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{
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{
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"structure_string": "Mn4 Fe4 Co4 P12 O48\n1.0\n5.939364 0.000000 0.000000\n0.000000 9.905906 0.000000\n0.000000 0.030758 14.602701\nMn Fe Co P O\n4 4 4 12 48\ndirect\n0.500000 0.780026 0.147430 Mn\n0.500000 0.784645 0.812466 Mn\n0.000000 0.718581 0.647792 Mn\n0.500000 0.283659 0.021374 Mn\n0.500000 0.773974 0.488027 Fe\n0.000000 0.725166 0.987649 Fe\n0.000000 0.722913 0.321590 Fe\n0.500000 0.275983 0.346199 Fe\n0.500000 0.278546 0.683501 Co\n0.000000 0.217014 0.850352 Co\n0.000000 0.222196 0.516469 Co\n0.000000 0.223115 0.182912 Co\n0.000000 0.903734 0.804418 P\n0.000000 0.902551 0.472893 P\n0.000000 0.905239 0.139172 P\n0.500000 0.598476 0.306087 P\n0.500000 0.599778 0.973836 P\n0.500000 0.596224 0.639666 P\n0.000000 0.402362 0.028318 P\n0.000000 0.401083 0.362668 P\n0.000000 0.402536 0.692689 P\n0.500000 0.096937 0.191819 P\n0.500000 0.098019 0.527894 P\n0.500000 0.097313 0.857382 P\n0.500000 0.946373 0.215319 O\n0.500000 0.947955 0.551301 O\n0.500000 0.946557 0.884271 O\n0.000000 0.881955 0.577640 O\n0.000000 0.883407 0.908383 O\n0.000000 0.882694 0.242336 O\n0.201628 0.828694 0.756809 O\n0.798372 0.828694 0.756809 O\n0.199741 0.829354 0.089378 O\n0.800259 0.829354 0.089378 O\n0.201697 0.827298 0.425224 O\n0.798303 0.827298 0.425224 O\n0.704806 0.670464 0.927364 O\n0.295194 0.670464 0.927364 O\n0.704751 0.671556 0.259651 O\n0.295249 0.671556 0.259651 O\n0.699462 0.671818 0.590070 O\n0.300538 0.671818 0.590070 O\n0.500000 0.617604 0.410226 O\n0.500000 0.618287 0.743745 O\n0.500000 0.616890 0.079315 O\n0.000000 0.552042 0.052851 O\n0.000000 0.550941 0.386742 O\n0.000000 0.553686 0.718123 O\n0.500000 0.446845 0.953117 O\n0.500000 0.446876 0.283494 O\n0.500000 0.446590 0.615813 O\n0.000000 0.382887 0.257936 O\n0.000000 0.386710 0.588517 O\n0.000000 0.381618 0.924699 O\n0.199570 0.326393 0.078485 O\n0.800430 0.326393 0.078485 O\n0.202392 0.325398 0.409937 O\n0.797608 0.325398 0.409937 O\n0.203957 0.328145 0.740715 O\n0.796043 0.328145 0.740715 O\n0.703775 0.173551 0.575276 O\n0.296225 0.173551 0.575276 O\n0.702125 0.171713 0.240271 O\n0.297875 0.171713 0.240271 O\n0.704797 0.171355 0.904223 O\n0.295203 0.171355 0.904223 O\n0.500000 0.117934 0.423881 O\n0.500000 0.112685 0.752918 O\n0.500000 0.116631 0.087474 O\n0.000000 0.053971 0.778256 O\n0.000000 0.055253 0.113836 O\n0.000000 0.052931 0.449655 O\n",
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{
