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{
"id": "jvasp-44685",
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"structure_string": "Co4 Ni1 O8\n1.0\n5.641689 -0.007877 -0.063721\n-2.813496 4.918846 0.079307\n-2.769411 -1.512030 4.665766\nCo Ni O\n4 1 8\ndirect\n0.000000 0.500001 0.500001 Co\n0.000000 0.000000 0.000000 Co\n0.500000 0.500000 0.000000 Co\n0.000000 0.500001 0.000000 Co\n0.500000 -0.000000 0.000000 Ni\n0.535295 0.274834 0.795666 O\n0.033756 0.764271 0.787659 O\n0.518264 0.764267 0.787673 O\n0.032354 0.276862 0.787758 O\n0.967647 0.723139 0.212244 O\n0.481737 0.235734 0.212329 O\n0.966245 0.235730 0.212342 O\n0.464706 0.725167 0.204336 O\n",
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{
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{
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"updated_at": "2022-09-04T14:38:08.468356Z",
"structure_string": "Mn4 Cd2 O8\n1.0\n5.234978 -0.000000 -2.655638\n-1.347171 5.058669 -2.655638\n-0.008668 -0.011278 6.470511\nMn Cd O\n4 2 8\ndirect\n0.000000 0.000000 0.000000 Mn\n0.500000 -0.000000 0.500000 Mn\n0.000001 -0.000000 0.500001 Mn\n0.000001 0.499999 -0.000000 Mn\n0.624999 0.375000 0.250000 Cd\n0.375000 0.624999 0.749998 Cd\n0.766464 0.800573 0.532925 O\n0.767646 0.233536 0.967073 O\n0.199426 0.233536 0.967073 O\n0.233536 0.199428 0.467073 O\n0.233536 0.767645 0.467073 O\n0.232353 0.766463 0.032926 O\n0.766462 0.232354 0.532926 O\n0.800573 0.766463 0.032927 O\n",
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{
"id": "jvasp-22896",
"created_at": "2022-09-04T14:38:08.467533Z",
"updated_at": "2022-09-04T14:38:08.467552Z",
"structure_string": "Sr2 Ni10 As6\n1.0\n3.783427 -0.000000 0.000000\n-1.891714 6.148140 -0.000000\n0.000000 0.000000 11.958670\nSr Ni As\n2 10 6\ndirect\n0.164912 0.329824 0.750000 Sr\n0.835090 0.670176 0.250000 Sr\n0.452443 0.904884 0.855187 Ni\n0.807141 0.614278 0.567074 Ni\n0.547559 0.095116 0.144813 Ni\n0.807141 0.614278 0.932926 Ni\n0.452443 0.904884 0.644813 Ni\n0.000000 0.000000 0.500000 Ni\n0.000000 0.000000 0.000000 Ni\n0.192861 0.385722 0.432926 Ni\n0.547559 0.095116 0.355187 Ni\n0.192861 0.385722 0.067074 Ni\n0.378398 0.756793 0.458966 As\n0.887479 0.774956 0.750000 As\n0.378398 0.756793 0.041034 As\n0.621604 0.243207 0.958966 As\n0.112523 0.225044 0.250000 As\n0.621604 0.243207 0.541034 As\n",
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{
"id": "jvasp-37586",
"created_at": "2022-09-04T14:38:08.466160Z",
"updated_at": "2022-09-04T14:38:08.466195Z",
"structure_string": "Sm10 Sb6\n1.0\n9.191259 0.000048 0.000000\n-4.595590 7.959892 0.000000\n0.000000 0.000000 6.385673\nSm Sb\n10 6\ndirect\n0.248510 0.999993 0.250000 Sm\n0.751489 0.000006 0.750000 Sm\n0.999993 0.248511 0.250000 Sm\n0.751485 0.751485 0.250000 Sm\n0.248516 0.248516 0.750000 Sm\n0.000007 0.751489 0.750000 Sm\n0.333334 0.666668 -0.000000 Sm\n0.666667 0.333335 0.500000 Sm\n0.666667 0.333335 0.000000 Sm\n0.333334 0.666668 0.500000 Sm\n0.613692 0.000003 0.250000 Sb\n0.386308 -0.000002 0.750000 Sb\n0.000002 0.613691 0.250000 Sb\n0.386312 0.386313 0.250000 Sb\n0.613687 0.613688 0.750000 Sb\n-0.000002 0.386308 0.750000 Sb\n",
