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{
"id": "jvasp-29183",
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{
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{
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"structure_string": "Y4 Ga2 N6\n1.0\n6.534631 0.016716 -0.000000\n-3.124138 5.557350 0.000000\n-0.000000 -0.000000 5.074894\nY Ga N\n4 2 6\ndirect\n0.318597 0.342075 0.448718 Y\n0.681403 0.023477 0.448718 Y\n0.681403 0.657926 0.948718 Y\n0.318597 0.976523 0.948718 Y\n-0.000000 0.663322 0.476892 Ga\n-0.000000 0.336678 0.976892 Ga\n0.306664 0.331010 0.917735 N\n0.693336 0.024348 0.917735 N\n0.693336 0.668990 0.417736 N\n0.306664 0.975653 0.417736 N\n-0.000000 0.627143 0.862197 N\n-0.000000 0.372857 0.362198 N\n",
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{
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"updated_at": "2022-09-04T14:37:06.824063Z",
"structure_string": "Hf10 Cu2 Pb6\n1.0\n4.342857 -7.522048 -0.000000\n4.342857 7.522048 -0.000000\n-0.000000 0.000000 5.863457\nHf Cu Pb\n10 2 6\ndirect\n0.666667 0.333333 0.000000 Hf\n0.258440 0.000000 0.250000 Hf\n0.666667 0.333333 0.500000 Hf\n0.000000 0.741560 0.750000 Hf\n0.333333 0.666667 0.000000 Hf\n0.741561 0.741561 0.250000 Hf\n0.258440 0.258440 0.750000 Hf\n0.741560 0.000000 0.750000 Hf\n0.000000 0.258440 0.250000 Hf\n0.333333 0.666667 0.500000 Hf\n0.000000 0.000000 0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.000000 0.386747 0.750000 Pb\n0.613254 0.613254 0.750000 Pb\n0.386747 0.000000 0.750000 Pb\n0.000000 0.613254 0.250000 Pb\n0.386747 0.386747 0.250000 Pb\n0.613254 0.000000 0.250000 Pb\n",
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{
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"created_at": "2022-09-04T14:37:04.816604Z",
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"structure_string": "Li10 Re2 N8\n1.0\n4.869301 0.000000 0.000000\n0.000000 6.620497 0.000000\n0.000000 0.000000 6.707282\nLi Re N\n10 2 8\ndirect\n0.299753 0.000000 0.000000 Li\n0.245149 0.762440 0.698239 Li\n0.754851 0.262440 0.801760 Li\n0.754851 0.737560 0.198239 Li\n0.754851 0.737560 0.801760 Li\n0.245149 0.237560 0.301760 Li\n0.245149 0.237560 0.698239 Li\n0.245149 0.762440 0.301760 Li\n0.700247 0.500000 0.500000 Li\n0.754851 0.262440 0.198239 Li\n0.277030 0.500000 0.000000 Re\n0.722969 0.000000 0.500000 Re\n0.929994 0.768288 0.500000 N\n0.070006 0.731713 0.000000 N\n0.516966 0.000000 0.730423 N\n0.483034 0.500000 0.230423 N\n0.483034 0.500000 0.769577 N\n0.070006 0.268288 0.000000 N\n0.929994 0.231713 0.500000 N\n0.516966 0.000000 0.269577 N\n",
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{
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"created_at": "2022-09-04T14:35:53.007467Z",
"updated_at": "2022-09-04T14:35:53.007496Z",
"structure_string": "Te4 Mo3 W1 Se2 S2\n1.0\n3.400375 -0.000000 0.000000\n-1.700188 2.944812 -0.000009\n-0.000002 -0.000109 38.721049\nTe Mo W Se S\n4 3 1 2 2\ndirect\n0.333350 0.666703 0.330298 Te\n0.666645 0.333291 0.045456 Te\n0.666643 0.333288 0.142238 Te\n0.333348 0.666699 0.233474 Te\n0.333311 0.666623 0.093796 Mo\n0.333314 0.666627 0.469679 Mo\n0.666683 0.333370 0.281885 Mo\n0.666689 0.333381 0.657535 W\n0.666642 0.333285 0.427044 Se\n0.666649 0.333300 0.512317 Se\n0.333359 0.666720 0.696458 S\n0.333354 0.666708 0.618568 S\n",
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{
