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{
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{
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"structure_string": "Cu3 Ni1 H6 Cl2 O6\n1.0\n5.706781 -0.024785 1.995657\n1.408348 5.530328 1.995657\n-0.032030 -0.024785 6.045575\nCu Ni H Cl O\n3 1 6 2 6\ndirect\n0.500000 0.500001 0.000000 Cu\n0.500000 0.000001 0.500000 Cu\n0.000000 0.500001 0.500000 Cu\n0.500000 0.500001 0.500000 Ni\n0.228735 0.820027 0.228735 H\n0.820026 0.228736 0.228735 H\n0.771265 0.179975 0.771264 H\n0.771265 0.771266 0.179974 H\n0.179974 0.771266 0.771264 H\n0.228735 0.228736 0.820026 H\n0.821266 0.821268 0.821266 Cl\n0.178733 0.178734 0.178733 Cl\n0.727581 0.727583 0.360464 O\n0.272419 0.272420 0.639536 O\n0.272419 0.639537 0.272419 O\n0.360464 0.727583 0.727581 O\n0.727581 0.360465 0.727581 O\n0.639536 0.272420 0.272419 O\n",
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{
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"structure_string": "Mg12 Ni6\n1.0\n2.594372 -4.493584 -0.000000\n2.594372 4.493584 0.000000\n-0.000000 -0.000000 13.136000\nMg Ni\n12 6\ndirect\n0.500000 0.500000 0.717195 Mg\n0.835835 0.164164 0.833333 Mg\n0.164164 0.328330 0.500000 Mg\n0.671669 0.835835 0.166667 Mg\n0.835835 0.671669 0.500000 Mg\n0.164164 0.835835 0.833333 Mg\n0.328330 0.164164 0.166667 Mg\n0.500000 0.000000 0.616138 Mg\n0.500000 0.500000 0.949472 Mg\n0.000000 0.500000 0.050528 Mg\n0.500000 0.000000 0.383862 Mg\n0.000000 0.500000 0.282805 Mg\n0.500000 0.500000 0.333333 Ni\n0.000000 0.000000 0.666667 Ni\n0.000000 0.000000 0.333333 Ni\n0.000000 0.000000 0.000000 Ni\n0.000000 0.500000 0.666667 Ni\n0.500000 0.000000 0.000000 Ni\n",
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{
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"structure_string": "Cd6 I12\n1.0\n4.285873 0.000000 0.000000\n-2.142937 3.711676 -0.000000\n0.000000 -0.000000 41.277729\nCd I\n6 12\ndirect\n0.666666 0.333333 0.041665 Cd\n0.333333 0.666668 0.208351 Cd\n0.333333 0.666668 0.541686 Cd\n0.333333 0.666668 0.708356 Cd\n-0.000000 0.000000 0.374972 Cd\n0.333333 0.666668 0.874970 Cd\n-0.000000 0.000000 0.666342 I\n0.666666 0.333333 0.250368 I\n0.666666 0.333333 0.916979 I\n0.000000 -0.000000 -0.000365 I\n0.666666 0.333333 0.417001 I\n0.333333 0.666668 0.332974 I\n-0.000000 0.000000 0.832958 I\n-0.000000 0.000000 0.499675 I\n0.333333 0.666668 0.083667 I\n-0.000000 0.000000 0.166334 I\n0.666666 0.333333 0.583701 I\n0.666666 0.333333 0.750368 I\n",
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{
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"created_at": "2022-09-04T14:37:54.111881Z",
"updated_at": "2022-09-04T14:37:54.111901Z",
"structure_string": "Fe6 O5 F7\n1.0\n-4.901829 4.901829 2.987936\n-0.226581 4.676741 -2.990406\n-4.676741 0.226581 -2.990406\nFe O F\n6 5 7\ndirect\n0.833333 0.663216 0.670118 Fe\n0.672060 0.322393 0.335275 Fe\n0.333332 0.696064 0.637271 Fe\n0.147320 0.344310 0.365738 Fe\n0.519347 0.967595 -0.010977 Fe\n-0.005394 0.998058 0.010940 Fe\n-0.006995 0.705578 0.313968 O\n-0.009082 0.303074 0.719209 O\n0.675747 0.614124 0.030261 O\n0.333332 0.988260 0.345075 O\n0.673661 0.019366 0.627756 O\n0.333332 0.382370 0.950964 F\n0.295080 0.902838 0.899364 F\n0.972010 0.236335 0.240171 F\n0.641584 0.567708 0.571751 F\n0.025081 0.761582 0.765627 F\n0.371586 0.433970 0.430497 F\n0.694657 0.093162 0.096997 F\n",
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{
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"updated_at": "2022-09-04T14:37:36.276405Z",
"structure_string": "Rb4 Mn6 Se8\n1.0\n5.116105 0.000000 1.683109\n1.960726 8.655568 2.657234\n-0.210568 0.288037 9.257262\nRb Mn Se\n4 6 8\ndirect\n0.749910 0.875245 0.124755 Rb\n0.750091 0.375245 0.624755 Rb\n0.250091 0.124756 0.875244 Rb\n0.249910 0.624755 0.375244 Rb\n0.750000 -0.002478 0.502478 Mn\n0.250001 0.497522 0.002478 Mn\n0.750001 0.750000 0.749999 Mn\n0.750001 0.502479 -0.002479 Mn\n0.250000 0.002479 0.497521 Mn\n0.250000 0.250000 0.250000 Mn\n0.403954 0.219863 0.471155 Se\n0.594972 0.280137 0.028845 Se\n0.905029 0.471155 0.219862 Se\n0.596047 0.780138 0.528844 Se\n0.405029 0.719863 0.971154 Se\n0.903955 0.971156 0.719862 Se\n0.094972 0.528845 0.780137 Se\n0.096046 0.028845 0.280137 Se\n",
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{
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}