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{
"id": "mp-865143",
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"structure_string": "Ba2 Yb2 Cd2 Sb4\n1.0\n2.388695 -9.441808 0.000000\n2.388695 9.441808 0.000000\n0.000000 0.000000 7.464598\nBa Yb Cd Sb\n2 2 2 4\ndirect\n0.697560 0.302440 0.524675 Ba\n0.302440 0.697560 0.024675 Ba\n0.519767 0.480233 0.223501 Yb\n0.480233 0.519767 0.723501 Yb\n0.093224 0.906776 0.893639 Cd\n0.906776 0.093224 0.393639 Cd\n0.058984 0.941016 0.503300 Sb\n0.666039 0.333961 0.010746 Sb\n0.333961 0.666039 0.510746 Sb\n0.941016 0.058984 0.003300 Sb\n",
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{
"id": "mp-1214205",
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"structure_string": "Ba2 Yb2 Al6 Si2 N8 O6\n1.0\n3.096281 -5.362916 0.000000\n3.096281 5.362916 0.000000\n0.000000 0.000000 10.192267\nBa Yb Al Si N O\n2 2 6 2 8 6\ndirect\n0.666667 0.333333 0.553470 Ba\n0.333333 0.666667 0.053470 Ba\n0.666667 0.333333 0.925745 Yb\n0.333333 0.666667 0.425745 Yb\n0.165493 0.330986 0.741130 Al\n0.165493 0.834507 0.741130 Al\n0.834507 0.669014 0.241130 Al\n0.669014 0.834507 0.741130 Al\n0.834507 0.165493 0.241130 Al\n0.330986 0.165493 0.241130 Al\n0.000000 0.000000 0.001896 Si\n0.000000 0.000000 0.501896 Si\n0.150206 0.300412 0.560299 N\n0.150206 0.849794 0.560299 N\n0.849794 0.699588 0.060299 N\n0.699588 0.849794 0.560299 N\n0.849794 0.150206 0.060299 N\n0.300412 0.150206 0.060299 N\n0.000000 0.000000 0.822246 N\n0.000000 0.000000 0.322246 N\n0.487534 0.975068 0.791888 O\n0.487534 0.512466 0.791888 O\n0.512466 0.024932 0.291888 O\n0.024932 0.512466 0.791888 O\n0.512466 0.487534 0.291888 O\n0.975068 0.487534 0.291888 O\n",
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"formula_full": "Ba2 Yb2 Al6 Si2 N8 O6",
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"spacegroup": 186
},
{
"id": "mp-684785",
"created_at": "2022-09-04T14:46:58.289962Z",
"structure_string": "Ba2 Yb2 Al4 Si4 N10 O4\n1.0\n6.069501 0.000000 0.000000\n-2.769756 6.992467 0.000000\n-0.507642 -0.560745 8.077177\nBa Yb Al Si N O\n2 2 4 4 10 4\ndirect\n0.350185 0.592647 0.752020 Ba\n0.696629 0.338471 0.193507 Ba\n0.334673 0.748765 0.388866 Yb\n0.770793 0.414694 0.787042 Yb\n0.730337 0.916399 0.067808 Al\n0.152384 0.290122 0.029028 Al\n0.099555 0.763086 0.065013 Al\n0.800332 0.693258 0.467990 Al\n0.377525 0.019149 0.704275 Si\n0.771436 0.085300 0.471602 Si\n0.319639 0.269994 0.439158 Si\n0.877087 0.950054 0.782888 Si\n0.700917 0.876409 0.590163 N\n0.842513 0.756327 0.901776 N\n0.131753 0.074868 0.688525 N\n0.083935 0.202736 0.576109 N\n0.846187 0.123602 0.923093 N\n0.025761 0.969679 0.187718 N\n0.993728 0.795642 0.286865 N\n0.520136 0.162111 0.543634 N\n0.486068 0.504814 0.426513 N\n0.186401 0.172331 0.238277 N\n0.429721 0.353246 0.941509 O\n0.424991 0.837991 0.108141 O\n0.063895 0.504528 0.018551 O\n0.983420 0.583775 0.561129 O\n",
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"formula_full": "Ba2 Yb2 Al4 Si4 N10 O4",
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"spacegroup": 1
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{
"id": "mp-684853",
"created_at": "2022-09-04T14:41:27.824282Z",
