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{
"id": "jvasp-63910",
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"structure_string": "Ba4 Ge1 Sb1\n1.0\n-0.000000 4.902421 4.902421\n4.902421 -0.000000 4.902421\n4.902421 4.902421 -0.000000\nBa Ge Sb\n4 1 1\ndirect\n0.123933 0.625355 0.625355 Ba\n0.625355 0.625355 0.625355 Ba\n0.625355 0.123933 0.625355 Ba\n0.625355 0.625355 0.123933 Ba\n0.250000 0.250000 0.250000 Ge\n0.000000 0.000000 0.000000 Sb\n",
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{
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{
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{
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"created_at": "2022-09-04T14:37:15.808762Z",
"updated_at": "2022-09-04T14:37:15.808786Z",
"structure_string": "Ba4 Ge2 Se8\n1.0\n0.000000 7.097853 0.045375\n7.112894 0.000000 0.000000\n0.000000 -2.947405 -8.719041\nBa Ge Se\n4 2 8\ndirect\n0.717434 0.250000 0.924262 Ba\n0.282566 0.750000 0.075738 Ba\n0.782579 0.250000 0.451370 Ba\n0.217421 0.750000 0.548630 Ba\n0.792480 0.750000 0.709905 Ge\n0.207520 0.250000 0.290095 Ge\n0.011619 0.011098 0.771903 Se\n0.988381 0.511097 0.228097 Se\n0.988381 0.988902 0.228097 Se\n0.011619 0.488902 0.771903 Se\n0.627913 0.750000 0.437158 Se\n0.372087 0.250000 0.562841 Se\n0.588869 0.750000 0.871765 Se\n0.411131 0.250000 0.128235 Se\n",
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{
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"created_at": "2022-09-04T14:37:19.209742Z",
"updated_at": "2022-09-04T14:37:19.209753Z",
"structure_string": "Ba4 Ge2 Te4 Se4\n1.0\n7.242291 0.000000 0.000000\n0.000000 7.153801 -2.328902\n0.000000 -0.013177 9.304047\nBa Ge Te Se\n4 2 4 4\ndirect\n0.250000 0.225182 0.054753 Ba\n0.250000 0.224171 0.557403 Ba\n0.750000 0.775828 0.442598 Ba\n0.750000 0.774818 0.945247 Ba\n0.250000 0.783345 0.696350 Ge\n0.750000 0.216654 0.303650 Ge\n0.250000 0.609609 0.900643 Te\n0.250000 0.610495 0.405418 Te\n0.750000 0.389505 0.594583 Te\n0.750000 0.390390 0.099357 Te\n0.505260 -0.004064 0.751273 Se\n0.005260 0.004064 0.248727 Se\n0.494740 0.004064 0.248727 Se\n0.994740 -0.004064 0.751273 Se\n",
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{
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"created_at": "2022-09-04T14:37:11.642940Z",
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"structure_string": "Ba4 Ge4 O12\n1.0\n4.658297 0.000000 0.000000\n0.000000 5.775212 0.000000\n0.000000 0.000000 12.947416\nBa Ge O\n4 4 12\ndirect\n0.276641 0.817794 0.861199 Ba\n0.776641 0.682205 0.138801 Ba\n0.723360 0.317794 0.638801 Ba\n0.223359 0.182206 0.361199 Ba\n0.827197 0.307037 0.923124 Ge\n0.327197 0.192963 0.076876 Ge\n0.172803 0.807036 0.576876 Ge\n0.672804 0.692963 0.423124 Ge\n0.783700 0.788209 0.552281 O\n0.283700 0.711791 0.447719 O\n0.741170 0.888197 0.323222 O\n0.241170 0.611802 0.676778 O\n0.258830 0.388198 0.176778 O\n0.264809 0.895403 0.087662 O\n0.735192 0.395403 0.412338 O\n0.235192 0.104597 0.587662 O\n0.716301 0.211791 0.052281 O\n0.764809 0.604597 0.912338 O\n0.758831 0.111802 0.823222 O\n0.216301 0.288209 0.947720 O\n",
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{
"id": "jvasp-112970",
"created_at": "2022-09-04T14:38:46.030627Z",
"updated_at": "2022-09-04T14:38:46.030654Z",
