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{
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"structure_string": "In16 Br28\n1.0\n3.855964 6.792232 0.000000\n-3.855964 6.792232 0.000000\n0.000000 4.818290 31.623012\nIn Br\n16 28\ndirect\n0.177054 0.681215 0.972756 In\n0.458007 0.958819 0.125012 In\n0.041181 0.541993 0.374988 In\n0.681215 0.177054 0.472756 In\n0.369390 0.914337 0.315329 In\n0.199526 0.800474 0.750000 In\n0.541993 0.041181 0.874988 In\n0.822946 0.318785 0.027244 In\n0.630610 0.085663 0.684671 In\n0.500000 0.000000 0.000000 In\n0.914337 0.369390 0.815329 In\n0.958819 0.458007 0.625012 In\n0.318785 0.822946 0.527244 In\n0.000000 0.500000 0.500000 In\n0.800474 0.199526 0.250000 In\n0.085663 0.630610 0.184671 In\n0.323591 0.992390 0.236205 Br\n0.498527 0.878595 0.661707 Br\n0.992390 0.323591 0.736205 Br\n0.723707 0.691840 0.950349 Br\n0.032342 0.014143 0.848104 Br\n0.121405 0.501473 0.838293 Br\n0.547325 0.593485 0.835706 Br\n0.007610 0.676409 0.263795 Br\n0.136921 0.188189 0.451447 Br\n0.630691 0.226351 0.950688 Br\n0.226351 0.630691 0.450688 Br\n0.593485 0.547325 0.335706 Br\n0.501473 0.121405 0.338293 Br\n0.985857 0.967658 0.651896 Br\n0.014143 0.032342 0.348104 Br\n0.811811 0.863079 0.048553 Br\n0.878595 0.498527 0.161707 Br\n0.773649 0.369309 0.549312 Br\n0.863079 0.811811 0.548553 Br\n0.452675 0.406515 0.164294 Br\n0.691840 0.723707 0.450349 Br\n0.967658 0.985857 0.151896 Br\n0.369309 0.773649 0.049312 Br\n0.308160 0.276293 0.549651 Br\n0.406515 0.452675 0.664294 Br\n0.276293 0.308160 0.049651 Br\n0.676409 0.007610 0.763795 Br\n0.188189 0.136921 0.951447 Br\n",
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{
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{
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"created_at": "2022-09-04T14:43:01.520442Z",
"structure_string": "In64 Br96\n1.0\n13.229480 0.000000 0.000000\n0.000000 13.344534 0.000000\n0.000000 0.067146 33.051302\nIn Br\n64 96\ndirect\n0.939664 0.593417 0.870807 In\n0.939990 0.593773 0.371175 In\n0.938319 0.752103 0.514651 In\n0.932808 0.375255 0.965477 In\n0.933806 0.372247 0.464761 In\n0.900019 0.718109 0.725400 In\n0.901879 0.719793 0.224098 In\n0.863070 0.056097 0.664374 In\n0.863697 0.055288 0.165505 In\n0.861795 0.054766 0.580578 In\n0.860129 0.054614 0.081844 In\n0.788218 0.735878 0.871776 In\n0.788027 0.736223 0.371430 In\n0.770371 0.421034 0.624512 In\n0.772510 0.424872 0.123834 In\n0.729452 0.080415 0.873402 In\n0.729851 0.078875 0.374614 In\n0.711878 0.764030 0.621430 In\n0.715221 0.761039 0.120583 In\n0.638073 0.444837 0.831504 In\n0.638257 0.445425 0.330715 In\n0.632643 0.444366 0.915488 In\n0.636091 0.444185 0.414507 In\n0.603590 0.773707 0.975643 In\n0.598997 0.780800 0.475311 In\n0.566140 0.129445 0.218530 In\n0.565565 0.128754 0.714814 In\n0.561947 0.747145 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Br\n0.039143 0.015699 0.697014 Br\n0.039873 0.015170 0.197380 Br\n0.037101 0.999975 0.549661 Br\n0.040866 0.007343 0.053526 Br\n",
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"formula_full": "In64 Br96",
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{
"id": "mp-568108",
"created_at": "2022-09-04T14:43:17.348990Z",
"structure_string": "In8 Br16\n1.0\n8.069130 0.000000 0.000000\n0.000000 10.700840 0.000000\n0.000000 0.000000 10.779200\nIn Br\n8 16\ndirect\n0.750000 0.000000 0.818488 In\n0.323865 0.750000 0.750000 In\n0.250000 0.000000 0.181512 In\n0.676135 0.250000 0.250000 In\n0.176135 0.250000 0.750000 In\n0.250000 0.500000 0.318488 In\n0.823865 0.750000 0.250000 In\n0.750000 0.500000 0.681512 In\n0.498176 0.455545 0.818527 Br\n0.501824 0.544455 0.181473 Br\n0.998176 0.044455 0.318527 Br\n0.844267 0.314846 0.549801 Br\n0.501824 0.955545 0.318527 Br\n0.344267 0.314846 0.450199 Br\n0.844267 0.185154 0.950199 Br\n0.344267 0.185154 0.049801 Br\n0.655733 0.814846 0.950199 Br\n0.998176 0.455545 0.181473 Br\n0.155733 0.814846 0.049801 Br\n0.498176 0.044455 0.681473 Br\n0.655733 0.685154 0.549801 Br\n0.001824 0.544455 0.818527 Br\n0.155733 0.685154 0.450199 Br\n0.001824 0.955545 0.681473 Br\n",
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{
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{
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"spacegroup": 21
},
{
"id": "mp-23188",
"created_at": "2022-09-04T14:40:21.371917Z",
"structure_string": "In4 Bi2\n1.0\n2.790384 -4.833088 0.000000\n2.790384 4.833088 0.000000\n0.000000 0.000000 6.682238\nIn Bi\n4 2\ndirect\n0.000000 0.000000 0.500000 In\n0.000000 0.000000 0.000000 In\n0.333333 0.666667 0.750000 In\n0.666667 0.333333 0.250000 In\n0.333333 0.666667 0.250000 Bi\n0.666667 0.333333 0.750000 Bi\n",
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"updated_at": "2021-11-28T01:34:53.144000Z",
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}
]
}