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"structure_string": "Na12 Mn12 O32\n1.0\n8.769133 0.000000 0.000000\n0.000000 8.769133 0.000000\n0.000000 0.000000 8.769133\nNa Mn O\n12 12 32\ndirect\n0.013360 0.013360 0.013360 Na\n0.125000 0.875000 0.375000 Na\n0.236640 0.236640 0.236640 Na\n0.263360 0.763360 0.736640 Na\n0.375000 0.125000 0.875000 Na\n0.486640 0.986640 0.513360 Na\n0.513360 0.486640 0.986640 Na\n0.625000 0.625000 0.625000 Na\n0.736640 0.263360 0.763360 Na\n0.763360 0.736640 0.263360 Na\n0.875000 0.375000 0.125000 Na\n0.986640 0.513360 0.486640 Na\n0.104136 0.145864 0.625000 Mn\n0.125000 0.395864 0.854136 Mn\n0.145864 0.625000 0.104136 Mn\n0.354136 0.375000 0.604136 Mn\n0.375000 0.604136 0.354136 Mn\n0.395864 0.854136 0.125000 Mn\n0.604136 0.354136 0.375000 Mn\n0.625000 0.104136 0.145864 Mn\n0.645864 0.875000 0.895864 Mn\n0.854136 0.125000 0.395864 Mn\n0.875000 0.895864 0.645864 Mn\n0.895864 0.645864 0.875000 Mn\n0.069282 0.141661 0.406813 O\n0.093187 0.930718 0.641661 O\n0.120284 0.620284 0.879716 O\n0.141661 0.406813 0.069282 O\n0.108339 0.180718 0.843187 O\n0.129716 0.370284 0.629716 O\n0.156813 0.608339 0.319282 O\n0.180718 0.843187 0.108339 O\n0.319282 0.156813 0.608339 O\n0.343187 0.391661 0.819282 O\n0.370284 0.629716 0.129716 O\n0.391661 0.819282 0.343187 O\n0.358339 0.593187 0.569282 O\n0.379716 0.379716 0.379716 O\n0.406813 0.069282 0.141661 O\n0.430718 0.858339 0.906813 O\n0.569282 0.358339 0.593187 O\n0.593187 0.569282 0.358339 O\n0.620284 0.879716 0.120284 O\n0.641661 0.093187 0.930718 O\n0.608339 0.319282 0.156813 O\n0.629716 0.129716 0.370284 O\n0.656813 0.891661 0.680718 O\n0.680718 0.656813 0.891661 O\n0.819282 0.343187 0.391661 O\n0.843187 0.108339 0.180718 O\n0.870284 0.870284 0.870284 O\n0.891661 0.680718 0.656813 O\n0.858339 0.906813 0.430718 O\n0.879716 0.120284 0.620284 O\n0.906813 0.430718 0.858339 O\n0.930718 0.641661 0.093187 O\n",
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{
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"structure_string": "Sr1 Ca1 Gd1 Bi1 O6\n1.0\n0.000000 -4.311256 -4.311256\n4.311256 0.000000 -4.311256\n4.311256 -4.311256 0.000000\nSr Ca Gd Bi O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750000 Ca\n0.500000 0.500000 0.500000 Gd\n0.000000 0.000000 0.000000 Bi\n0.756856 0.243144 0.243144 O\n0.243144 0.756856 0.756856 O\n0.756856 0.243144 0.756856 O\n0.243144 0.756856 0.243144 O\n0.756856 0.756856 0.243144 O\n0.243144 0.243144 0.756856 O\n",
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{
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{
"id": "mp-1175794",
"created_at": "2022-09-04T14:40:23.767865Z",
"structure_string": "Li9 Mn2 Co5 O16\n1.0\n5.006531 0.000000 0.000000\n-1.691590 7.541561 0.000000\n-1.565886 -1.440748 7.468596\nLi Mn Co O\n9 2 5 16\ndirect\n0.501068 0.751589 0.760223 Li\n0.004465 0.374283 0.123355 Li\n0.498990 0.999540 0.488168 Li\n0.998733 0.877543 0.623552 Li\n0.499521 0.507727 0.002605 Li\n0.982121 0.117226 0.367594 Li\n0.016725 0.629928 0.884902 Li\n0.501970 0.239888 0.248272 Li\n0.504491 0.874558 0.127572 Li\n0.003029 0.996728 0.006748 Mn\n0.497271 0.632849 0.366598 Mn\n0.998572 0.249234 0.750735 Co\n0.996626 0.498446 0.500119 Co\n0.502269 0.114259 0.884783 Co\n0.999971 0.752331 0.247711 Co\n0.494187 0.372981 0.624860 Co\n0.785153 0.762235 