"structure_string": "Ba4 Ge4 Pb4 O16\n1.0\n6.265355 -0.000000 0.000000\n0.000000 7.647312 0.000000\n-0.000000 -0.000000 10.313548\nBa Ge Pb O\n4 4 4 16\ndirect\n0.475465 0.750153 0.788909 Ba\n0.975465 0.749847 0.211091 Ba\n0.024535 0.249847 0.288909 Ba\n0.524536 0.250153 0.711091 Ba\n0.518635 0.960169 0.089339 Ge\n0.018635 0.539831 0.910661 Ge\n0.981366 0.039831 0.589339 Ge\n0.481366 0.460169 0.410661 Ge\n0.565714 0.443016 0.091020 Pb\n0.065714 0.056983 0.908980 Pb\n0.934287 0.556983 0.591020 Pb\n0.434287 0.943016 0.408980 Pb\n0.798346 0.514919 0.801196 O\n0.298345 0.985081 0.198804 O\n0.410803 0.237870 0.447529 O\n0.910803 0.262130 0.552472 O\n0.089198 0.762130 0.947529 O\n0.589198 0.737869 0.052471 O\n0.256156 0.552630 0.334603 O\n0.937466 0.442197 0.060619 O\n0.243844 0.447370 0.834603 O\n0.743845 0.052630 0.165397 O\n0.562535 0.557803 0.560620 O\n0.062535 0.942197 0.439381 O\n0.201655 0.014919 0.698804 O\n0.437465 0.057803 0.939381 O\n0.756157 0.947369 0.665397 O\n0.701655 0.485081 0.301196 O\n",
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{
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"structure_string": "Ba4 Ge4 Pt4\n1.0\n6.830964 0.000000 -0.000000\n-0.000000 6.830964 -0.000000\n0.000000 0.000000 6.830964\nBa Ge Pt\n4 4 4\ndirect\n0.134211 0.134211 0.134211 Ba\n0.634211 0.365789 0.865788 Ba\n0.365789 0.865788 0.634211 Ba\n0.865788 0.634211 0.365789 Ba\n0.339918 0.660081 0.160081 Ge\n0.160081 0.339918 0.660081 Ge\n0.660081 0.160081 0.339918 Ge\n0.839918 0.839918 0.839918 Ge\n0.411090 0.411090 0.411090 Pt\n0.088910 0.588909 0.911090 Pt\n0.911090 0.088910 0.588909 Pt\n0.588909 0.911090 0.088910 Pt\n",
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{
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"created_at": "2022-09-04T14:35:47.417469Z",
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"structure_string": "Ba4 Ge8 P8\n1.0\n7.714454 0.000000 0.000000\n0.000000 7.714454 0.000000\n0.000000 0.000000 8.598950\nBa Ge P\n4 8 8\ndirect\n0.000000 0.000000 0.998024 Ba\n0.500000 0.000000 0.026853 Ba\n0.000000 0.500000 0.526853 Ba\n0.000000 0.000000 0.498024 Ba\n0.500000 0.668626 0.365559 Ge\n0.668626 0.500000 0.865559 Ge\n0.331373 0.500000 0.865559 Ge\n0.500000 0.331373 0.365559 Ge\n0.500000 0.833599 0.615137 Ge\n0.166400 0.500000 0.115137 Ge\n0.833599 0.500000 0.115137 Ge\n0.500000 0.166400 0.615137 Ge\n0.247216 0.767075 0.756533 P\n0.767075 0.752783 0.256533 P\n0.232924 0.247216 0.256533 P\n0.752783 0.232924 0.756533 P\n0.767075 0.247216 0.256533 P\n0.232924 0.752783 0.256533 P\n0.752783 0.767075 0.756533 P\n0.247216 0.232924 0.756533 P\n",
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{
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{
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"structure_string": "Ba4 H12 Pt2\n1.0\n7.259677 3.006177 -0.000000\n-7.259677 3.006177 -0.000000\n0.000000 0.000000 6.012338\nBa H Pt\n4 12 2\ndirect\n0.141539 0.858462 0.500000 Ba\n0.641539 0.358462 0.000000 Ba\n0.858462 0.141539 0.500000 Ba\n0.358462 0.641539 0.000000 Ba\n0.801950 0.801950 0.801986 H\n0.198051 0.198051 0.198014 H\n0.698051 0.698051 0.301986 H\n0.301949 0.301949 0.698014 H\n0.115238 0.884763 0.000000 H\n0.615238 0.384763 0.500000 H\n0.384763 0.615238 0.500000 H\n0.499769 -0.000231 0.750000 H\n0.000232 0.500232 0.250000 H\n0.500232 0.000232 0.250000 H\n-0.000231 0.499769 0.750000 H\n0.884763 0.115238 0.000000 H\n0.500000 0.500000 0.500000 Pt\n0.000000 0.000000 0.000000 Pt\n",
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}
]
}