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{
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{
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"density": 4.2460612287160115,
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"formula_full": "Sc10 Ga6",
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{
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{
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{
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"structure_string": "Na3 Ca1 Al3 Si3 S1 O16\n1.0\n7.811006 0.000000 0.000000\n-2.562966 7.392653 0.000000\n-2.465156 -3.805457 6.394156\nNa Ca Al Si S O\n3 1 3 3 1 16\ndirect\n0.009517 0.002077 0.362014 Na\n0.627457 0.998746 0.997777 Na\n0.005118 0.626620 0.999515 Na\n0.346338 0.379205 0.651585 Ca\n0.249635 0.751805 0.497249 Al\n0.493752 0.748929 0.757912 Al\n0.506853 0.251389 0.245880 Al\n0.243579 0.491347 0.255082 Si\n0.746824 0.251447 0.504981 Si\n0.755379 0.506291 0.747873 Si\n0.006047 0.001425 0.993143 S\n0.003440 0.018665 0.798358 O\n0.209252 0.011452 0.968250 O\n0.009762 0.190823 0.005766 O\n0.821674 0.808943 0.181556 O\n0.695228 0.011810 0.596502 O\n0.294756 0.302073 0.288670 O\n0.989358 0.703548 0.582003 O\n0.421234 0.000488 0.291350 O\n0.392601 0.689612 0.020734 O\n0.716939 0.310016 0.695375 O\n0.290719 0.675044 0.706962 O\n0.715045 0.423142 0.983844 O\n0.994419 0.403141 0.309248 O\n0.594641 0.299701 0.419593 O\n0.587052 0.576644 0.719189 O\n0.273380 0.565617 0.419588 O\n",
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{
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{
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"structure_string": "Li5 Mn2 Co1 O8\n1.0\n3.006116 0.000000 0.000000\n0.231711 5.030418 0.000000\n1.208385 0.423681 9.595365\nLi Mn Co O\n5 2 1 8\ndirect\n0.879085 0.120817 0.734469 Li\n0.612188 0.371874 0.264650 Li\n0.387812 0.628126 0.735350 Li\n0.120915 0.879183 0.265531 Li\n0.500000 0.000000 0.500000 Li\n0.749959 0.750259 0.999403 Mn\n0.250041 0.249741 0.000597 Mn\n0.000000 0.500000 0.500000 Co\n0.337073 0.943557 0.881549 O\n0.063067 0.224943 0.387946 O\n0.835302 0.438657 0.884992 O\n0.539733 0.669128 0.390641 O\n0.460267 0.330872 0.609359 O\n0.164698 0.561343 0.115008 O\n0.936933 0.775057 0.612054 O\n0.662927 0.056443 0.118451 O\n",
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