"structure_string": "Ba2 Yb2 Al4 Si3 N10 O4\n1.0\n6.807299 0.000000 0.000000\n-3.016467 6.519538 0.000000\n-0.295941 -1.788352 8.049037\nBa Yb Al Si N O\n2 2 4 3 10 4\ndirect\n0.613857 0.318099 0.154511 Ba\n0.413548 0.760617 0.613435 Ba\n0.653503 0.298204 0.807020 Yb\n0.178858 0.559045 0.209240 Yb\n0.839790 0.172921 0.459618 Al\n0.089296 0.770972 0.913813 Al\n0.545692 0.821601 0.040716 Al\n0.185035 0.385192 0.845923 Al\n0.876348 0.607436 0.500144 Si\n0.963967 0.928620 0.197597 Si\n0.431539 0.283757 0.499088 Si\n0.977434 0.774836 0.348987 N\n0.437622 0.532177 0.008652 N\n0.998741 0.496861 0.948427 N\n0.202892 0.894181 0.382590 N\n0.234931 0.087390 0.338207 N\n0.391647 0.936352 0.940662 N\n0.755555 0.999846 0.233407 N\n0.991755 0.440176 0.434740 N\n0.596367 0.513442 0.452111 N\n0.936323 0.151019 0.690808 N\n0.972701 0.732419 0.696395 O\n0.582470 0.158242 0.536115 O\n0.780722 0.040818 0.780273 O\n0.349406 0.335778 0.679419 O\n",
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"formula_full": "Ba2 Yb2 Al4 Si3 N10 O4",
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{
"id": "mp-1248373",
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"structure_string": "Ba2 Yb2 Al4 Si3 N10 O4\n1.0\n7.488521 -0.853575 1.017030\n-4.501551 6.616837 -1.188456\n1.283054 -0.910418 8.190602\nBa Yb Al Si N O\n2 2 4 3 10 4\ndirect\n0.408870 0.654367 0.092217 Ba\n0.662013 0.483147 0.620873 Ba\n0.292550 0.706201 0.797964 Yb\n0.740108 0.238741 0.220067 Yb\n0.661947 0.839683 0.458544 Al\n0.339776 0.101116 0.921551 Al\n0.746985 0.506006 0.049736 Al\n0.799889 0.200835 0.832661 Al\n0.284105 0.855927 0.476865 Si\n0.059693 0.941985 0.201541 Si\n0.113473 0.418457 0.483325 Si\n0.208842 0.985223 0.382508 N\n0.972341 0.465080 0.000366 N\n0.513456 0.055611 0.988394 N\n0.195696 0.144423 0.474294 N\n0.090203 0.166904 0.384430 N\n0.518735 0.396551 0.925394 N\n0.771564 0.713842 0.248843 N\n0.568062 0.971368 0.394032 N\n0.081283 0.563061 0.397683 N\n0.758304 0.947119 0.684541 N\n0.242676 0.915858 0.694108 O\n0.387030 0.580643 0.524333 O\n0.640738 0.781001 0.794854 O\n0.941661 0.366851 0.662777 O\n",
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{
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"structure_string": "Ba2 Yb2 Al4 Si2 N10 O4\n1.0\n6.237166 0.000113 -0.653068\n-3.118588 5.524372 0.326477\n-0.750014 0.000098 9.173706\nBa Yb Al Si N O\n2 2 4 2 10 4\ndirect\n0.396075 0.702787 0.186950 Ba\n0.693327 0.297234 0.686915 Ba\n0.320200 0.691256 0.818724 Yb\n0.628941 0.308833 0.318666 Yb\n0.163803 0.829432 0.460356 Al\n0.122195 0.329172 0.434945 Al\n0.334433 0.170586 0.960372 Al\n0.793030 0.670806 0.934958 Al\n0.630192 0.770148 0.547106 Si\n0.860012 0.229795 0.047092 Si\n0.001058 0.007459 0.029327 N\n0.982464 0.506374 0.956693 N\n0.550637 0.044747 0.990640 N\n0.485468 0.490972 0.988146 N\n0.476011 0.493574 0.456696 N\n0.967722 0.882113 0.164945 N\n0.505928 0.955275 0.490662 N\n0.993568 0.992528 0.529325 N\n0.994432 0.509023 0.488071 N\n0.085572 0.117877 0.664958 N\n0.184804 0.977580 0.267562 O\n0.947449 0.272045 0.233149 O\n0.207275 0.022495 0.767561 O\n0.675401 0.727891 0.733180 O\n",
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{
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{
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{
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{
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"structure_string": "Ba2 Yb1 Sb1 O6\n1.0\n0.000000 4.657140 4.657140\n4.657140 0.000000 4.657140\n4.657140 4.657140 0.000000\nBa Yb Sb O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.500000 Sb\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.000000 O\n0.500000 0.500000 0.000000 O\n0.000000 0.500000 0.500000 O\n",
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