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{
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{
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{
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"structure_string": "Li7 Mn2 Co3 O12\n1.0\n2.983731 0.000000 0.000000\n0.068471 5.070091 0.000000\n0.415846 0.579096 14.362160\nLi Mn Co O\n7 2 3 12\ndirect\n0.003897 0.339182 0.172147 Li\n0.509223 0.185432 0.334626 Li\n0.991913 0.996096 0.500584 Li\n0.497109 0.833073 0.665514 Li\n0.999068 0.667725 0.832204 Li\n0.495893 0.493619 0.996988 Li\n0.988300 0.650679 0.331709 Li\n0.004718 0.004901 0.000124 Mn\n0.507057 0.825701 0.173458 Mn\n0.496381 0.503181 0.493134 Co\n0.995843 0.337677 0.664059 Co\n0.496067 0.170302 0.830501 Co\n0.544653 0.145584 0.083304 O\n0.992550 0.976605 0.241500 O\n0.499057 0.797188 0.428204 O\n0.034262 0.645749 0.583244 O\n0.493788 0.482906 0.750337 O\n0.987583 0.319027 0.915302 O\n0.494366 0.517383 0.244229 O\n0.968685 0.338457 0.424239 O\n0.506732 0.199731 0.581264 O\n0.005169 0.020924 0.747482 O\n0.465277 0.852715 0.914952 O\n0.022409 0.696162 0.090894 O\n",
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},
{
"id": "mp-984762",
"created_at": "2022-09-04T14:40:18.496383Z",
"structure_string": "Cs1 Y1\n1.0\n1.921708 -3.328495 0.000000\n1.921708 3.328495 0.000000\n0.000000 0.000000 7.510495\nCs Y\n1 1\ndirect\n0.333333 0.666667 0.500000 Cs\n0.000000 0.000000 0.000000 Y\n",
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"spacegroup": 187
},
{
"id": "mp-570082",
"created_at": "2022-09-04T14:40:10.921069Z",
"structure_string": "Cd8 I16\n1.0\n2.165652 -3.751019 0.000000\n2.165652 3.751019 0.000000\n0.000000 0.000000 59.426337\nCd I\n8 16\ndirect\n0.000000 0.000000 0.906225 Cd\n0.000000 0.000000 0.781278 Cd\n0.333333 0.666667 0.406222 Cd\n0.000000 0.000000 0.656229 Cd\n0.000000 0.000000 0.031274 Cd\n0.333333 0.666667 0.156221 Cd\n0.000000 0.000000 0.281281 Cd\n0.333333 0.666667 0.531241 Cd\n0.666667 0.333333 0.810336 I\n0.333333 0.666667 0.877167 I\n0.666667 0.333333 0.560313 I\n0.333333 0.666667 0.252237 I\n0.666667 0.333333 0.060332 I\n0.000000 0.000000 0.127145 I\n0.666667 0.333333 0.435299 I\n0.666667 0.333333 0.185297 I\n0.000000 0.000000 0.502177 I\n0.333333 0.666667 0.002233 I\n0.666667 0.333333 0.310339 I\n0.666667 0.333333 0.935300 I\n0.333333 0.666667 0.752235 I\n0.000000 0.000000 0.377145 I\n0.666667 0.333333 0.685303 I\n0.333333 0.666667 0.627170 I\n",
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{
"id": "mp-1193397",
"created_at": "2022-09-04T14:40:14.476719Z",
"structure_string": "Zr18 Ni2 Mo8\n1.0\n4.418874 -7.653714 0.000000\n4.418874 7.653714 0.000000\n0.000000 0.000000 8.397771\nZr Ni Mo\n18 2 8\ndirect\n0.199056 0.800944 0.444316 Zr\n0.199056 0.398112 0.444316 Zr\n0.601888 0.800944 0.444316 Zr\n0.800944 0.199056 0.555684 Zr\n0.800944 0.601888 0.555684 Zr\n0.398112 0.199056 0.555684 Zr\n0.800944 0.199056 0.944316 Zr\n0.800944 0.601888 0.944316 Zr\n0.398112 0.199056 0.944316 Zr\n0.199056 0.800944 0.055684 Zr\n0.199056 0.398112 0.055684 Zr\n0.601888 0.800944 0.055684 Zr\n0.541087 0.458913 0.250000 Zr\n0.541087 0.082175 0.250000 Zr\n0.917825 0.458913 0.250000 Zr\n0.458913 0.541087 0.750000 Zr\n0.458913 0.917825 0.750000 Zr\n0.082175 0.541087 0.750000 Zr\n0.333333 0.666667 0.250000 Ni\n0.666667 0.333333 0.750000 Ni\n0.890041 0.109959 0.250000 Mo\n0.890041 0.780081 0.250000 Mo\n0.219919 0.109959 0.250000 Mo\n0.109959 0.890041 0.750000 Mo\n0.109959 0.219919 0.750000 Mo\n0.780081 0.890041 0.750000 Mo\n0.000000 0.000000 0.500000 Mo\n0.000000 0.000000 0.000000 Mo\n",
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{
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"structure_string": "Na1 Nd1 Nb4 O12\n1.0\n-2.810314 2.810314 8.021477\n2.810314 -2.810314 8.021477\n2.810314 2.810314 -8.021477\nNa Nd Nb O\n1 1 4 12\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.000000 Nd\n0.628972 0.128972 0.500000 Nb\n0.128972 0.628972 0.500000 Nb\n0.871028 0.371028 0.500000 Nb\n0.371028 0.871028 0.500000 Nb\n0.855757 0.855757 0.483534 O\n0.372223 0.372223 0.516466 O\n0.144243 0.144243 0.516466 O\n0.627777 0.627777 0.483534 O\n0.372223 0.855757 0.000000 O\n0.855757 0.372223 0.000000 O\n0.627777 0.144243 0.000000 O\n0.144243 0.627777 0.000000 O\n0.750000 0.250000 0.500000 O\n0.250000 0.750000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
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{
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{
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"structure_string": "Zr8 Zn2\n1.0\n0.000000 5.028067 5.028067\n5.028067 0.000000 5.028067\n5.028067 5.028067 0.000000\nZr Zn\n8 2\ndirect\n0.394889 0.394889 0.394889 Zr\n0.394889 0.394889 0.815332 Zr\n0.394889 0.815332 0.394889 Zr\n0.855111 0.855111 0.434668 Zr\n0.855111 0.855111 0.855111 Zr\n0.815332 0.394889 0.394889 Zr\n0.855111 0.434668 0.855111 Zr\n0.434668 0.855111 0.855111 Zr\n0.000000 0.000000 0.000000 Zn\n0.250000 0.250000 0.250000 Zn\n",
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