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{
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"updated_at": "2022-09-04T14:38:08.465726Z",
"structure_string": "Ta2 Pd3 Ru3\n1.0\n3.921784 0.000000 0.000000\n0.000000 4.018712 0.000000\n-0.000000 -0.000000 7.654007\nTa Pd Ru\n2 3 3\ndirect\n0.000000 0.000000 0.243794 Ta\n0.000000 0.000000 0.756207 Ta\n0.500000 0.500000 0.249411 Pd\n0.500000 0.500000 0.750589 Pd\n-0.000000 0.500000 0.500000 Pd\n-0.000000 0.500000 -0.000000 Ru\n0.500000 0.000000 0.500000 Ru\n0.500000 0.000000 -0.000000 Ru\n",
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"density_atomic": 0.06631787133984196,
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"formula_full": "Ta2 Pd3 Ru3",
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{
"id": "jvasp-37127",
"created_at": "2022-09-04T14:38:08.449872Z",
"updated_at": "2022-09-04T14:38:08.449892Z",
"structure_string": "Pd2 N2\n1.0\n1.514782 -2.623679 -0.000000\n1.514782 2.623679 -0.000000\n-0.000000 0.000000 5.450454\nPd N\n2 2\ndirect\n0.000000 0.000000 0.500000 Pd\n0.000000 0.000000 0.000000 Pd\n0.333332 0.666666 0.250000 N\n0.666666 0.333332 0.749999 N\n",
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{
"id": "jvasp-32287",
"created_at": "2022-09-04T14:38:08.444204Z",
"updated_at": "2022-09-04T14:38:08.444218Z",
"structure_string": "Si6 C2 Cl16\n1.0\n7.572025 -0.018278 -3.758296\n-2.417444 8.503466 -0.851433\n0.003172 0.060791 9.023120\nSi C Cl\n6 2 16\ndirect\n0.112326 0.429837 0.604716 Si\n0.887675 0.570163 0.395284 Si\n0.691752 0.203825 0.338455 Si\n0.308249 0.796175 0.661545 Si\n0.982909 0.283890 0.216492 Si\n0.017092 0.716110 0.783508 Si\n0.909854 0.357193 0.377729 C\n0.090147 0.642807 0.622271 C\n0.095546 0.314702 0.784904 Cl\n0.904455 0.685299 0.215096 Cl\n0.716424 0.980909 0.300911 Cl\n0.356001 0.418062 0.614189 Cl\n0.467424 0.222866 0.129504 Cl\n0.532578 0.777134 0.870497 Cl\n0.627441 0.213913 0.531538 Cl\n0.372560 0.786087 0.468462 Cl\n0.100443 0.102612 0.275470 Cl\n0.899558 0.897388 0.724531 Cl\n0.762345 0.207599 0.979206 Cl\n0.237656 0.792401 0.020794 Cl\n0.169722 0.452165 0.193611 Cl\n0.830279 0.547835 0.806389 Cl\n0.644000 0.581939 0.385812 Cl\n0.283577 0.019091 0.699089 Cl\n",
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{
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"created_at": "2022-09-04T14:38:08.443148Z",
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"structure_string": "Pr2 Rh2\n1.0\n-3.991694 -0.000000 -0.000000\n-0.000000 0.000000 -4.239561\n-1.995848 -5.542256 0.000000\nPr Rh\n2 2\ndirect\n0.141230 0.750000 0.717540 Pr\n0.858769 0.250000 0.282461 Pr\n0.414607 0.750000 0.170785 Rh\n0.585392 0.250000 0.829216 Rh\n",
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{
