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{
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{
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"updated_at": "2022-09-04T14:37:37.758654Z",
"structure_string": "Sn4 Se8 O24\n1.0\n8.256450 0.000000 0.000000\n-0.000000 8.256450 0.000000\n0.000000 -0.000000 8.256450\nSn Se O\n4 8 24\ndirect\n0.500000 0.500000 0.000000 Sn\n0.500000 0.000000 0.500000 Sn\n0.000000 0.000000 0.000000 Sn\n0.000000 0.500000 0.500000 Sn\n0.663343 0.836657 0.163343 Se\n0.836657 0.336657 0.163343 Se\n0.336657 0.163343 0.836657 Se\n0.336657 0.336657 0.336657 Se\n0.663343 0.663343 0.663343 Se\n0.163343 0.836657 0.336657 Se\n0.836657 0.163343 0.663343 Se\n0.163343 0.663343 0.836657 Se\n0.028065 0.529231 0.748150 O\n0.970768 0.251850 0.528065 O\n0.529231 0.751850 0.528065 O\n0.470769 0.248150 0.471935 O\n0.029231 0.751850 0.971935 O\n0.971935 0.470769 0.251850 O\n0.751850 0.528065 0.529231 O\n0.471935 0.470769 0.248150 O\n0.248150 0.028065 0.970768 O\n0.028065 0.970768 0.248150 O\n0.251850 0.528065 0.970768 O\n0.528065 0.529231 0.751850 O\n0.471935 0.029231 0.748150 O\n0.528065 0.970768 0.251850 O\n0.529231 0.748150 0.028065 O\n0.971935 0.029231 0.751850 O\n0.748150 0.028065 0.529231 O\n0.251850 0.971935 0.470769 O\n0.470769 0.251850 0.971935 O\n0.029231 0.748150 0.471935 O\n0.970768 0.248150 0.028065 O\n0.248150 0.471935 0.470769 O\n0.751850 0.971935 0.029231 O\n0.748150 0.471935 0.029231 O\n",
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{
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"structure_string": "K6 Re3 H27\n1.0\n4.739406 -8.208892 0.000000\n4.739406 8.208892 -0.000000\n0.000000 -0.000000 5.495252\nK Re H\n6 3 27\ndirect\n0.592142 0.000000 0.000000 K\n0.407858 0.407858 0.000000 K\n0.000000 0.592142 0.000000 K\n0.262719 0.000000 0.500000 K\n0.737282 0.737282 0.500000 K\n0.000000 0.262719 0.500000 K\n0.000000 0.000000 0.000000 Re\n0.333333 0.666667 0.500000 Re\n0.666667 0.333333 0.500000 Re\n0.220040 0.530518 0.725455 H\n0.310478 0.779960 0.274544 H\n0.469482 0.689523 0.274544 H\n0.469482 0.689523 0.725455 H\n0.310478 0.779960 0.725455 H\n0.220040 0.530518 0.274544 H\n0.779960 0.310478 0.274544 H\n0.530518 0.220040 0.274544 H\n0.635342 0.141293 0.500000 H\n0.530518 0.220040 0.725455 H\n0.689523 0.469482 0.274544 H\n0.858708 0.494049 0.500000 H\n0.870751 0.000000 0.781468 H\n0.364659 0.505951 0.500000 H\n0.494049 0.858708 0.500000 H\n0.141293 0.635342 0.500000 H\n0.689523 0.469482 0.725455 H\n0.129250 0.129250 0.218532 H\n0.000000 0.870751 0.218532 H\n0.000000 0.870751 0.781468 H\n0.129250 0.129250 0.781468 H\n0.870751 0.000000 0.218532 H\n0.000000 0.178900 0.000000 H\n0.821101 0.821101 0.000000 H\n0.178900 0.000000 0.000000 H\n0.505951 0.364659 0.500000 H\n0.779960 0.310478 0.725455 H\n",
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{