0.013162 O\n0.253833 0.397766 0.384013 O\n0.770178 0.002675 0.771826 O\n0.248919 0.890962 0.878038 O\n0.748457 0.520741 0.257116 O\n0.245656 0.144791 0.639082 O\n0.252796 0.631444 0.145699 O\n0.747167 0.255252 0.504500 O\n0.245038 0.743853 0.478133 O\n0.753650 0.357143 0.857329 O\n0.220616 0.987847 0.237023 O\n0.748918 0.855149 0.369853 O\n0.241312 0.496298 0.741650 O\n0.764178 0.120289 0.112935 O\n0.729628 0.611593 0.602748 O\n0.244492 0.232850 0.999092 O\n",
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"formula_full": "Li9 Mn2 Co5 O16",
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{
"id": "mp-1046861",
"created_at": "2022-09-04T14:40:23.809544Z",
"structure_string": "Nb4 Zn4 Co2 O16\n1.0\n2.980901 9.690856 0.000000\n-2.980901 9.690856 0.000000\n0.000000 0.027664 5.285080\nNb Zn Co O\n4 4 2 16\ndirect\n0.722248 0.049632 0.766316 Nb\n0.950368 0.277752 0.733684 Nb\n0.277752 0.950368 0.233684 Nb\n0.049632 0.722248 0.266316 Nb\n0.567478 0.873568 0.736873 Zn\n0.126432 0.432522 0.763127 Zn\n0.432522 0.126432 0.263127 Zn\n0.873568 0.567478 0.236873 Zn\n0.354205 0.645795 0.750000 Co\n0.645795 0.354205 0.250000 Co\n0.811401 0.049162 0.426033 O\n0.950838 0.188599 0.073967 O\n0.188599 0.950838 0.573967 O\n0.049162 0.811401 0.926033 O\n0.566084 0.319919 0.913350 O\n0.680081 0.433916 0.586650 O\n0.433916 0.680081 0.086650 O\n0.319919 0.566084 0.413350 O\n0.715343 0.926860 0.062824 O\n0.073140 0.284657 0.437176 O\n0.159816 0.453594 0.135464 O\n0.546406 0.840184 0.364536 O\n0.840184 0.546406 0.864536 O\n0.453594 0.159816 0.635464 O\n0.926860 0.715343 0.562824 O\n0.284657 0.073140 0.937176 O\n",
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{
"id": "mp-1176229",
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"structure_string": "Li9 Mn2 Co5 O16\n1.0\n5.017442 0.000000 0.000000\n-1.585118 4.844669 0.000000\n-0.373477 -0.359324 11.861531\nLi Mn Co O\n9 2 5 16\ndirect\n0.999598 0.502721 0.130932 Li\n0.496858 0.495712 0.251679 Li\n0.002641 0.499406 0.368246 Li\n0.502981 0.504783 0.497393 Li\n0.000780 0.498587 0.624913 Li\n0.502300 0.500169 0.750340 Li\n0.997660 0.498894 0.875056 Li\n0.491948 0.495851 0.003049 Li\n0.003677 0.004619 0.247538 Li\n0.995614 0.994017 0.002356 Mn\n0.499986 0.003275 0.626057 Mn\n0.503976 0.000807 0.130831 Co\n0.510186 0.009204 0.367537 Co\n0.007553 0.003268 0.496364 Co\n0.998495 0.997413 0.750114 Co\n0.494297 0.991531 0.877031 Co\n0.231429 0.764354 0.004975 O\n0.756630 0.779203 0.111641 O\n0.284428 0.771363 0.253663 O\n0.730106 0.781572 0.378571 O\n0.244088 0.768697 0.508062 O\n0.755589 0.774746 0.629336 O\n0.257361 0.762711 0.763131 O\n0.751261 0.774632 0.877235 O\n0.734977 0.250122 0.246640 O\n0.273252 0.219319 0.379202 O\n0.762767 0.233445 0.489454 O\n0.250739 0.231214 0.628344 O\n0.743589 0.236313 0.744425 O\n0.229853 0.208457 0.879885 O\n0.741476 0.216220 0.991927 O\n0.243905 0.227375 0.114069 O\n",
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]
}