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"structure_string": "Cr4 Fe1 Cu1 S8\n1.0\n5.992025 0.000000 3.459497\n1.997342 5.649336 3.459497\n0.000000 0.000000 6.918995\nCr Fe Cu S\n4 1 1 8\ndirect\n0.624235 0.624235 0.624235 Cr\n0.624235 0.624235 0.127295 Cr\n0.624235 0.127295 0.624235 Cr\n0.127294 0.624235 0.624235 Cr\n0.000000 0.000000 0.000000 Fe\n0.250000 0.250000 0.250000 Cu\n0.871590 0.385233 0.871590 S\n0.385233 0.871590 0.871590 S\n0.871590 0.871590 0.385233 S\n0.871590 0.871590 0.871590 S\n0.383024 0.850930 0.383024 S\n0.850930 0.383024 0.383024 S\n0.383024 0.383024 0.383024 S\n0.383024 0.383024 0.850930 S\n",
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"structure_string": "I4 O8 F4\n1.0\n5.332060 0.000000 0.000000\n0.000000 5.724353 0.000000\n0.000000 0.000000 7.673513\nI O F\n4 8 4\ndirect\n0.290864 0.394868 0.666816 I\n0.790864 0.105131 0.333184 I\n0.709136 0.894868 0.833184 I\n0.209136 0.605131 0.166816 I\n0.398541 0.338011 0.448097 O\n0.898541 0.161988 0.551902 O\n0.601459 0.838011 0.051903 O\n0.101459 0.661988 0.948097 O\n0.572719 0.551855 0.742563 O\n0.927282 0.448145 0.242563 O\n0.427282 0.051855 0.757437 O\n0.072718 0.948144 0.257437 O\n0.379320 0.321343 0.082594 F\n0.620680 0.821343 0.417406 F\n0.879320 0.178656 0.917406 F\n0.120680 0.678656 0.582594 F\n",
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"structure_string": "Hg4 Mo2 O8\n1.0\n4.798086 0.029777 -1.283275\n-2.550540 6.589020 -2.078526\n0.015632 0.054746 7.364609\nHg Mo O\n4 2 8\ndirect\n0.516899 0.249167 0.467944 Hg\n0.983103 0.532058 0.750834 Hg\n0.483102 0.750834 0.532057 Hg\n0.016898 0.467944 0.249166 Hg\n0.250000 0.100179 0.899822 Mo\n0.750001 0.899822 0.100179 Mo\n0.704757 0.949541 0.335162 O\n0.295244 0.050460 0.664839 O\n0.853242 0.915900 0.818367 O\n0.353242 0.818367 0.915899 O\n0.204757 0.335162 0.949541 O\n0.646759 0.181634 0.084102 O\n0.146759 0.084101 0.181633 O\n0.795244 0.664839 0.050460 O\n",
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