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{
"id": "mp-1195034",
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{
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"structure_string": "B24 H24 O48\n1.0\n8.956578 0.000000 0.000000\n0.000000 8.956578 0.000000\n0.000000 0.000000 8.956578\nB H O\n24 24 48\ndirect\n0.192025 0.581664 0.282922 B\n0.418336 0.717078 0.192025 B\n0.282922 0.807975 0.418336 B\n0.807975 0.418336 0.282922 B\n0.581664 0.282922 0.192025 B\n0.717078 0.192025 0.418336 B\n0.192025 0.418336 0.717078 B\n0.418336 0.282922 0.807975 B\n0.282922 0.192025 0.581664 B\n0.807975 0.581664 0.717078 B\n0.581664 0.717078 0.807975 B\n0.717078 0.807975 0.581664 B\n0.692025 0.782922 0.081664 B\n0.918336 0.692025 0.217078 B\n0.782922 0.918336 0.307975 B\n0.307975 0.782922 0.918336 B\n0.081664 0.692025 0.782922 B\n0.217078 0.918336 0.692025 B\n0.692025 0.217078 0.918336 B\n0.918336 0.307975 0.782922 B\n0.782922 0.081664 0.692025 B\n0.307975 0.217078 0.081664 B\n0.081664 0.307975 0.217078 B\n0.217078 0.081664 0.307975 B\n0.165637 0.610467 0.568378 H\n0.389533 0.431622 0.165637 H\n0.568378 0.834363 0.389533 H\n0.834363 0.389533 0.568378 H\n0.610467 0.568378 0.165637 H\n0.431622 0.165637 0.389533 H\n0.165637 0.389533 0.431622 H\n0.389533 0.568378 0.834363 H\n0.568378 0.165637 0.610467 H\n0.834363 0.610467 0.431622 H\n0.610467 0.431622 0.834363 H\n0.431622 0.834363 0.610467 H\n0.665637 0.068378 0.110467 H\n0.889533 0.665637 0.931622 H\n0.068378 0.889533 0.334363 H\n0.334363 0.068378 0.889533 H\n0.110467 0.665637 0.068378 H\n0.931622 0.889533 0.665637 H\n0.665637 0.931622 0.889533 H\n0.889533 0.334363 0.068378 H\n0.068378 0.110467 0.665637 H\n0.334363 0.931622 0.110467 H\n0.110467 0.334363 0.931622 H\n0.931622 0.110467 0.334363 H\n0.199605 0.668315 0.419323 O\n0.331685 0.580677 0.199605 O\n0.419323 0.800395 0.331685 O\n0.800395 0.331685 0.419323 O\n0.668315 0.419323 0.199605 O\n0.580677 0.199605 0.331685 O\n0.199605 0.331685 0.580677 O\n0.331685 0.419323 0.800395 O\n0.419323 0.199605 0.668315 O\n0.800395 0.668315 0.580677 O\n0.668315 0.580677 0.800395 O\n0.580677 0.800395 0.668315 O\n0.699605 0.919323 0.168315 O\n0.831685 0.699605 0.080677 O\n0.919323 0.831685 0.300395 O\n0.300395 0.919323 0.831685 O\n0.168315 0.699605 0.919323 O\n0.080677 0.831685 0.699605 O\n0.699605 0.080677 0.831685 O\n0.831685 0.300395 0.919323 O\n0.919323 0.168315 0.699605 O\n0.300395 0.080677 0.168315 O\n0.168315 0.300395 0.080677 O\n0.080677 0.168315 0.300395 O\n0.073432 0.644996 0.177521 O\n0.355004 0.822479 0.073432 O\n0.177521 0.926568 0.355004 O\n0.926568 0.355004 0.177521 O\n0.644996 0.177521 0.073432 O\n0.822479 0.073432 0.355004 O\n0.073432 0.355004 0.822479 O\n0.355004 0.177521 0.926568 O\n0.177521 0.073432 0.644996 O\n0.926568 0.644996 0.822479 O\n0.644996 0.822479 0.926568 O\n0.822479 0.926568 0.644996 O\n0.573432 0.677521 0.144996 O\n0.855004 0.573432 0.322479 O\n0.677521 0.855004 0.426568 O\n0.426568 0.677521 0.855004 O\n0.144996 0.573432 0.677521 O\n0.322479 0.855004 0.573432 O\n0.573432 0.322479 0.855004 O\n0.855004 0.426568 0.677521 O\n0.677521 0.144996 0.573432 O\n0.426568 0.322479 0.144996 O\n0.144996 0.426568 0.322479 O\n0.322479 0.144996 0.426568 O\n",
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"formula_full": "B24 H24 O48",
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{
"id": "mp-504751",
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"structure_string": "As2 H2 Pb2 O8\n1.0\n6.790122 0.000000 0.000000\n0.000000 4.972945 0.000000\n0.000000 0.527862 5.912436\nAs H Pb O\n2 2 2 8\ndirect\n0.208066 0.500000 0.750000 As\n0.791934 0.500000 0.250000 As\n0.500000 0.500000 0.500000 H\n0.500000 0.500000 0.000000 H\n0.796908 0.000000 0.750000 Pb\n0.203092 0.000000 0.250000 Pb\n0.358156 0.360277 0.554069 O\n0.358156 0.639723 0.945931 O\n0.641844 0.639723 0.445931 O\n0.641844 0.360277 0.054069 O\n0.070284 0.248179 0.890418 O\n0.070284 0.751821 0.609582 O\n0.929716 0.751821 0.109582 O\n0.929716 0.248179 0.390418 O\n",
