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{
"id": "oqmd-1758668",
"created_at": "2022-09-04T16:03:14.348242Z",
"updated_at": "2022-09-04T16:03:14.348268Z",
"structure_string": "Tb4 Sc4 S12\n1.0\n7.033160 0.000000 0.000000\n0.000000 9.521330 0.000000\n0.000000 0.000000 6.388915\nS Sc Tb\n12 4 4\ndirect\n0.954012 0.250000 0.143028 S\n0.684106 0.570256 0.175425 S\n0.684106 0.929744 0.175425 S\n0.184106 0.570256 0.324575 S\n0.184106 0.929744 0.324575 S\n0.454012 0.250000 0.356972 S\n0.545988 0.750000 0.643028 S\n0.815894 0.070256 0.675425 S\n0.815894 0.429744 0.675425 S\n0.315894 0.070256 0.824575 S\n0.315894 0.429744 0.824575 S\n0.045988 0.750000 0.856972 S\n0.000000 0.000000 0.000000 Sc\n0.000000 0.500000 0.000000 Sc\n0.500000 0.000000 0.500000 Sc\n0.500000 0.500000 0.500000 Sc\n0.398468 0.750000 0.040682 Tb\n0.898468 0.750000 0.459318 Tb\n0.101532 0.250000 0.540682 Tb\n0.601532 0.250000 0.959318 Tb\n",
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{
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"updated_at": "2022-09-04T16:03:14.346584Z",
"structure_string": "K4 V4 Cl12\n1.0\n6.990789 0.000000 0.000000\n0.000000 9.850837 0.000000\n0.000000 0.000000 6.870403\nCl K V\n12 4 4\ndirect\n0.505450 0.250000 0.062857 Cl\n0.793459 0.531711 0.205656 Cl\n0.793459 0.968289 0.205656 Cl\n0.293459 0.531711 0.294344 Cl\n0.293459 0.968289 0.294344 Cl\n0.005450 0.250000 0.437143 Cl\n0.994550 0.750000 0.562857 Cl\n0.706541 0.031711 0.705656 Cl\n0.706541 0.468289 0.705656 Cl\n0.206541 0.031711 0.794344 Cl\n0.206541 0.468289 0.794344 Cl\n0.494550 0.750000 0.937143 Cl\n0.050826 0.750000 0.013121 K\n0.550826 0.750000 0.486879 K\n0.449174 0.250000 0.513121 K\n0.949174 0.250000 0.986879 K\n0.500000 0.000000 0.000000 V\n0.500000 0.500000 0.000000 V\n0.000000 0.000000 0.500000 V\n0.000000 0.500000 0.500000 V\n",
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{
"id": "oqmd-1758900",
"created_at": "2022-09-04T16:03:14.343204Z",
"updated_at": "2022-09-04T16:03:14.343221Z",
"structure_string": "Na2 Tb2 Sn2 W2 O12\n1.0\n5.476101 0.000000 0.000000\n0.000000 5.738130 0.000000\n-0.052400 0.000000 8.520540\nNa O Sn Tb W\n2 12 2 2 2\ndirect\n0.748997 0.789863 0.499006 Na\n0.251003 0.289863 0.500994 Na\n0.868913 0.325953 0.010503 O\n0.419728 0.512076 0.148554 O\n0.535188 0.960851 0.162778 O\n0.935157 0.652131 0.253690 O\n0.128520 0.088320 0.269720 O\n0.357088 0.694906 0.433648 O\n0.642912 0.194906 0.566352 O\n0.871480 0.588320 0.730280 O\n0.064843 0.152131 0.746310 O\n0.464812 0.460851 0.837222 O\n0.580272 0.012076 0.851446 O\n0.131087 0.825953 0.989497 O\n0.760159 0.261813 0.256686 Sn\n0.239841 0.761813 0.743314 Sn\n0.264777 0.207478 0.000624 Tb\n0.735223 0.707478 0.999376 Tb\n0.250703 0.771011 0.240290 W\n0.749297 0.271011 0.759710 W\n",
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},
{
"id": "oqmd-1758901",