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"created_at": "2022-09-04T14:36:51.866058Z",
"updated_at": "2022-09-04T14:36:51.866073Z",
"structure_string": "Mn1 Al1 Ru2\n1.0\n0.000001 2.986931 2.986932\n2.986932 0.000001 2.986933\n2.986932 2.986932 -0.000000\nMn Al Ru\n1 1 2\ndirect\n0.749997 0.749999 0.750003 Mn\n0.250001 0.249999 0.249998 Al\n0.000000 0.999999 0.999998 Ru\n0.500000 0.500001 0.499999 Ru\n",
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{
"id": "jvasp-59785",
"created_at": "2022-09-04T14:36:35.884106Z",
"updated_at": "2022-09-04T14:36:35.884127Z",
"structure_string": "Nb6 Fe2 S12\n1.0\n2.893412 -5.011537 0.000000\n2.893412 5.011537 -0.000000\n0.000000 -0.000000 11.604244\nNb Fe S\n6 2 12\ndirect\n0.666667 0.333332 0.495921 Nb\n0.333332 0.666667 0.995920 Nb\n0.000000 0.000000 0.500000 Nb\n0.000000 0.000000 0.000000 Nb\n0.666667 0.333332 0.004079 Nb\n0.333332 0.666667 0.504079 Nb\n0.333332 0.666667 0.250000 Fe\n0.666667 0.333332 0.750000 Fe\n0.337235 0.331588 0.863099 S\n0.331588 0.994353 0.363100 S\n0.662764 0.668411 0.363100 S\n0.337235 0.005647 0.636900 S\n0.668411 0.662764 0.636900 S\n0.662764 0.994353 0.136900 S\n0.994353 0.331588 0.636900 S\n0.005646 0.668412 0.136900 S\n0.994353 0.662764 0.863099 S\n0.331588 0.337235 0.136900 S\n0.668412 0.005646 0.863099 S\n0.005647 0.337235 0.363100 S\n",
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{
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"created_at": "2022-09-04T14:38:02.429331Z",
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"structure_string": "Mn5 Si4 O14\n1.0\n-5.650691 0.000951 -0.177932\n2.338566 7.113670 0.135390\n-0.420018 -3.430371 -7.311468\nMn Si O\n5 4 14\ndirect\n0.000000 0.000000 0.000000 Mn\n0.097862 0.424463 0.793397 Mn\n0.656769 0.571895 0.711880 Mn\n0.343230 0.428105 0.288120 Mn\n0.902137 0.575537 0.206603 Mn\n0.517626 0.211542 0.858421 Si\n0.758183 0.236219 0.379285 Si\n0.241816 0.763781 0.620716 Si\n0.482373 0.788458 0.141579 Si\n0.476695 0.979091 0.686872 O\n0.580950 0.640750 0.203332 O\n0.000757 0.810429 0.745031 O\n0.325422 0.585979 0.647729 O\n0.669714 0.822907 0.980734 O\n0.330285 0.177093 0.019266 O\n0.523305 0.020909 0.313128 O\n-0.000758 0.189571 0.254969 O\n0.419050 0.359250 0.796668 O\n0.165902 0.658717 0.400011 O\n0.834097 0.341283 0.599989 O\n0.812080 0.314914 0.940873 O\n0.674578 0.414021 0.352271 O\n0.187919 0.685086 0.059127 O\n",
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{
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"structure_string": "Sr2 Ni1 N6 O12\n1.0\n6.105254 -0.000000 3.524870\n2.035084 5.756088 3.524870\n0.000000 0.000000 7.049740\nSr Ni N O\n2 1 6 12\ndirect\n0.250000 0.250001 0.250000 Sr\n0.749999 0.750001 0.750000 Sr\n0.000000 0.000000 0.000000 Ni\n0.202425 0.202425 0.797575 N\n0.202426 0.797575 0.797574 N\n0.797574 0.202425 0.202427 N\n0.797574 0.202425 0.797575 N\n0.202426 0.797575 0.202426 N\n0.797573 0.797575 0.202426 N\n0.607997 -0.000000 0.999999 O\n-0.000000 -0.000000 0.607998 O\n0.607997 -0.000000 0.392003 O\n0.392002 0.000000 0.000001 O\n0.392004 0.607997 0.000000 O\n0.999998 0.392003 0.607997 O\n-0.000000 0.607997 0.392004 O\n0.999998 0.392003 0.000001 O\n0.392002 -0.000000 0.607997 O\n0.607996 0.392003 0.000000 O\n-0.000000 -0.000000 0.392003 O\n-0.000000 0.607997 0.000000 O\n",
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{
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}