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},
{
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"created_at": "2022-09-04T14:40:57.435460Z",
"structure_string": "Li6 Mn2 Co6 O16\n1.0\n1.580819 -2.494020 -5.035502\n8.658087 2.596829 5.110593\n1.587366 -5.611576 0.078741\nLi Mn Co O\n6 2 6 16\ndirect\n0.501724 0.249587 0.749829 Li\n0.498293 0.750408 0.250115 Li\n0.001068 0.250795 0.751059 Li\n0.998959 0.749204 0.248895 Li\n0.999034 0.249698 0.250476 Li\n0.000944 0.750302 0.749526 Li\n0.999974 0.000122 0.999969 Mn\n0.999818 0.499875 0.500142 Mn\n0.500145 0.499998 0.500026 Co\n0.000199 0.500023 0.999987 Co\n0.499900 0.999997 0.500046 Co\n0.499799 0.999956 0.999952 Co\n0.999882 0.999973 0.499948 Co\n0.500111 0.499969 0.000024 Co\n0.733795 0.110832 0.622083 O\n0.734140 0.610711 0.122514 O\n0.266218 0.389318 0.877456 O\n0.266068 0.889129 0.377882 O\n0.234792 0.110536 0.123801 O\n0.235125 0.610683 0.623920 O\n0.757655 0.107155 0.113286 O\n0.758233 0.607312 0.612642 O\n0.220788 0.107267 0.650256 O\n0.221028 0.607423 0.149956 O\n0.779186 0.392522 0.850171 O\n0.779073 0.892805 0.349610 O\n0.241968 0.392648 0.387401 O\n0.242020 0.892958 0.886743 O\n0.765032 0.389268 0.376086 O\n0.765027 0.889525 0.876196 O\n",
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{
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"structure_string": "Ba8 Na8 Fe8 F48\n1.0\n5.660158 0.000000 0.000000\n0.000000 10.058068 0.000000\n0.000000 0.000000 19.495661\nBa Na Fe F\n8 8 8 48\ndirect\n0.758797 0.366665 0.111526 Ba\n0.241203 0.866665 0.888474 Ba\n0.741203 0.366665 0.611526 Ba\n0.258797 0.866665 0.388474 Ba\n0.257400 0.001653 0.137562 Ba\n0.742600 0.501653 0.862438 Ba\n0.242600 0.001653 0.637562 Ba\n0.757400 0.501653 0.362438 Ba\n0.256168 0.640402 0.064575 Na\n0.743832 0.140402 0.935425 Na\n0.243832 0.640402 0.564575 Na\n0.756168 0.140402 0.435425 Na\n0.263594 0.227246 0.312939 Na\n0.736406 0.727246 0.687061 Na\n0.236406 0.227246 0.812939 Na\n0.763594 0.727246 0.187061 Na\n0.264307 0.263340 0.492340 Fe\n0.735693 0.763340 0.507660 Fe\n0.235693 0.263340 0.992340 Fe\n0.764307 0.763340 0.007660 Fe\n0.250802 0.604515 0.243190 Fe\n0.749198 0.104515 0.756810 Fe\n0.249198 0.604515 0.743190 Fe\n0.750802 0.104515 0.256810 Fe\n0.028894 0.171781 0.059223 F\n0.971106 0.671781 0.940777 F\n0.471106 0.171781 0.559223 F\n0.528894 0.671781 0.440777 F\n0.345769 0.118430 0.427724 F\n0.654231 0.618430 0.572276 F\n0.154231 0.118430 0.927724 F\n0.845769 0.618430 0.072276 F\n0.497766 0.164159 0.034426 F\n0.502234 0.664159 0.965574 F\n0.002234 0.164159 0.534426 F\n0.997766 0.664159 0.465574 F\n0.478672 0.543436 0.176281 F\n0.521328 0.043436 0.823719 F\n0.021328 0.543436 0.676281 F\n0.978672 0.043436 0.323719 F\n0.533882 0.194953 0.191787 F\n0.466118 0.694953 0.808213 F\n0.966118 0.194953 0.691787 F\n0.033882 0.694953 0.308213 F\n0.301325 0.459837 0.308030 F\n0.698675 0.959837 0.691970 F\n0.198675 0.459837 0.808030 F\n0.801325 0.959837 0.191970 F\n0.047095 0.322619 0.421780 F\n0.952905 0.822619 0.578220 F\n0.452905 0.322619 0.921780 F\n0.547095 0.822619 0.078220 F\n0.008454 0.202129 0.212140 F\n0.991546 0.702129 0.787860 F\n0.491546 0.202129 0.712140 F\n0.508454 0.702129 0.287860 F\n0.555125 0.354555 0.464575 F\n0.444875 0.854555 0.535425 F\n0.944875 0.354555 0.964575 F\n0.055125 0.854555 0.035425 F\n0.180814 0.749705 0.178189 F\n0.819186 0.249705 0.821811 F\n0.319186 0.749705 0.678189 F\n0.680814 0.249705 0.321811 F\n0.297044 0.407514 0.056339 F\n0.702956 0.907514 0.943661 F\n0.202956 0.407514 0.556339 F\n0.797044 0.907514 0.443661 F\n0.468566 0.012659 0.289327 F\n0.531434 0.512659 0.710673 F\n0.031434 0.012659 0.789327 F\n0.968566 0.512659 0.210673 F\n",
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},
{
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