"created_at": "2022-09-04T16:03:14.342390Z",
"updated_at": "2022-09-04T16:03:14.342421Z",
"structure_string": "Na2 Tb2 Tm2 W2 O12\n1.0\n5.469724 0.000000 0.000000\n0.000000 5.664668 0.000000\n-0.048359 0.000000 8.016092\nNa O Tb Tm W\n2 12 2 2 2\ndirect\n0.251981 0.692086 0.499820 Na\n0.748019 0.192086 0.500180 Na\n0.363515 0.185068 0.002192 O\n0.963616 0.030625 0.175773 O\n0.063904 0.509802 0.176087 O\n0.568921 0.386732 0.275832 O\n0.409225 0.915951 0.284219 O\n0.160893 0.269193 0.473446 O\n0.839107 0.769193 0.526554 O\n0.590775 0.415951 0.715781 O\n0.431079 0.886732 0.724168 O\n0.936096 0.009802 0.823913 O\n0.036384 0.530625 0.824227 O\n0.636485 0.685068 0.997808 O\n0.764648 0.290430 0.000414 Tb\n0.235352 0.790430 0.999586 Tb\n0.750242 0.729873 0.266377 Tm\n0.249758 0.229873 0.733623 Tm\n0.259764 0.225837 0.248501 W\n0.740236 0.725837 0.751499 W\n",
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{
"id": "oqmd-1759020",
"created_at": "2022-09-04T16:03:14.342039Z",
"updated_at": "2022-09-04T16:03:14.342066Z",
"structure_string": "Eu4 Y2 Ir2 O12\n1.0\n5.640690 0.000000 0.000000\n0.000000 5.786664 0.000000\n-5.549024 0.000000 8.052418\nEu Ir O Y\n4 2 12 2\ndirect\n0.233322 0.554193 0.249255 Eu\n0.766678 0.054193 0.250745 Eu\n0.233322 0.945807 0.749255 Eu\n0.766678 0.445807 0.750745 Eu\n0.000000 0.000000 0.000000 Ir\n0.000000 0.500000 0.500000 Ir\n0.767295 0.808647 0.049566 O\n0.866901 0.282116 0.052555 O\n0.330801 0.970889 0.234235 O\n0.669199 0.470889 0.265765 O\n0.133099 0.782116 0.447445 O\n0.232705 0.308647 0.450434 O\n0.767295 0.691353 0.549566 O\n0.866901 0.217884 0.552555 O\n0.330801 0.529111 0.734235 O\n0.669199 0.029111 0.765765 O\n0.133099 0.717884 0.947445 O\n0.232705 0.191353 0.950434 O\n0.500000 0.500000 0.000000 Y\n0.500000 0.000000 0.500000 Y\n",
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"formula_anonymous": "ABC2D6",
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"spacegroup": 14
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{
"id": "oqmd-1758997",
"created_at": "2022-09-04T16:03:14.340390Z",
"updated_at": "2022-09-04T16:03:14.340408Z",
"structure_string": "Sm4 Zn2 Ir2 O12\n1.0\n5.418824 0.000000 0.000000\n0.000000 5.766192 0.000000\n-5.385022 0.000000 7.741678\nIr O Sm Zn\n2 12 4 2\ndirect\n0.000000 0.500000 0.000000 Ir\n0.000000 0.000000 0.500000 Ir\n0.747815 0.693321 0.055799 O\n0.876489 0.200859 0.058195 O\n0.361638 0.536918 0.246171 O\n0.638362 0.036918 0.253829 O\n0.123511 0.700859 0.441805 O\n0.252185 0.193321 0.444201 O\n0.747815 0.806679 0.555799 O\n0.876489 0.299141 0.558195 O\n0.361638 0.963082 0.746171 O\n0.638362 0.463082 0.753829 O\n0.123511 0.799141 0.941805 O\n0.252185 0.306679 0.944201 O\n0.772527 0.426330 0.249038 Sm\n0.227473 0.926330 0.250962 Sm\n0.772527 0.073670 0.749038 Sm\n0.227473 0.573670 0.750962 Sm\n0.500000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Zn\n",
