n0.333334 0.666667 0.667715 Ba\n0.666667 0.333334 0.332285 Ba\n0.000000 0.000000 0.000000 Ba\n0.000000 0.000000 0.500000 Cd\n0.333334 0.666667 0.221006 Si\n0.666667 0.333334 0.778994 Si\n0.333334 0.666667 0.004327 O\n0.666667 0.333334 0.995673 O\n0.179183 0.820818 0.304832 O\n0.820818 0.179183 0.695169 O\n0.179183 0.358365 0.304832 O\n0.820819 0.641636 0.695169 O\n0.641636 0.820818 0.304832 O\n0.358365 0.179183 0.695169 O\n",
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{
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"structure_string": "Ba6 Co2 Ir4 O18\n1.0\n5.776696 0.000000 0.000000\n-2.888348 5.002765 0.000000\n-0.000000 -0.000000 14.333421\nBa Co Ir O\n6 2 4 18\ndirect\n0.333334 0.666667 0.086633 Ba\n0.666667 0.333334 0.913367 Ba\n0.666667 0.333334 0.586633 Ba\n0.333334 0.666667 0.413367 Ba\n0.000000 0.000000 0.250000 Ba\n0.000000 0.000000 0.750000 Ba\n0.000000 0.000000 0.000000 Co\n0.000000 0.000000 0.500000 Co\n0.333334 0.666667 0.845004 Ir\n0.666667 0.333334 0.154996 Ir\n0.666667 0.333334 0.345004 Ir\n0.333334 0.666667 0.654996 Ir\n0.666469 0.833235 0.919833 O\n0.833235 0.166766 0.419833 O\n0.333532 0.166766 0.080167 O\n0.166766 0.833235 0.580167 O\n0.166766 0.333532 0.919833 O\n0.333532 0.166766 0.419833 O\n0.833235 0.666469 0.080167 O\n0.666469 0.833235 0.580167 O\n0.974978 0.487488 0.250000 O\n0.166766 0.333532 0.580167 O\n0.487488 0.512513 0.750000 O\n0.512513 0.487488 0.250000 O\n0.025023 0.512513 0.750000 O\n0.833235 0.166766 0.080167 O\n0.487488 0.974978 0.750000 O\n0.512512 0.025023 0.250000 O\n0.833235 0.666469 0.419833 O\n0.166766 0.833235 0.919833 O\n",
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{
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"structure_string": "Ba3 Cr2 O8\n1.0\n5.386167 0.006233 5.820136\n2.283994 4.877931 5.820136\n0.009787 0.006233 7.929986\nBa Cr O\n3 2 8\ndirect\n0.793890 0.793888 0.793891 Ba\n0.206111 0.206111 0.206111 Ba\n0.000000 0.000000 0.000000 Ba\n0.592596 0.592595 0.592597 Cr\n0.407405 0.407404 0.407405 Cr\n0.671391 0.671389 0.671392 O\n0.328610 0.328609 0.328610 O\n0.273461 0.273459 0.757718 O\n0.273460 0.757717 0.273461 O\n0.757718 0.273459 0.273461 O\n0.726541 0.242282 0.726541 O\n0.726540 0.726539 0.242284 O\n0.242283 0.726539 0.726541 O\n",
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"structure_string": "Ba6 Cr2 O10\n1.0\n-1.822958 6.216061 -3.436402\n0.013510 0.018042 7.849268\n6.477854 0.000000 -3.436402\nBa Cr O\n6 2 10\ndirect\n0.750000 0.500000 0.750000 Ba\n0.250000 0.500000 0.250001 Ba\n0.321850 0.999998 0.178148 Ba\n0.678147 0.999998 0.821849 Ba\n0.178150 0.000002 0.678148 Ba\n0.821853 0.000002 0.321853 Ba\n0.250000 0.500000 0.749998 Cr\n0.750000 0.500000 0.250000 Cr\n0.021520 0.314643 0.793122 O\n0.706879 0.685361 0.478481 O\n0.978480 0.685360 0.206878 O\n0.478479 0.685358 0.978479 O\n0.000000 0.000000 0.000000 O\n0.521519 0.314639 0.021518 O\n0.500000 -0.000000 0.500000 O\n0.293122 0.314643 0.521520 O\n0.206878 0.685358 0.706877 O\n0.793120 0.314639 0.293120 O\n",
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}