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{
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{
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{
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"structure_string": "Fe12 O12 F12\n1.0\n3.097075 0.000000 0.000000\n0.000000 9.524449 0.000000\n0.000000 0.151773 14.227965\nFe O F\n12 12 12\ndirect\n0.000000 0.990579 0.991669 Fe\n0.000000 0.503445 0.995673 Fe\n0.500000 0.245952 0.808367 Fe\n0.500000 0.745227 0.844037 Fe\n0.000000 0.005251 0.657981 Fe\n0.000000 0.484375 0.661906 Fe\n0.500000 0.779628 0.500121 Fe\n0.500000 0.248939 0.511875 Fe\n0.000000 0.991236 0.329088 Fe\n0.000000 0.496818 0.323881 Fe\n0.500000 0.246606 0.186799 Fe\n0.500000 0.750383 0.188003 Fe\n0.500000 0.903022 0.934444 O\n0.000000 0.644892 0.902160 O\n0.000000 0.356530 0.771948 O\n0.500000 0.088278 0.733187 O\n0.500000 0.408484 0.599487 O\n0.500000 0.898678 0.606313 O\n0.000000 0.155921 0.561020 O\n0.000000 0.850793 0.431962 O\n0.500000 0.405457 0.267693 O\n0.500000 0.908305 0.266198 O\n0.000000 0.151723 0.232065 O\n0.000000 0.649731 0.229959 O\n0.500000 0.398369 0.941208 F\n0.000000 0.159644 0.903645 F\n0.000000 0.836523 0.773295 F\n0.500000 0.605410 0.731949 F\n0.000000 0.652145 0.564562 F\n0.000000 0.350825 0.431995 F\n0.500000 0.106798 0.396605 F\n0.500000 0.593666 0.398801 F\n0.000000 0.350900 0.096309 F\n0.000000 0.844938 0.099287 F\n0.500000 0.096450 0.061841 F\n0.500000 0.594077 0.064666 F\n",
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{
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"structure_string": "Co6 O4 F8\n1.0\n4.652105 0.000000 0.000000\n-0.014802 5.608290 0.000000\n-0.000247 -0.345673 7.812272\nCo O F\n6 4 8\ndirect\n0.546510 0.324240 0.823543 Co\n0.500000 0.000000 0.500000 Co\n0.453490 0.675760 0.176457 Co\n0.996276 0.159921 0.151120 Co\n0.000000 0.500000 0.500000 Co\n0.003724 0.840079 0.848880 Co\n0.200882 0.862972 0.072632 O\n0.289272 0.695804 0.408189 O\n0.710728 0.304196 0.591811 O\n0.799118 0.137028 0.927368 O\n0.196508 0.201326 0.389440 F\n0.213279 0.527945 0.741091 F\n0.309079 0.369078 0.062260 F\n0.304199 0.042585 0.730616 F\n0.695801 0.957415 0.269384 F\n0.690921 0.630922 0.937740 F\n0.803492 0.798674 0.610560 F\n0.786721 0.472055 0.258909 F\n",
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{
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"structure_string": "Mg30 B1 W1 O32\n1.0\n8.568672 0.000000 0.000000\n0.000000 8.568672 0.000000\n0.000000 0.000000 8.560129\nMg B W O\n30 1 1 32\ndirect\n0.500000 0.000000 0.000000 Mg\n0.000000 0.500000 0.000000 Mg\n0.000000 0.000000 0.500000 Mg\n0.500000 0.000000 0.500000 Mg\n0.000000 0.500000 0.500000 Mg\n0.500000 0.500000 0.500000 Mg\n0.257690 0.257690 0.000000 Mg\n0.742310 0.257690 0.000000 Mg\n0.257690 0.742310 0.000000 Mg\n0.742310 0.742310 0.000000 Mg\n0.251464 0.251464 0.500000 Mg\n0.748536 0.251464 0.500000 Mg\n0.251464 0.748536 0.500000 Mg\n0.748536 0.748536 0.500000 Mg\n0.255450 0.000000 0.253456 Mg\n0.744550 0.000000 0.253456 Mg\n0.253295 0.500000 0.248003 Mg\n0.746705 0.500000 0.248003 Mg\n0.255450 0.000000 0.746544 Mg\n0.744550 0.000000 0.746544 Mg\n0.253295 0.500000 0.751997 Mg\n0.746705 0.500000 0.751997 Mg\n0.000000 0.255450 0.253456 Mg\n0.500000 0.253295 0.248003 Mg\n0.000000 0.744550 0.253456 Mg\n0.500000 0.746705 0.248003 Mg\n0.000000 0.255450 0.746544 Mg\n0.500000 0.253295 0.751997 Mg\n0.000000 0.744550 0.746544 Mg\n0.500000 0.746705 