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{
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{
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"structure_string": "Rb1 Cr1 P2 Se2 S1 O4\n1.0\n3.949704 -4.685009 0.000000\n3.949704 4.685009 0.000000\n-0.802300 0.000000 6.194821\nCr O P Rb S Se\n1 4 2 1 1 2\ndirect\n0.504858 0.495142 0.000000 Cr\n0.499943 0.185104 0.127213 O\n0.743850 0.675423 0.222834 O\n0.324577 0.256150 0.777166 O\n0.814896 0.500057 0.872787 O\n0.931263 0.658567 0.070726 P\n0.341433 0.068737 0.929274 P\n0.833173 0.166827 0.500000 Rb\n0.004984 0.995016 0.000000 S\n0.212669 0.561999 0.249486 Se\n0.438001 0.787331 0.750514 Se\n",
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{
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"updated_at": "2022-09-04T15:54:35.155866Z",
"structure_string": "Cs1 Cr1 P2 Se1 S2 O4\n1.0\n4.099140 -4.266966 0.000000\n4.099140 4.266966 0.000000\n-0.282119 0.000000 6.579810\nCr Cs O P S Se\n1 1 4 2 2 1\ndirect\n0.515599 0.484401 0.000000 Cr\n0.139192 0.860808 0.500000 Cs\n0.515969 0.814299 0.098764 O\n0.833289 0.469589 0.130596 O\n0.530411 0.166711 0.869404 O\n0.185701 0.484031 0.901236 O\n0.058560 0.369914 0.075763 P\n0.630086 0.941440 0.924237 P\n0.304946 0.367245 0.299424 S\n0.632755 0.695054 0.700576 S\n0.003901 0.996099 0.000000 Se\n",
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{
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"created_at": "2022-09-04T15:53:26.583148Z",
"updated_at": "2022-09-04T15:53:26.583174Z",
"structure_string": "Nd2 Sc2 C1 I2 Br1 Cl2\n1.0\n10.106067 -1.908001 0.000000\n10.106067 1.908001 0.000000\n-1.931931 0.000000 8.237933\nBr C Cl I Nd Sc\n1 1 2 2 2 2\ndirect\n0.500000 0.500000 0.000000 Br\n0.500000 0.500000 0.500000 C\n0.853682 0.853682 0.217931 Cl\n0.146318 0.146318 0.782069 Cl\n0.160322 0.160322 0.348790 I\n0.839678 0.839678 0.651210 I\n0.998863 0.998863 0.292840 Nd\n0.001137 0.001137 0.707160 Nd\n0.386158 0.386158 0.434064 Sc\n0.613842 0.613842 0.565936 Sc\n",
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{
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"created_at": "2022-09-04T15:54:35.352312Z",
"updated_at": "2022-09-04T15:54:35.352349Z",
"structure_string": "Rb1 Cr1 P2 Se1 S2 O4\n1.0\n4.172577 -4.201640 0.000000\n4.172577 4.201640 0.000000\n-2.067172 0.000000 6.243291\nCr O P Rb S Se\n1 4 2 1 2 1\ndirect\n0.511495 0.488505 0.000000 Cr\n0.867181 0.471954 0.144959 O\n0.313346 0.419094 0.207110 O\n0.580906 0.686654 0.792890 O\n0.528046 0.132819 0.855041 O\n0.068729 0.361238 0.056018 P\n0.638762 0.931271 0.943982 P\n0.137643 0.862357 0.500000 Rb\n0.560920 0.885319 0.219411 S\n0.114681 0.439080 0.780589 S\n0.028638 0.971362 0.000000 Se\n",
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{
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"created_at": "2022-09-04T15:54:35.839661Z",
"updated_at": "2022-09-04T15:54:35.839687Z",
"structure_string": "K1 Cr1 P2 Se3 S2 O2\n1.0\n4.464176 -4.435440 0.000000\n4.464176 4.435440 0.000000\n-1.462105 0.000000 6.495089\nCr K O P S Se\n1 1 2 2 2 3\ndirect\n0.485526 0.514474 0.000000 Cr\n0.906405 0.093595 0.500000 K\n0.461491 0.833236 0.144073 O\n0.166764 0.538509 0.855927 O\n0.365155 0.037065 0.068880 P\n0.962935 0.634845 0.931120 P\n0.410048 0.310833 0.278771 S\n0.689167 0.589952 0.721229 S\n0.996239 0.003761 0.000000 Se\n0.867959 0.527287 0.204836 Se\n0.472713 0.132041 0.795164 Se\n",
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{
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"created_at": "2022-09-04T15:54:39.203204Z",
"updated_at": "2022-09-04T15:54:39.203228Z",
"structure_string": "Dy2 Er1 Tm2 Lu2 Ni2 Te2\n1.0\n-1.905033 7.703996 4.747578\n1.905033 -7.703996 4.747578\n1.905033 7.703996 -4.747578\nDy Er Lu Ni Te Tm\n2 1 2 2 2 2\ndirect\n0.691786 0.377187 0.314599 Dy\n0.062588 0.377187 0.685401 Dy\n0.000819 0.000819 0.000000 Er\n0.082256 0.728089 0.354167 Lu\n0.373922 0.728089 0.645833 Lu\n0.307825 0.071836 0.235990 Ni\n0.835846 0.071836 0.764010 Ni\n0.338254 0.338254 0.000000 Te\n0.732467 0.232467 0.500000 Te\n0.715062 0.581214 0.133847 Tm\n0.447367 0.581214 0.866153 Tm\n",
