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"id": "jvasp-28901",
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"structure_string": "Hg8 Se4 O12\n1.0\n5.149390 0.000000 0.000000\n0.000000 8.392357 -2.114317\n0.000000 0.001142 10.492048\nHg Se O\n8 4 12\ndirect\n0.730504 0.158812 0.593419 Hg\n0.269496 0.841188 0.406581 Hg\n0.769496 0.658812 0.093419 Hg\n0.797423 0.107898 0.341176 Hg\n0.702577 0.607899 0.841176 Hg\n0.202577 0.892102 0.658824 Hg\n0.297423 0.392102 0.158824 Hg\n0.230504 0.341188 0.906581 Hg\n0.243779 0.464395 0.620049 Se\n0.756221 0.535605 0.379950 Se\n0.743779 0.035604 0.879951 Se\n0.256221 0.964396 0.120049 Se\n0.165553 0.309773 0.694790 O\n0.653328 0.870442 0.762471 O\n0.153329 0.629558 0.737529 O\n0.346671 0.129558 0.237529 O\n0.419279 0.525086 0.361176 O\n0.080721 0.025086 0.861176 O\n0.580721 0.474914 0.638824 O\n0.334447 0.809773 0.194789 O\n0.834447 0.690227 0.305210 O\n0.665553 0.190227 0.805211 O\n0.846671 0.370442 0.262471 O\n0.919279 0.974914 0.138824 O\n",
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{
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"structure_string": "K6 In2 P4\n1.0\n6.301149 0.000000 -2.620690\n-1.355373 6.677761 -3.258838\n0.003793 0.069878 8.894662\nK In P\n6 2 4\ndirect\n0.817333 0.024917 0.634667 K\n0.750000 0.500000 -0.000000 K\n0.317334 0.609750 0.634667 K\n0.682666 0.390250 0.365333 K\n0.250000 0.500000 -0.000000 K\n0.182667 0.975083 0.365333 K\n0.250000 -0.000000 0.000000 In\n0.750000 -0.000000 0.000000 In\n0.400351 0.093229 0.800701 P\n0.599649 0.906771 0.199298 P\n0.099649 0.292527 0.199298 P\n0.900351 0.707473 0.800701 P\n",
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{
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"structure_string": "Fe2 O3 F1\n1.0\n4.379777 -0.132719 0.000000\n-0.132719 4.379777 0.000000\n0.000000 0.000000 2.859673\nFe O F\n2 3 1\ndirect\n0.023366 0.976634 0.000000 Fe\n0.479155 0.520845 0.499999 Fe\n0.198633 0.801368 0.499999 O\n0.300635 0.305294 0.000000 O\n0.694707 0.699366 0.000000 O\n0.803506 0.196494 0.499999 F\n",
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{
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"created_at": "2022-09-04T14:36:18.784132Z",
"updated_at": "2022-09-04T14:36:18.784157Z",
"structure_string": "K4 C8 N12\n1.0\n3.745156 0.000002 0.000027\n0.000003 8.704173 -0.000089\n0.000087 -0.000026 11.971020\nK C N\n4 8 12\ndirect\n0.250002 0.622835 0.869658 K\n0.749992 0.377164 0.130342 K\n0.750010 0.877163 0.369658 K\n0.249999 0.122835 0.630343 K\n0.750004 0.485518 0.624584 C\n0.249997 0.246851 0.368511 C\n0.249998 0.514483 0.375416 C\n0.749997 0.985515 0.875416 C\n0.250002 0.746853 0.131489 C\n0.250004 0.014482 0.124582 C\n0.749998 0.253147 0.868510 C\n0.750004 0.753148 0.631489 C\n0.749999 0.358230 0.591168 N\n0.750003 0.383583 0.895180 N\n0.250010 0.641770 0.408832 N\n0.250010 0.116415 0.395181 N\n0.750000 0.883584 0.604819 N\n0.749991 0.117319 0.823824 N\n0.750011 0.617323 0.676177 N\n0.249992 0.141769 0.091167 N\n0.250020 0.882679 0.176179 N\n0.249980 0.382677 0.323822 N\n0.750001 0.858230 0.908835 N\n0.249990 0.616415 0.104821 N\n",
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"structure_string": "La2 Fe1 Si3\n1.0\n4.083796 0.000000 -0.000000\n-2.041898 3.536670 0.000000\n0.000000 -0.000000 8.801490\nLa Fe Si\n2 1 3\ndirect\n0.666668 0.333333 0.741870 La\n0.666668 0.333333 0.258130 La\n0.000000 0.000000 0.500000 Fe\n0.000000 0.000000 0.000000 Si\n0.333333 0.666667 0.500000 Si\n0.333333 0.666667 0.000000 Si\n",
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"structure_string": "Ba8 Mn4 O12\n1.0\n5.853826 0.000000 0.366467\n2.926913 5.814014 0.183233\n-0.037024 0.000000 12.799326\nBa Mn O\n8 4 12\ndirect\n0.212634 0.590330 0.250971 Ba\n0.674277 0.590342 0.053412 Ba\n0.264621 0.409657 0.553412 Ba\n0.583060 0.790200 0.476953 Ba\n0.103983 0.790213 0.827431 Ba\n0.894196 0.209786 0.327431 Ba\n0.373261 0.209799 0.976953 Ba\n0.802965 0.409669 0.750971 Ba\n0.513192 0.006561 0.738160 Mn\n0.957513 0.006549 0.566223 Mn\n0.519751 0.993438 0.238160 Mn\n0.964061 0.993450 0.066223 Mn\n0.722305 0.655996 0.269226 O\n0.098941 0.656008 0.035158 O\n0.754949 0.343992 0.535158 O\n0.369430 0.197477 0.365952 O\n0.636183 0.204878 0.152191 O\n0.107830 0.802506 0.438431 O\n0.910337 0.197494 0.938432 O\n0.242153 0.992944 0.152193 O\n0.235098 0.007056 0.652193 O\n0.378302 0.344004 0.769226 O\n0.566907 0.802522 0.865952 O\n0.841062 0.795121 0.652191 O\n",
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}