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{
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{
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{
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{
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"structure_string": "Li2 V4 S8\n1.0\n6.245671 0.000000 -3.279057\n-1.721547 6.003723 -3.279057\n-0.287197 -0.381123 7.040616\nLi V S\n2 4 8\ndirect\n0.375000 0.625001 0.750000 Li\n0.624999 0.375000 0.250000 Li\n-0.000000 0.500001 0.000001 V\n0.000001 0.000000 0.500000 V\n0.500001 0.000000 0.500000 V\n0.000000 0.000000 0.000000 V\n0.758142 0.774119 0.516285 S\n0.757832 0.241859 0.983715 S\n0.225882 0.241859 0.983715 S\n0.241857 0.225882 0.483714 S\n0.241856 0.757831 0.483713 S\n0.242167 0.758142 0.016285 S\n0.758142 0.242168 0.516285 S\n0.774117 0.758142 0.016284 S\n",
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{
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"updated_at": "2022-09-04T14:38:36.809798Z",
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{
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"updated_at": "2022-09-04T14:38:36.800892Z",
"structure_string": "Mg4 V12 O28\n1.0\n5.267702 -0.000000 -0.000000\n-0.000000 10.111882 0.000000\n0.000001 -0.000000 10.058089\nMg V O\n4 12 28\ndirect\n0.651545 0.750000 0.919914 Mg\n0.151544 0.250000 0.580085 Mg\n0.348454 0.250000 0.080086 Mg\n0.848455 0.750000 0.419915 Mg\n0.713103 0.973358 0.681438 V\n0.286897 0.473358 0.318562 V\n0.786897 0.526641 0.181438 V\n0.204081 0.750000 0.712232 V\n0.704081 0.250000 0.787769 V\n0.213102 0.026641 0.818562 V\n0.295919 0.750000 0.212231 V\n0.213102 0.473358 0.818562 V\n0.713103 0.526641 0.681438 V\n0.786897 0.973358 0.181438 V\n0.286897 0.026641 0.318562 V\n0.795919 0.250000 0.287769 V\n0.972938 0.618611 0.782688 O\n0.183371 0.750000 0.548331 O\n0.683369 0.250000 0.951670 O\n0.816629 0.250000 0.451669 O\n0.316631 0.750000 0.048330 O\n0.772769 0.907411 0.031237 O\n0.727230 0.592588 0.531237 O\n0.272770 0.092588 0.468763 O\n0.772769 0.592588 0.031237 O\n0.272770 0.407411 0.468763 O\n0.472937 0.381388 0.717313 O\n0.227231 0.407411 0.968763 O\n0.027062 0.118612 0.217312 O\n0.547169 0.121189 0.214246 O\n0.027062 0.381388 0.217312 O\n0.527062 0.618611 0.282687 O\n0.972938 0.881388 0.782688 O\n0.472937 0.118612 0.717313 O\n0.452831 0.621189 0.785754 O\n0.952831 0.378811 0.714247 O\n0.227231 0.092588 0.968763 O\n0.047169 0.878811 0.285753 O\n0.547169 0.378811 0.214246 O\n0.047169 0.621189 0.285753 O\n0.452831 0.878811 0.785754 O\n0.952831 0.121189 0.714247 O\n0.527062 0.881388 0.282687 O\n0.727230 0.907411 0.531237 O\n",
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{
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"created_at": "2022-09-04T14:38:36.794492Z",
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"structure_string": "Ca6 Lu2\n1.0\n7.445479 0.000000 0.000000\n-3.722740 6.447973 0.000000\n-0.000000 -0.000000 6.100322\nCa Lu\n6 2\ndirect\n0.341474 0.170737 0.750000 Ca\n0.829263 0.658525 0.750000 Ca\n0.170737 0.829262 0.250000 Ca\n0.658525 0.829262 0.250000 Ca\n0.170737 0.341474 0.250000 Ca\n0.829263 0.170737 0.750000 Ca\n0.666667 0.333333 0.250000 Lu\n0.333333 0.666666 0.750000 Lu\n",
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"structure_string": "Sr6 Y4 N8\n1.0\n7.643741 0.032064 -0.172939\n-7.274635 7.602826 -0.000001\n-0.039065 -0.037379 6.457171\nSr Y N\n6 4 8\ndirect\n0.222161 0.919956 0.077929 Sr\n0.777838 0.697794 0.422071 Sr\n0.777837 0.080044 0.922071 Sr\n0.222161 0.302206 0.577929 Sr\n-0.000001 0.588148 0.750000 Sr\n-0.000000 0.411852 0.250000 Sr\n0.525373 0.369082 0.091526 Y\n0.474626 0.843709 0.408474 Y\n0.525372 0.156290 0.591526 Y\n0.474626 0.630918 0.908473 Y\n0.379317 0.769943 0.063484 N\n0.213750 0.867665 0.498750 N\n0.786249 0.653913 0.001250 N\n0.786249 0.132335 0.501250 N\n0.213750 0.346087 0.998750 N\n0.620681 0.230057 0.936516 N\n0.379317 0.609375 0.563484 N\n0.620682 0.390625 0.436516 N\n",
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{
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"structure_string": "Te8 Mo6 S4\n1.0\n-0.347504 -5.943759 -0.000003\n0.000034 0.000003 13.951332\n-4.982029 3.273330 -0.000013\nTe Mo S\n8 6 4\ndirect\n0.651382 0.380654 0.668236 Te\n0.016860 0.880653 0.668245 Te\n0.983148 0.380654 0.331761 Te\n0.983149 0.119346 0.331761 Te\n0.016860 0.619347 0.668245 Te\n0.348615 0.880654 0.331755 Te\n0.348615 0.619347 0.331755 Te\n0.651382 0.119346 0.668236 Te\n0.317750 0.250000 0.311931 Mo\n0.682251 0.750001 0.688066 Mo\n0.628579 0.250000 -0.000000 Mo\n0.994185 0.750001 0.311933 Mo\n0.005820 0.250000 0.688072 Mo\n0.371417 0.750000 0.000002 Mo\n0.682848 0.861272 -0.000001 S\n0.317149 0.138723 0.000004 S\n0.317149 0.361277 0.000003 S\n0.682849 0.638729 -0.000001 S\n",
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}