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{
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{
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{
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{
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"structure_string": "Co8 P8 H32 Cl8 O24\n1.0\n7.466098 0.000000 0.000000\n0.000000 9.561864 0.000000\n0.000000 0.000000 13.403546\nCo P H Cl O\n8 8 32 8 24\ndirect\n0.618508 0.354814 0.501212 Co\n0.118508 0.645186 0.998788 Co\n0.381492 0.145186 0.001212 Co\n0.881492 0.854814 0.498788 Co\n0.381492 0.645186 0.498788 Co\n0.881492 0.354814 0.001212 Co\n0.618508 0.854814 0.998788 Co\n0.118508 0.145186 0.501212 Co\n0.725074 0.110141 0.151444 P\n0.225074 0.889859 0.348556 P\n0.274926 0.389859 0.651444 P\n0.774926 0.610141 0.848556 P\n0.274926 0.889859 0.848556 P\n0.774926 0.110141 0.651444 P\n0.725074 0.610141 0.348556 P\n0.225074 0.389859 0.151444 P\n0.798777 0.010072 0.216833 H\n0.298777 0.989928 0.283167 H\n0.201223 0.489928 0.716833 H\n0.701223 0.510072 0.783167 H\n0.201223 0.989928 0.783167 H\n0.701223 0.010072 0.716833 H\n0.798777 0.510072 0.283167 H\n0.298777 0.489928 0.216833 H\n0.631907 0.207044 0.211628 H\n0.131907 0.792956 0.288372 H\n0.368093 0.292956 0.711628 H\n0.868093 0.707044 0.788372 H\n0.368093 0.792956 0.788372 H\n0.868093 0.207044 0.711628 H\n0.631907 0.707044 0.288372 H\n0.131907 0.292956 0.211628 H\n0.071522 0.076894 0.088880 H\n0.571522 0.923106 0.411120 H\n0.928478 0.423106 0.588880 H\n0.428478 0.576894 0.911120 H\n0.928478 0.923106 0.911120 H\n0.428478 0.076894 0.588880 H\n0.071522 0.576894 0.411120 H\n0.571522 0.423106 0.088880 H\n0.206160 0.943268 0.094738 H\n0.706160 0.056732 0.405262 H\n0.793840 0.556732 0.594738 H\n0.293840 0.443268 0.905262 H\n0.793840 0.056732 0.905262 H\n0.293840 0.943268 0.594738 H\n0.206160 0.443268 0.405262 H\n0.706160 0.556732 0.094738 H\n0.375241 0.237750 0.400949 Cl\n0.875241 0.762250 0.099051 Cl\n0.624759 0.262250 0.900949 Cl\n0.124759 0.737750 0.599051 Cl\n0.624759 0.762250 0.599051 Cl\n0.124759 0.237750 0.900949 Cl\n0.375241 0.737750 0.099051 Cl\n0.875241 0.262250 0.400949 Cl\n0.584438 0.036434 0.085642 O\n0.084438 0.963566 0.414358 O\n0.415562 0.463566 0.585642 O\n0.915562 0.536434 0.914358 O\n0.415562 0.963566 0.914358 O\n0.915562 0.036434 0.585642 O\n0.584438 0.536434 0.414358 O\n0.084438 0.463566 0.085642 O\n0.198097 0.045841 0.095545 O\n0.698097 0.954159 0.404455 O\n0.801903 0.454159 0.595545 O\n0.301903 0.545841 0.904455 O\n0.801903 0.954159 0.904455 O\n0.301903 0.045841 0.595545 O\n0.198097 0.545841 0.404455 O\n0.698097 0.454159 0.095545 O\n0.880451 0.180948 0.096161 O\n0.380451 0.819052 0.403839 O\n0.119549 0.319052 0.596161 O\n0.619549 0.680948 0.903839 O\n0.119549 0.819052 0.903839 O\n0.619549 0.180948 0.596161 O\n0.880451 0.680948 0.403839 O\n0.380451 0.319052 0.096161 O\n",
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{
"id": "mp-30171",
"created_at": "2022-09-04T14:39:33.099609Z",
"structure_string": "Ho8 Ge18 Ir26\n1.0\n4.000786 0.000000 0.000000\n0.000000 11.316667 0.000000\n0.000000 0.000000 19.514630\nHo Ge Ir\n8 18 26\ndirect\n0.500000 0.500000 0.022674 Ho\n0.000000 0.000000 0.977326 Ho\n0.000000 0.191274 0.792434 Ho\n0.500000 0.308726 0.207566 Ho\n0.500000 0.691274 0.207566 Ho\n0.000000 0.808726 0.792434 Ho\n0.000000 0.500000 0.480934 Ho\n0.500000 0.000000 0.519066 Ho\n0.500000 0.186261 0.918739 Ge\n0.000000 0.000000 0.398840 Ge\n0.500000 0.500000 0.601160 Ge\n0.500000 0.000000 0.099781 Ge\n0.000000 0.500000 0.900219 Ge\n0.000000 0.820448 0.584619 Ge\n0.500000 0.679552 0.415381 Ge\n0.500000 0.320448 