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{
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"created_at": "2022-09-04T16:03:10.964033Z",
"updated_at": "2022-09-04T16:03:10.964051Z",
"structure_string": "K1 Na1 Mg2 Si4 Cl2 O10\n1.0\n2.671475 -4.630970 0.000000\n2.671475 4.630970 0.000000\n-1.948739 0.000000 9.824471\nCl K Mg Na O Si\n2 1 2 1 10 4\ndirect\n0.592412 0.592412 0.332425 Cl\n0.407588 0.407588 0.667575 Cl\n0.500000 0.500000 0.000000 K\n0.681288 0.318712 0.500000 Mg\n0.318712 0.681288 0.500000 Mg\n0.000000 0.000000 0.500000 Na\n0.554380 0.054671 0.153461 O\n0.054671 0.554380 0.153461 O\n0.048506 0.048506 0.159281 O\n0.966221 0.318946 0.382936 O\n0.318946 0.966221 0.382936 O\n0.681054 0.033779 0.617064 O\n0.033779 0.681054 0.617064 O\n0.951494 0.951494 0.840719 O\n0.945329 0.445620 0.846539 O\n0.445620 0.945329 0.846539 O\n0.910307 0.246541 0.218919 Si\n0.246541 0.910307 0.218919 Si\n0.753459 0.089693 0.781081 Si\n0.089693 0.753459 0.781081 Si\n",
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{
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"structure_string": "K4 Li4 P4 H8 O16 F4\n1.0\n5.094991 0.000000 0.056088\n0.000000 7.112000 0.000000\n-3.807302 0.000000 11.282993\nF H K Li O P\n4 8 4 4 16 4\ndirect\n0.343477 0.549131 0.076906 F\n0.656523 0.049131 0.423095 F\n0.343477 0.950869 0.576905 F\n0.656524 0.450869 0.923095 F\n0.936550 0.608927 0.152531 H\n0.838714 0.399422 0.159346 H\n0.161286 0.899421 0.340653 H\n0.063450 0.108927 0.347469 H\n0.936550 0.891073 0.652532 H\n0.838714 0.100579 0.659346 H\n0.161288 0.600579 0.840653 H\n0.063449 0.391074 0.847469 H\n0.326432 0.217663 0.162887 K\n0.673567 0.717663 0.337112 K\n0.326431 0.282337 0.662887 K\n0.673567 0.782337 0.837112 K\n0.820464 0.961957 0.139323 Li\n0.179537 0.461956 0.360677 Li\n0.820462 0.538044 0.639323 Li\n0.179538 0.038043 0.860676 Li\n0.974098 0.779093 0.064513 O\n0.749176 0.210716 0.078766 O\n0.477008 0.876090 0.137770 O\n0.930088 0.507479 0.209641 O\n0.069912 0.007478 0.290358 O\n0.522992 0.376090 0.362231 O\n0.250824 0.710714 0.421234 O\n0.025902 0.279093 0.435487 O\n0.974097 0.720906 0.564514 O\n0.749175 0.289284 0.578767 O\n0.477006 0.623910 0.637770 O\n0.930090 0.992522 0.709642 O\n0.069910 0.492521 0.790358 O\n0.522994 0.123910 0.862230 O\n0.250824 0.789286 0.921234 O\n0.025902 0.220907 0.935487 O\n0.258539 0.765165 0.048936 P\n0.741461 0.265165 0.451064 P\n0.258541 0.734835 0.548936 P\n0.741459 0.234835 0.951064 P\n",
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{
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"structure_string": "Hf1 Zr1 Ti1 Ni2 As4 Pd2\n1.0\n6.457956 0.000000 0.000000\n0.000000 3.833258 0.000000\n-0.167447 0.000000 7.489043\nAs Hf Ni Pd Ti Zr\n4 1 2 2 1 1\ndirect\n0.239084 0.000000 0.129438 As\n0.764117 0.000000 0.397970 As\n0.235061 0.500000 0.622207 As\n0.779300 0.500000 0.857255 As\n0.963751 0.500000 0.183084 Hf\n0.142814 0.000000 0.446450 Ni\n0.862748 0.500000 0.556301 Ni\n0.651383 0.000000 0.061280 Pd\n0.365823 0.500000 0.932580 Pd\n0.528942 0.000000 0.687711 Ti\n0.464954 0.500000 0.322983 Zr\n",
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{
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"created_at": "2022-09-04T15:53:26.641834Z",
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"structure_string": "Nd2 Ho2 C1 I2 Br2 Cl1\n1.0\n9.161174 -1.938091 0.000000\n9.161174 1.938091 0.000000\n-1.683316 0.000000 8.037163\nBr C Cl Ho I Nd\n2 1 1 2 2 2\ndirect\n0.835083 0.835083 0.191494 Br\n0.164917 0.164917 0.808506 Br\n0.500000 0.500000 0.000000 C\n0.500000 0.500000 0.500000 Cl\n0.997808 0.997808 0.201233 Ho\n0.002192 0.002192 0.798767 Ho\n0.163185 0.163185 0.368432 I\n0.836815 0.836815 0.631568 I\n0.640379 0.640379 0.067075 Nd\n0.359621 0.359621 0.932925 Nd\n",
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{
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]
}