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{
"id": "oqmd-1758651",
"created_at": "2022-09-04T16:03:14.339268Z",
"updated_at": "2022-09-04T16:03:14.339296Z",
"structure_string": "Ni4 Sn4 O12\n1.0\n5.390197 0.000000 0.000000\n0.000000 7.735404 0.000000\n0.000000 0.000000 5.253666\nNi O Sn\n4 12 4\ndirect\n0.537413 0.750000 0.000134 Ni\n0.037413 0.750000 0.499866 Ni\n0.962587 0.250000 0.500134 Ni\n0.462587 0.250000 0.999866 Ni\n0.090287 0.250000 0.141142 O\n0.323748 0.575686 0.169368 O\n0.323748 0.924314 0.169368 O\n0.823748 0.575686 0.330632 O\n0.823748 0.924314 0.330632 O\n0.590287 0.250000 0.358858 O\n0.409713 0.750000 0.641142 O\n0.176252 0.075686 0.669368 O\n0.176252 0.424314 0.669368 O\n0.676252 0.075686 0.830632 O\n0.676252 0.424314 0.830632 O\n0.909713 0.750000 0.858858 O\n0.000000 0.000000 0.000000 Sn\n0.000000 0.500000 0.000000 Sn\n0.500000 0.000000 0.500000 Sn\n0.500000 0.500000 0.500000 Sn\n",
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{
"id": "oqmd-1758899",
"created_at": "2022-09-04T16:03:14.336810Z",
"updated_at": "2022-09-04T16:03:14.336838Z",
"structure_string": "Na2 Tb2 Ni2 W2 O12\n1.0\n5.332621 0.000000 0.000000\n0.000000 5.501347 0.000000\n-0.034616 0.000000 7.763814\nNa Ni O Tb W\n2 2 12 2 2\ndirect\n0.748488 0.187224 0.001268 Na\n0.251512 0.687224 0.998732 Na\n0.249057 0.229125 0.249584 Ni\n0.750943 0.729125 0.750416 Ni\n0.826863 0.752654 0.006922 O\n0.571244 0.422790 0.216007 O\n0.443919 0.907146 0.220450 O\n0.034982 0.526884 0.310875 O\n0.941719 0.005349 0.311325 O\n0.648503 0.693380 0.496011 O\n0.351497 0.193380 0.503989 O\n0.058281 0.505349 0.688675 O\n0.965018 0.026884 0.689125 O\n0.556081 0.407146 0.779550 O\n0.428756 0.922790 0.783993 O\n0.173137 0.252654 0.993078 O\n0.235141 0.786773 0.499242 Tb\n0.764859 0.286773 0.500758 Tb\n0.738582 0.724272 0.233682 W\n0.261418 0.224272 0.766318 W\n",
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{
"id": "oqmd-1758894",
"created_at": "2022-09-04T16:03:14.335682Z",
"updated_at": "2022-09-04T16:03:14.335713Z",
"structure_string": "Na2 Tb2 V2 W2 O12\n1.0\n5.371720 0.000000 0.000000\n0.000000 5.576984 0.000000\n-0.037325 0.000000 7.851586\nNa O Tb V W\n2 12 2 2 2\ndirect\n0.754197 0.686143 0.499025 Na\n0.245803 0.186143 0.500975 Na\n0.857432 0.187709 0.005595 O\n0.564512 0.505750 0.183632 O\n0.465293 0.033125 0.185497 O\n0.055790 0.402865 0.280056 O\n0.924168 0.925384 0.286326 O\n0.668376 0.255265 0.487079 O\n0.331624 0.755265 0.512921 O\n0.075832 0.425384 0.713674 O\n0.944210 0.902865 0.719944 O\n0.534707 0.533125 0.814503 O\n0.435488 0.005750 0.816368 O\n0.142568 0.687709 0.994405 O\n0.264798 0.288692 0.000591 Tb\n0.735202 0.788692 0.999409 Tb\n0.252210 0.726689 0.252453 V\n0.747790 0.226689 0.747547 V\n0.760585 0.223976 0.263001 W\n0.239415 0.723976 0.736999 W\n",
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{
"id": "oqmd-1758963",
