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{
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{
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{
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{
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{
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{
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"structure_string": "Zr4 Se16 Cl24\n1.0\n11.114009 0.000000 0.000000\n0.000000 11.114009 0.000000\n0.000000 0.000000 11.048019\nZr Se Cl\n4 16 24\ndirect\n0.750000 0.750000 0.250000 Zr\n0.750000 0.250000 0.750000 Zr\n0.250000 0.250000 0.250000 Zr\n0.250000 0.750000 0.750000 Zr\n0.839253 0.660747 0.830566 Se\n0.660747 0.839253 0.669434 Se\n0.644983 0.644983 0.750000 Se\n0.144983 0.855017 0.250000 Se\n0.144983 0.144983 0.750000 Se\n0.355017 0.355017 0.750000 Se\n0.339253 0.160747 0.669434 Se\n0.160747 0.339253 0.830566 Se\n0.855017 0.144983 0.250000 Se\n0.355017 0.644983 0.250000 Se\n0.855017 0.855017 0.750000 Se\n0.644983 0.355017 0.250000 Se\n0.660747 0.160747 0.169434 Se\n0.839253 0.339253 0.330566 Se\n0.160747 0.660747 0.330566 Se\n0.339253 0.839253 0.169434 Se\n0.807287 0.919595 0.110067 Cl\n0.614512 0.114512 0.860571 Cl\n0.692713 0.419595 0.889933 Cl\n0.885488 0.614512 0.139429 Cl\n0.307287 0.580405 0.889933 Cl\n0.419595 0.692713 0.610067 Cl\n0.192713 0.080405 0.110067 Cl\n0.692713 0.580405 0.389933 Cl\n0.080405 0.192713 0.389933 Cl\n0.580405 0.692713 0.110067 Cl\n0.307287 0.419595 0.389933 Cl\n0.192713 0.919595 0.610067 Cl\n0.114512 0.385488 0.139429 Cl\n0.580405 0.307287 0.610067 Cl\n0.614512 0.885488 0.360571 Cl\n0.419595 0.307287 0.110067 Cl\n0.114512 0.614512 0.639429 Cl\n0.919595 0.192713 0.889933 Cl\n0.080405 0.807287 0.889933 Cl\n0.385488 0.885488 0.860571 Cl\n0.919595 0.807287 0.389933 Cl\n0.885488 0.385488 0.639429 Cl\n0.807287 0.080405 0.610067 Cl\n0.385488 0.114512 0.360571 Cl\n",
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{
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},
{
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],
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},
{
"id": "mp-756361",
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"structure_string": "Zr4 Se4 O4\n1.0\n5.887382 0.000000 0.000000\n0.000000 5.887382 0.000000\n0.000000 0.000000 5.887382\nZr Se O\n4 4 4\ndirect\n0.077999 0.077999 0.077999 Zr\n0.422001 0.922001 0.577999 Zr\n0.577999 0.422001 0.922001 Zr\n0.922001 0.577999 0.422001 Zr\n0.159000 0.659000 0.841000 Se\n0.341000 0.341000 0.341000 Se\n0.659000 0.841000 0.159000 Se\n0.841000 0.159000 0.659000 Se\n0.151187 0.848813 0.348813 O\n0.348813 0.151187 0.848813 O\n0.651187 0.651187 0.651187 O\n0.848813 0.348813 0.151187 O\n",
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]
}