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"structure_string": "Ba2 Te2 Mo4 O18\n1.0\n5.541778 0.000000 -0.075016\n0.000000 7.525526 0.000000\n0.018482 0.000000 8.882739\nBa Te Mo O\n2 2 4 18\ndirect\n0.272148 0.747431 0.066626 Ba\n0.727852 0.247431 0.933374 Ba\n0.628462 0.510091 0.420249 Te\n0.371537 0.010090 0.579751 Te\n0.223942 0.272919 0.229590 Mo\n0.776058 0.772919 0.770409 Mo\n0.784625 0.951598 0.325575 Mo\n0.215375 0.451598 0.674425 Mo\n0.980328 0.935554 0.832176 O\n0.019671 0.435554 0.167823 O\n0.489639 0.890061 0.805326 O\n0.510361 0.390061 0.194673 O\n0.444020 0.089835 0.369580 O\n0.286986 0.466440 0.867641 O\n0.541309 0.729000 0.329393 O\n0.705042 0.929816 0.557986 O\n0.294957 0.429816 0.442014 O\n0.220260 0.121643 0.079651 O\n0.779740 0.621643 0.920349 O\n0.963858 0.156956 0.356269 O\n0.036142 0.656957 0.643731 O\n0.019514 0.798700 0.333789 O\n0.980486 0.298700 0.666210 O\n0.713014 0.966441 0.132358 O\n0.458691 0.229000 0.670607 O\n0.555980 0.589835 0.630419 O\n",
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"structure_string": "Ba2 Te2 O6\n1.0\n0.000000 4.630108 -0.024279\n6.000344 0.000000 0.000000\n0.000000 -2.060673 -6.830087\nBa Te O\n2 2 6\ndirect\n0.337789 0.250000 0.686957 Ba\n0.662212 0.750000 0.313044 Ba\n0.070271 0.250000 0.145663 Te\n0.929730 0.750000 0.854338 Te\n0.824196 0.511904 0.673400 O\n0.175805 0.011905 0.326600 O\n0.175805 0.488095 0.326600 O\n0.824196 0.988095 0.673400 O\n0.353562 0.750000 0.892361 O\n0.646439 0.250000 0.107640 O\n",
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{
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"structure_string": "Ba2 Te4\n1.0\n6.129686 -0.008792 -2.961734\n-3.714308 5.636225 -0.884240\n-0.005794 0.008792 6.807708\nBa Te\n2 4\ndirect\n0.000001 0.750000 0.750001 Ba\n0.000000 0.250000 0.250000 Ba\n0.223019 0.361509 0.861510 Te\n0.500001 0.861510 0.638492 Te\n0.776983 0.638492 0.138492 Te\n0.500001 0.138491 0.361510 Te\n",
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"created_at": "2022-09-04T14:36:35.482587Z",
"updated_at": "2022-09-04T14:36:35.482613Z",
"structure_string": "Ba2 Te4 O12\n1.0\n5.655798 -0.000000 0.000000\n-2.827898 6.437671 -0.000000\n0.000000 -0.000000 7.451861\nBa Te O\n2 4 12\ndirect\n0.719379 0.438757 0.250000 Ba\n0.280621 0.561243 0.750000 Ba\n0.585890 0.171779 0.750000 Te\n0.414110 0.828220 0.250000 Te\n0.000000 0.000000 0.500000 Te\n0.000000 0.000000 0.000000 Te\n0.655975 0.786129 0.455887 O\n0.869846 0.213871 0.544113 O\n0.270483 0.540967 0.250000 O\n0.655975 0.786129 0.044113 O\n0.951691 0.903382 0.750000 O\n0.130154 0.786129 0.044113 O\n0.344025 0.213871 0.955887 O\n0.130154 0.786129 0.455887 O\n0.344025 0.213871 0.544113 O\n0.869846 0.213871 0.955887 O\n0.048309 0.096617 0.250000 O\n0.729517 0.459033 0.750000 O\n",
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"structure_string": "Ba2 Te6\n1.0\n8.026996 0.000000 0.000000\n0.000000 8.026996 0.000000\n0.000000 0.000000 4.414616\nBa Te\n2 6\ndirect\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.000000 Ba\n0.799644 0.700357 0.499151 Te\n0.299644 0.799644 0.500850 Te\n0.000000 0.500000 0.104284 Te\n0.500000 0.000000 0.895717 Te\n0.200357 0.299644 0.499151 Te\n0.700357 0.200357 0.500850 Te\n",
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"created_at": "2022-09-04T14:38:31.708720Z",
"updated_at": "2022-09-04T14:38:31.708756Z",
"structure_string": "Ba2 Th2 Br12\n1.0\n4.570330 0.000000 0.000000\n0.000000 9.486416 0.000000\n0.000000 -0.000000 11.601913\nBa Th Br\n2 2 12\ndirect\n0.500000 0.250000 0.252193 Ba\n0.500000 0.750000 0.747807 Ba\n0.000000 0.250000 0.731589 Th\n0.000000 0.750000 0.268411 Th\n0.000000 0.535571 0.849846 Br\n0.000000 0.250000 0.459968 Br\n0.500000 0.750000 0.089483 Br\n0.500000 0.250000 0.910516 Br\n0.000000 0.750000 0.540032 Br\n0.500000 0.927956 0.362371 Br\n0.000000 0.964430 0.849846 Br\n0.000000 0.464430 0.150154 Br\n0.500000 0.072044 0.637629 Br\n0.500000 0.427956 0.637629 Br\n0.000000 0.035571 0.150154 Br\n0.500000 0.572044 0.362371 Br\n",
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{
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"created_at": "2022-09-04T14:35:46.720552Z",
"updated_at": "2022-09-04T14:35:46.720572Z",
"structure_string": "Ba2 Ti1 Bi1\n1.0\n0.000000 4.234963 4.234963\n4.234963 0.000000 4.234963\n4.234963 4.234963 -0.000000\nBa Ti Bi\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.749999 0.749999 0.749999 Ba\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Bi\n",
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"created_at": "2022-09-04T14:35:41.127600Z",
"updated_at": "2022-09-04T14:35:41.127622Z",
"structure_string": "Ba2 Ti1 Br1\n1.0\n-0.000000 4.217468 4.217468\n4.217468 -0.000000 4.217468\n4.217468 4.217468 0.000000\nBa Ti Br\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Br\n",
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{
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"structure_string": "Ba2 Ti1 Cl1\n1.0\n-0.000000 4.163907 4.163907\n4.163907 0.000000 4.163907\n4.163907 4.163907 0.000000\nBa Ti Cl\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Cl\n",
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"structure_string": "Ba2 Ti1 Cr1\n1.0\n0.000000 3.831256 3.831256\n3.831256 0.000000 3.831256\n3.831256 3.831256 -0.000000\nBa Ti Cr\n2 1 1\ndirect\n0.750001 0.750001 0.750001 Ba\n0.250000 0.250000 0.250000 Ba\n0.500001 0.500001 0.500001 Ti\n0.000000 0.000000 0.000000 Cr\n",
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"structure_string": "Ba2 Ti1 Hg1\n1.0\n0.000000 4.108049 4.108049\n4.108049 0.000000 4.108049\n4.108049 4.108049 0.000000\nBa Ti Hg\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 Ba\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Hg\n",
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