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"structure_string": "Ca1 U1 O4\n1.0\n3.709226 -0.000000 -0.000000\n0.000000 3.709226 -0.000000\n-0.000000 -0.000000 5.457187\nCa U O\n1 1 4\ndirect\n0.000000 0.000000 0.500000 Ca\n0.500000 0.500000 0.000000 U\n0.500000 0.000000 0.775853 O\n0.000000 0.500000 0.224148 O\n0.500000 0.000000 0.224148 O\n0.000000 0.500000 0.775853 O\n",
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{
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"structure_string": "Ba4 Fe1 Mo1\n1.0\n-0.000000 4.842677 4.842677\n4.842677 0.000000 4.842677\n4.842677 4.842677 -0.000000\nBa Fe Mo\n4 1 1\ndirect\n0.125456 0.624849 0.624849 Ba\n0.624849 0.624849 0.624849 Ba\n0.624849 0.125456 0.624849 Ba\n0.624849 0.624849 0.125456 Ba\n0.250000 0.250000 0.250000 Fe\n0.000000 0.000000 0.000000 Mo\n",
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"structure_string": "Ba4 Ru1 W1\n1.0\n0.000000 4.712438 4.712438\n4.712438 -0.000000 4.712438\n4.712438 4.712438 -0.000000\nBa Ru W\n4 1 1\ndirect\n0.125458 0.624848 0.624848 Ba\n0.624848 0.624848 0.624848 Ba\n0.624848 0.125458 0.624848 Ba\n0.624848 0.624848 0.125458 Ba\n0.250000 0.250000 0.250000 Ru\n0.000000 0.000000 0.000000 W\n",
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"structure_string": "Ba2 Mo2 O8\n1.0\n5.626140 -0.000000 -0.000000\n0.000000 5.626140 0.000000\n-2.813070 -2.813070 6.423437\nBa Mo O\n2 2 8\ndirect\n0.125000 0.375000 0.250000 Ba\n0.875000 0.625000 0.750000 Ba\n0.625000 0.875000 0.250000 Mo\n0.375000 0.125000 0.750000 Mo\n0.781076 0.918053 0.095108 O\n0.314032 0.677055 0.095108 O\n0.418053 0.814032 0.595108 O\n0.177055 0.281076 0.595108 O\n0.218924 0.081947 0.904892 O\n0.685968 0.322945 0.904892 O\n0.581947 0.185968 0.404892 O\n0.822945 0.718924 0.404892 O\n",
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"structure_string": "Mn2 P2 O8\n1.0\n-4.994958 0.049774 0.033184\n1.449670 4.863421 -0.010497\n-0.125788 -1.178794 -6.051149\nMn P O\n2 2 8\ndirect\n0.133186 0.732004 0.702128 Mn\n0.866814 0.267996 0.297873 Mn\n0.708493 0.145580 0.786169 P\n0.291508 0.854420 0.213832 P\n0.395678 0.077270 0.711958 O\n0.802443 0.882359 0.755809 O\n0.877009 0.347838 0.631225 O\n0.749918 0.316068 0.023314 O\n0.197557 0.117641 0.244193 O\n0.250083 0.683932 0.976687 O\n0.122992 0.652162 0.368777 O\n0.604322 0.922730 0.288043 O\n",
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