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{
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{
"id": "mp-672351",
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"structure_string": "Sm12 Br26\n1.0\n3.669977 21.512516 0.000000\n-3.669977 21.512516 0.000000\n0.000000 0.999612 7.264026\nSm Br\n12 26\ndirect\n0.585497 0.156032 0.044860 Sm\n0.495650 0.904027 0.175728 Sm\n0.699128 0.221814 0.585353 Sm\n0.221814 0.699128 0.085353 Sm\n0.156032 0.585497 0.544860 Sm\n0.778186 0.300872 0.914647 Sm\n0.414503 0.843968 0.955140 Sm\n0.504350 0.095973 0.824272 Sm\n0.095973 0.504350 0.324272 Sm\n0.904027 0.495650 0.675728 Sm\n0.843968 0.414503 0.455140 Sm\n0.300872 0.778186 0.414647 Sm\n0.462912 0.374670 0.319405 Br\n0.290633 0.224308 0.119236 Br\n0.775692 0.709367 0.380764 Br\n0.551714 0.448286 0.250000 Br\n0.177811 0.025336 0.289725 Br\n0.135318 0.228870 0.401882 Br\n0.901844 0.159915 0.544427 Br\n0.025336 0.177811 0.789725 Br\n0.773179 0.551014 0.070769 Br\n0.864682 0.771130 0.598118 Br\n0.448286 0.551714 0.750000 Br\n0.448986 0.226821 0.429231 Br\n0.840085 0.098156 0.955573 Br\n0.537088 0.625330 0.680595 Br\n0.226821 0.448986 0.929231 Br\n0.625330 0.537088 0.180595 Br\n0.228870 0.135318 0.901882 Br\n0.709367 0.775692 0.880764 Br\n0.974664 0.822189 0.210275 Br\n0.551014 0.773179 0.570769 Br\n0.098156 0.840085 0.455573 Br\n0.771130 0.864682 0.098118 Br\n0.159915 0.901844 0.044427 Br\n0.822189 0.974664 0.710275 Br\n0.224308 0.290633 0.619236 Br\n0.374670 0.462912 0.819405 Br\n",
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{
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"structure_string": "Fe1 H8 C4 S4 N6\n1.0\n3.940806 0.000000 0.000000\n-1.591968 7.576964 0.000000\n-1.556176 -0.962437 10.111324\nFe H C S N\n1 8 4 4 6\ndirect\n0.000000 0.000000 0.000000 Fe\n0.332581 0.483483 0.703063 H\n0.667419 0.516517 0.296937 H\n0.392623 0.523362 0.874576 H\n0.607377 0.476638 0.125424 H\n0.456773 0.216994 0.609319 H\n0.543227 0.783006 0.390681 H\n0.602854 0.069649 0.717946 H\n0.397146 0.930351 0.282054 H\n0.064685 0.184611 0.287896 C\n0.935315 0.815389 0.712104 C\n0.498455 0.288037 0.808739 C\n0.501545 0.711963 0.191261 C\n0.022011 0.295042 0.420617 S\n0.977989 0.704958 0.579383 S\n0.586798 0.223613 0.966942 S\n0.413202 0.776387 0.033058 S\n0.092243 0.102536 0.189392 N\n0.907757 0.897464 0.810608 N\n0.395397 0.440184 0.793662 N\n0.604603 0.559816 0.206338 N\n0.528927 0.186558 0.703608 N\n0.471073 0.813442 0.296392 N\n",
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{
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"structure_string": "Tm3 Tl1 C1\n1.0\n5.532385 0.000000 0.000000\n0.000000 5.532385 0.000000\n0.000000 0.000000 5.532385\nTm Tl C\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Tm\n0.500000 0.500000 0.000000 Tm\n0.500000 0.000000 0.500000 Tm\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 C\n",
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{
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{
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{
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{
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{
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{
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