0.751997 Mg\n0.500000 0.500000 0.000000 B\n0.000000 0.000000 0.000000 W\n0.000000 0.000000 0.254298 O\n0.500000 0.000000 0.252169 O\n0.000000 0.500000 0.252169 O\n0.500000 0.500000 0.264494 O\n0.000000 0.000000 0.745702 O\n0.500000 0.000000 0.747831 O\n0.000000 0.500000 0.747831 O\n0.500000 0.500000 0.735506 O\n0.249359 0.249359 0.248854 O\n0.750641 0.249359 0.248854 O\n0.249359 0.750641 0.248854 O\n0.750641 0.750641 0.248854 O\n0.249359 0.249359 0.751146 O\n0.750641 0.249359 0.751146 O\n0.249359 0.750641 0.751146 O\n0.750641 0.750641 0.751146 O\n0.252812 0.000000 0.000000 O\n0.747188 0.000000 0.000000 O\n0.234803 0.500000 0.000000 O\n0.765197 0.500000 0.000000 O\n0.248648 0.000000 0.500000 O\n0.751352 0.000000 0.500000 O\n0.247451 0.500000 0.500000 O\n0.752549 0.500000 0.500000 O\n0.000000 0.252812 0.000000 O\n0.500000 0.234803 0.000000 O\n0.000000 0.747188 0.000000 O\n0.500000 0.765197 0.000000 O\n0.000000 0.248648 0.500000 O\n0.500000 0.247451 0.500000 O\n0.000000 0.751352 0.500000 O\n0.500000 0.752549 0.500000 O\n",
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{
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{
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"structure_string": "Re12 Te16 Br12\n1.0\n9.573986 0.000000 0.000000\n1.252551 9.511307 0.000000\n1.338166 1.175010 13.555710\nRe Te Br\n12 16 12\ndirect\n0.689378 0.468273 0.944464 Re\n0.310622 0.531727 0.055536 Re\n0.439081 0.422185 0.890426 Re\n0.560919 0.577815 0.109574 Re\n0.889116 0.182237 0.500225 Re\n0.110884 0.817763 0.499775 Re\n0.480361 0.682640 0.932254 Re\n0.519639 0.317360 0.067746 Re\n0.834622 0.913905 0.506664 Re\n0.165378 0.086095 0.493336 Re\n0.989809 0.988049 0.640591 Re\n0.010191 0.011951 0.359409 Re\n0.737032 0.727647 0.988104 Te\n0.262968 0.272353 0.011896 Te\n0.272442 0.892998 0.636344 Te\n0.727558 0.107002 0.363656 Te\n0.224389 0.637610 0.875119 Te\n0.775611 0.362390 0.124881 Te\n0.952472 0.737751 0.366742 Te\n0.047528 0.262249 0.633258 Te\n0.293597 0.913945 0.353027 Te\n0.706403 0.086055 0.646973 Te\n0.606966 0.583766 0.762994 Te\n0.393034 0.416234 0.237006 Te\n0.934068 0.716394 0.652334 Te\n0.065932 0.283606 0.347666 Te\n0.652305 0.204815 0.900259 Te\n0.347695 0.795185 0.099741 Te\n0.448169 0.935666 0.848312 Br\n0.551831 0.064334 0.151688 Br\n0.637693 0.680653 0.258290 Br\n0.362307 0.319347 0.741710 Br\n0.608042 0.795701 0.516056 Br\n0.391958 0.204299 0.483944 Br\n0.945089 0.421476 0.867847 Br\n0.054911 0.578524 0.132153 Br\n0.979843 0.976968 0.830031 Br\n0.020157 0.023032 0.169969 Br\n0.741117 0.422267 0.498935 Br\n0.258883 0.577733 0.501065 Br\n",
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{
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"structure_string": "Li3 P3 O12\n1.0\n4.064216 -6.289087 0.000000\n4.064216 6.289087 0.000000\n-5.667704 0.000000 4.893628\nLi P O\n3 3 12\ndirect\n0.709399 0.569114 0.260379 Li\n0.260379 0.709399 0.569114 Li\n0.569114 0.260379 0.709399 Li\n0.974553 0.879345 0.143753 P\n0.143753 0.974553 0.879345 P\n0.879345 0.143753 0.974553 P\n0.806769 0.952844 0.035015 O\n0.035015 0.806769 0.952844 O\n0.952844 0.035015 0.806769 O\n0.772663 0.612775 0.050577 O\n0.050577 0.772663 0.612775 O\n0.612775 0.050577 0.772663 O\n0.231702 0.119610 0.438810 O\n0.438810 0.231702 0.119610 O\n0.119610 0.438810 0.231702 O\n0.193166 0.502504 0.745423 O\n0.745423 0.193166 0.502504 O\n0.502504 0.745423 0.193166 O\n",
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