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"created_at": "2022-09-04T14:37:11.854150Z",
"updated_at": "2022-09-04T14:37:11.854160Z",
"structure_string": "Rb12 Fe8 Se16\n1.0\n7.611369 0.000000 0.000000\n-0.000000 11.199298 0.000000\n0.000000 0.000000 12.552353\nRb Fe Se\n12 8 16\ndirect\n0.093521 0.250000 0.763467 Rb\n0.593521 0.250000 0.736533 Rb\n0.906479 0.750000 0.236533 Rb\n0.406479 0.750000 0.263467 Rb\n0.081915 0.435754 0.133891 Rb\n0.581915 0.064246 0.366109 Rb\n0.918085 0.935754 0.866108 Rb\n0.418085 0.564246 0.633891 Rb\n0.918085 0.564246 0.866108 Rb\n0.418085 0.935754 0.633891 Rb\n0.081915 0.064246 0.133891 Rb\n0.581915 0.435754 0.366109 Rb\n0.555621 0.366091 0.029439 Fe\n0.055621 0.133909 0.470561 Fe\n0.944380 0.633909 0.529439 Fe\n0.444379 0.866091 0.970560 Fe\n0.944380 0.866091 0.529439 Fe\n0.555621 0.133909 0.029439 Fe\n0.055621 0.366091 0.470561 Fe\n0.444379 0.633909 0.970560 Fe\n0.354750 0.055329 0.893961 Se\n0.854750 0.444672 0.606038 Se\n0.354750 0.444672 0.893961 Se\n0.854750 0.055329 0.606038 Se\n0.645250 0.944672 0.106039 Se\n0.145250 0.555329 0.393961 Se\n0.074780 0.750000 0.667897 Se\n0.925220 0.250000 0.332103 Se\n0.425220 0.250000 0.167897 Se\n0.191707 0.750000 0.030126 Se\n0.691707 0.750000 0.469874 Se\n0.808294 0.250000 0.969874 Se\n0.308293 0.250000 0.530126 Se\n0.145250 0.944672 0.393961 Se\n0.574780 0.750000 0.832102 Se\n0.645250 0.555329 0.106039 Se\n",
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"structure_string": "Mo12 Cl24\n1.0\n8.958493 0.074695 0.000000\n-1.894689 8.756159 -0.000000\n-0.000000 -0.000000 11.325229\nMo Cl\n12 24\ndirect\n0.633465 0.366534 0.500000 Mo\n0.435196 0.435196 0.350210 Mo\n0.133465 0.866535 0.000000 Mo\n0.849956 0.849956 0.935441 Mo\n0.064803 0.064803 0.850210 Mo\n0.564803 0.564803 0.649790 Mo\n0.366534 0.633465 0.500000 Mo\n0.935196 0.935196 0.149790 Mo\n0.150043 0.150044 0.064559 Mo\n0.650043 0.650043 0.435441 Mo\n0.349956 0.349956 0.564559 Mo\n0.866534 0.133465 0.000000 Mo\n0.831620 0.578138 0.581687 Cl\n0.142333 0.142333 0.642567 Cl\n0.804903 0.195096 0.500000 Cl\n0.921861 0.668379 0.081687 Cl\n0.304903 0.695097 0.000000 Cl\n0.791976 0.044327 0.795395 Cl\n0.544327 0.291976 0.704605 Cl\n0.578138 0.831621 0.581687 Cl\n0.668379 0.921861 0.081687 Cl\n0.421861 0.168379 0.418313 Cl\n0.708023 0.455673 0.295395 Cl\n0.331621 0.078138 0.918313 Cl\n0.195096 0.804903 0.500000 Cl\n0.642333 0.642333 0.857433 Cl\n0.695096 0.304903 0.000000 Cl\n0.044327 0.791976 0.795395 Cl\n0.291976 0.544327 0.704605 Cl\n0.955672 0.208023 0.204605 Cl\n0.357667 0.357667 0.142567 Cl\n0.078138 0.331621 0.918313 Cl\n0.168379 0.421862 0.418313 Cl\n0.208024 0.955673 0.204605 Cl\n0.857666 0.857666 0.357433 Cl\n0.455673 0.708024 0.295395 Cl\n",
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{