0.415381 Ge\n0.000000 0.313739 0.081261 Ge\n0.000000 0.686261 0.081261 Ge\n0.500000 0.813739 0.918739 Ge\n0.000000 0.500000 0.265345 Ge\n0.000000 0.179552 0.584619 Ge\n0.500000 0.000000 0.734655 Ge\n0.500000 0.369740 0.731158 Ge\n0.500000 0.630260 0.731158 Ge\n0.000000 0.869740 0.268842 Ge\n0.000000 0.130260 0.268842 Ge\n0.500000 0.200354 0.046057 Ir\n0.500000 0.690372 0.539813 Ir\n0.500000 0.309628 0.539813 Ir\n0.000000 0.190372 0.460187 Ir\n0.500000 0.872666 0.354469 Ir\n0.000000 0.627334 0.645531 Ir\n0.000000 0.372666 0.645531 Ir\n0.500000 0.127334 0.354469 Ir\n0.000000 0.299646 0.953943 Ir\n0.000000 0.700354 0.953943 Ir\n0.500000 0.799646 0.046057 Ir\n0.500000 0.500000 0.342386 Ir\n0.000000 0.000000 0.657614 Ir\n0.000000 0.500000 0.141006 Ir\n0.500000 0.000000 0.858994 Ir\n0.000000 0.500000 0.772950 Ir\n0.500000 0.000000 0.227050 Ir\n0.500000 0.182944 0.664674 Ir\n0.000000 0.317056 0.335326 Ir\n0.000000 0.682944 0.335326 Ir\n0.500000 0.817056 0.664674 Ir\n0.000000 0.123909 0.142058 Ir\n0.500000 0.376091 0.857942 Ir\n0.500000 0.623909 0.857942 Ir\n0.000000 0.876091 0.142058 Ir\n0.000000 0.809628 0.460187 Ir\n",
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{
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{
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{
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{
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{
"id": "mp-1190476",
"created_at": "2022-09-04T14:39:30.017829Z",
"structure_string": "Na4 Zn2 Ge4 Se12\n1.0\n-3.973983 3.973983 9.525760\n3.973983 -3.973983 9.525760\n3.973983 3.973983 -9.525760\nNa Zn Ge Se\n4 2 4 12\ndirect\n0.382577 0.382577 0.000000 Na\n0.882577 0.882577 0.000000 Na\n0.617423 0.617423 0.000000 Na\n0.117423 0.117423 0.000000 Na\n0.750000 0.250000 0.500000 Zn\n0.250000 0.750000 0.500000 Zn\n0.915049 0.415049 0.500000 Ge\n0.415049 0.915049 0.500000 Ge\n0.084951 0.584951 0.500000 Ge\n0.584951 0.084951 0.500000 Ge\n0.838088 0.338088 0.176176 Se\n0.161912 0.661912 0.823824 Se\n0.338088 0.161912 0.500000 Se\n0.661912 0.838088 0.500000 Se\n0.672137 0.505274 0.500000 Se\n0.005274 0.172137 0.500000 Se\n0.172137 0.672137 0.166863 Se\n0.505274 0.005274 0.833137 Se\n0.327863 0.494726 0.500000 Se\n0.994726 0.827863 0.500000 Se\n0.827863 0.327863 0.833137 Se\n0.494726 0.994726 0.166863 Se\n",
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},
{
"id": "mp-1198712",
"created_at": "2022-09-04T14:39:30.028649Z",
"structure_string": "Y20 Ir12\n1.0\n10.949270 0.000000 0.000000\n0.000000 10.949270 0.000000\n0.000000 0.000000 6.401502\nY Ir\n20 12\ndirect\n0.291391 0.088046 0.377807 Y\n0.291391 0.911954 0.877807 Y\n0.708609 0.088046 0.877807 Y\n0.708609 0.911954 0.377807 Y\n0.588046 0.791391 0.877807 Y\n0.588046 0.208609 0.377807 Y\n0.411954 0.791391 0.377807 Y\n0.411954 0.208609 0.877807 Y\n0.208609 0.411954 0.622193 Y\n0.208609 0.588046 0.122193 Y\n0.791391 0.411954 0.122193 Y\n0.791391 0.588046 0.622193 Y\n0.911954 0.708609 0.122193 Y\n0.911954 0.291391 0.622193 Y\n0.088046 0.708609 0.622193 Y\n0.088046 0.291391 0.122193 Y\n0.000000 0.000000 0.500000 Y\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.000000 Y\n0.500000 0.500000 0.500000 Y\n0.846662 0.153338 0.250000 Ir\n0.846662 0.846662 0.750000 Ir\n0.153338 0.153338 0.750000 Ir\n0.153338 0.846662 0.250000 Ir\n0.653338 0.346662 0.750000 Ir\n0.653338 0.653338 0.250000 Ir\n0.346662 0.346662 0.250000 Ir\n0.346662 0.653338 0.750000 Ir\n0.500000 0.000000 0.123132 Ir\n0.500000 0.000000 0.623132 Ir\n0.000000 0.500000 0.876868 Ir\n0.000000 0.500000 0.376868 Ir\n",
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}
]
}