"created_at": "2022-09-04T16:03:14.331632Z",
"updated_at": "2022-09-04T16:03:14.331652Z",
"structure_string": "Sr4 La2 Nb2 O12\n1.0\n5.876560 0.000000 0.000000\n0.000000 6.046624 0.000000\n-5.831739 0.000000 8.401727\nLa Nb O Sr\n2 2 12 4\ndirect\n0.000000 0.500000 0.000000 La\n0.000000 0.000000 0.500000 La\n0.500000 0.000000 0.000000 Nb\n0.500000 0.500000 0.500000 Nb\n0.272194 0.818397 0.050758 O\n0.384218 0.278187 0.059458 O\n0.831234 0.958781 0.227532 O\n0.168766 0.458781 0.272468 O\n0.615782 0.778187 0.440542 O\n0.727806 0.318397 0.449242 O\n0.272194 0.681603 0.550758 O\n0.384218 0.221813 0.559458 O\n0.831234 0.541219 0.727532 O\n0.168766 0.041219 0.772468 O\n0.615782 0.721813 0.940542 O\n0.727806 0.181603 0.949242 O\n0.260941 0.048766 0.248525 Sr\n0.739059 0.548766 0.251475 Sr\n0.260941 0.451234 0.748525 Sr\n0.739059 0.951234 0.751475 Sr\n",
"nsites": 20,
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{
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"created_at": "2022-09-04T16:03:14.328715Z",
"updated_at": "2022-09-04T16:03:14.328743Z",
"structure_string": "K4 Ag4 F12\n1.0\n5.870014 0.000000 0.000000\n0.000000 8.321191 0.000000\n0.000000 0.000000 5.997515\nAg F K\n4 12 4\ndirect\n0.000000 0.000000 0.000000 Ag\n0.000000 0.500000 0.000000 Ag\n0.500000 0.000000 0.500000 Ag\n0.500000 0.500000 0.500000 Ag\n0.004373 0.250000 0.086205 F\n0.258389 0.548136 0.241524 F\n0.258389 0.951864 0.241524 F\n0.758389 0.548136 0.258476 F\n0.758389 0.951864 0.258476 F\n0.504373 0.250000 0.413795 F\n0.495627 0.750000 0.586205 F\n0.241611 0.048136 0.741524 F\n0.241611 0.451864 0.741524 F\n0.741611 0.048136 0.758476 F\n0.741611 0.451864 0.758476 F\n0.995627 0.750000 0.913795 F\n0.509721 0.750000 0.007824 K\n0.009721 0.750000 0.492176 K\n0.990279 0.250000 0.507824 K\n0.490279 0.250000 0.992176 K\n",
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{
"id": "oqmd-1758988",
"created_at": "2022-09-04T16:03:14.326160Z",
"updated_at": "2022-09-04T16:03:14.326186Z",
"structure_string": "K2 Rb4 Tb2 F12\n1.0\n6.300584 0.000000 0.000000\n0.000000 6.441442 0.000000\n-6.239814 0.000000 8.986806\nF K Rb Tb\n12 2 4 2\ndirect\n0.827988 0.681809 0.044519 F\n0.725457 0.217431 0.049382 F\n0.640406 0.529922 0.232382 F\n0.359594 0.029922 0.267618 F\n0.274543 0.717431 0.450618 F\n0.172012 0.181809 0.455481 F\n0.827988 0.818191 0.544519 F\n0.725457 0.282569 0.549382 F\n0.640406 0.970078 0.732382 F\n0.359594 0.470078 0.767618 F\n0.274543 0.782569 0.950618 F\n0.172012 0.318191 0.955481 F\n0.000000 0.000000 0.000000 K\n0.000000 0.500000 0.500000 K\n0.238583 0.450250 0.249619 Rb\n0.761417 0.950250 0.250381 Rb\n0.238583 0.049750 0.749619 Rb\n0.761417 0.549750 0.750381 Rb\n0.500000 0.500000 0.000000 Tb\n0.500000 0.000000 0.500000 Tb\n",
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"elements": [
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}
]
}