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"structure_string": "Na4 Zr2 Si8 O22\n1.0\n7.487252 -0.021516 1.008284\n0.553374 7.466805 1.008284\n0.005744 0.005319 8.624547\nNa Zr Si O\n4 2 8 22\ndirect\n0.073526 0.926474 0.250000 Na\n0.926472 0.073527 0.750000 Na\n0.391318 0.608682 0.250000 Na\n0.608681 0.391318 0.750000 Na\n0.500000 -0.000000 -0.000000 Zr\n-0.000001 0.500000 0.500000 Zr\n0.804122 0.663526 0.139472 Si\n0.336473 0.195878 0.360527 Si\n0.733598 0.166400 0.429087 Si\n0.166400 0.733599 0.929087 Si\n0.266401 0.833600 0.570913 Si\n0.195877 0.336474 0.860527 Si\n0.833599 0.266401 0.070913 Si\n0.663525 0.804123 0.639473 Si\n0.755696 0.956361 0.504521 O\n0.245713 0.526090 0.917934 O\n0.473910 0.754286 0.582066 O\n0.043639 0.244303 0.995479 O\n0.204728 0.376194 0.351666 O\n0.840049 0.159951 0.250000 O\n0.623805 0.795272 0.148334 O\n0.795271 0.623806 0.648334 O\n0.376194 0.204728 0.851666 O\n0.108830 0.376343 0.697003 O\n0.623656 0.891170 0.802996 O\n0.891169 0.623657 0.302996 O\n0.244303 0.043639 0.495479 O\n0.376343 0.108830 0.197003 O\n0.715901 0.172887 0.965508 O\n0.172887 0.715903 0.465507 O\n0.284097 0.827113 0.034492 O\n0.754286 0.473910 0.082066 O\n0.526089 0.245714 0.417934 O\n0.159950 0.840050 0.750000 O\n0.827112 0.284098 0.534492 O\n0.956360 0.755697 0.004520 O\n",
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{
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"created_at": "2022-09-04T14:37:32.631052Z",
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"structure_string": "Rb20 Si4 As12\n1.0\n5.652485 -0.000000 0.000000\n-0.000000 14.177842 0.000000\n0.000000 0.000000 15.477025\nRb Si As\n20 4 12\ndirect\n0.750001 0.943742 0.348229 Rb\n0.750001 0.431175 0.441611 Rb\n0.250000 0.568825 0.558389 Rb\n0.250000 0.068825 0.941611 Rb\n0.750001 0.386211 0.680956 Rb\n0.250000 0.613789 0.319044 Rb\n0.750001 0.886211 0.819044 Rb\n0.250000 0.113789 0.180956 Rb\n0.750001 0.147884 0.543719 Rb\n0.250000 0.852116 0.456281 Rb\n0.750001 0.931175 0.058389 Rb\n0.250000 0.352116 0.043719 Rb\n0.750001 0.716275 0.213636 Rb\n0.250000 0.283724 0.786364 Rb\n0.750001 0.216275 0.286364 Rb\n0.250000 0.783724 0.713636 Rb\n0.250000 0.556258 0.848229 Rb\n0.750001 0.647884 0.956280 Rb\n0.750001 0.443742 0.151771 Rb\n0.250000 0.056258 0.651770 Rb\n0.750001 0.239368 0.922957 Si\n0.250000 0.760632 0.077042 Si\n0.750001 0.739368 0.577042 Si\n0.250000 0.260632 0.422958 Si\n0.750001 0.135923 0.804941 As\n0.250000 0.815614 0.935813 As\n0.750001 0.184386 0.064186 As\n0.250000 0.315614 0.564186 As\n0.750001 0.684386 0.435814 As\n0.250000 0.598141 0.094768 As\n0.750001 0.401859 0.905232 As\n0.250000 0.098141 0.405232 As\n0.750001 0.901859 0.594768 As\n0.750001 0.635923 0.695059 As\n0.250000 0.364077 0.304941 As\n0.250000 0.864076 0.195059 As\n",
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