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"created_at": "2022-09-04T14:38:08.442855Z",
"updated_at": "2022-09-04T14:38:08.442881Z",
"structure_string": "Li4 In4 Se8\n1.0\n6.883777 0.000000 0.000000\n0.000000 7.273111 0.000000\n0.000000 0.000000 8.442552\nLi In Se\n4 4 8\ndirect\n0.999093 0.587471 0.876304 Li\n0.499093 0.412529 0.123696 Li\n0.499093 0.912528 0.376304 Li\n0.999093 0.087471 0.623696 Li\n0.997839 0.580956 0.374507 In\n0.497839 0.419043 0.625492 In\n0.497839 0.919043 0.874507 In\n0.997839 0.080956 0.125492 In\n0.616149 0.083247 0.132683 Se\n0.116149 0.916753 0.867317 Se\n0.116149 0.416753 0.632682 Se\n0.616149 0.583247 0.367317 Se\n0.129721 0.419164 0.118635 Se\n0.629721 0.580836 0.881365 Se\n0.629721 0.080836 0.618634 Se\n0.129721 0.919164 0.381365 Se\n",
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{
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"created_at": "2022-09-04T14:38:08.436064Z",
"updated_at": "2022-09-04T14:38:08.436092Z",
"structure_string": "Li4 Ni2 C4 O12\n1.0\n5.099380 -0.001468 0.001677\n-2.507786 5.464775 0.012254\n-0.002523 -0.018636 7.848949\nLi Ni C O\n4 2 4 12\ndirect\n0.691409 0.315479 0.057543 Li\n0.815031 0.193154 0.557555 Li\n0.191361 0.815458 0.442203 Li\n0.315004 0.693096 0.942235 Li\n0.503207 0.504317 0.499884 Ni\n0.003208 0.004306 -0.000116 Ni\n0.277568 0.126737 0.735135 C\n0.228857 0.381869 0.235133 C\n0.777561 0.626731 0.764625 C\n0.728824 0.881865 0.264621 C\n0.907641 0.655105 0.910132 O\n0.598733 0.853477 0.410128 O\n0.896149 0.598283 0.624518 O\n0.519628 0.615909 0.753311 O\n0.486796 0.392706 0.246448 O\n0.019629 0.115907 0.746455 O\n0.098785 0.353506 0.089622 O\n0.407656 0.155119 0.589626 O\n0.396154 0.098290 0.875243 O\n0.610241 0.910312 0.124513 O\n0.110249 0.410296 0.375238 O\n0.986772 0.892710 0.253303 O\n",
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{
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"updated_at": "2022-09-04T14:38:08.433453Z",
"structure_string": "Na6 Mn2 P2 C2 O14\n1.0\n0.000000 5.282388 -0.002550\n6.621327 0.000000 0.000000\n0.000000 -0.077293 -9.002156\nNa Mn P C O\n6 2 2 2 14\ndirect\n-0.000040 0.513567 0.999952 Na\n0.560739 0.763701 0.836402 Na\n0.500109 0.513412 0.500065 Na\n0.499892 0.013412 0.499935 Na\n0.439262 0.263701 0.163599 Na\n0.000041 0.013567 0.000049 Na\n0.979963 0.263456 0.704567 Mn\n0.020038 0.763456 0.295433 Mn\n0.984093 0.263470 0.342675 P\n0.015908 0.763470 0.657325 P\n0.502719 0.263477 0.850410 C\n0.497282 0.763477 0.149590 C\n0.072620 0.450419 0.251038 O\n0.072867 0.076514 0.251129 O\n0.443192 0.763338 0.288982 O\n0.696382 0.263390 0.364561 O\n0.127414 0.263578 0.494837 O\n0.872587 0.763579 0.505164 O\n0.680849 0.263519 0.950776 O\n0.556809 0.263337 0.711019 O\n0.927134 0.576514 0.748871 O\n0.927381 0.950419 0.748962 O\n0.265802 0.263562 0.892937 O\n0.734199 0.763562 0.107063 O\n0.303619 0.763390 0.635439 O\n0.319152 0.763519 0.049225 O\n",
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}
]
}