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{
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{
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{
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],
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{
"id": "mp-1199663",
"created_at": "2022-09-04T14:47:23.437162Z",
"structure_string": "Cr8 Co4 H80 N24 Cl4 O32\n1.0\n9.508567 0.000000 0.000000\n0.000000 10.209025 0.000000\n0.000000 6.198049 15.038582\nCr Co H N Cl O\n8 4 80 24 4 32\ndirect\n0.929194 0.916478 0.244091 Cr\n0.429194 0.083522 0.255909 Cr\n0.070806 0.083522 0.755909 Cr\n0.570806 0.916478 0.744091 Cr\n0.746474 0.761668 0.417448 Cr\n0.246474 0.238332 0.082552 Cr\n0.253526 0.238332 0.582552 Cr\n0.753526 0.761668 0.917448 Cr\n0.251463 0.711093 0.060415 Co\n0.751463 0.288907 0.439585 Co\n0.748537 0.288907 0.939585 Co\n0.248537 0.711093 0.560415 Co\n0.501215 0.600603 0.114808 H\n0.001215 0.399397 0.385192 H\n0.498785 0.399397 0.885192 H\n0.998785 0.600603 0.614808 H\n0.401957 0.488205 0.090373 H\n0.901957 0.511795 0.409627 H\n0.598043 0.511795 0.909627 H\n0.098043 0.488205 0.590373 H\n0.375449 0.512289 0.184817 H\n0.875449 0.487711 0.315183 H\n0.624551 0.487711 0.815183 H\n0.124551 0.512289 0.684817 H\n0.258199 0.547741 0.972643 H\n0.758199 0.452259 0.527357 H\n0.741801 0.452259 0.027357 H\n0.241801 0.547741 0.472643 H\n0.315423 0.706788 0.907821 H\n0.815423 0.293212 0.592179 H\n0.684577 0.293212 0.092179 H\n0.184577 0.706788 0.407821 H\n0.145586 0.678731 0.925350 H\n0.645586 0.321269 0.574650 H\n0.854414 0.321269 0.074650 H\n0.354414 0.678731 0.425350 H\n0.140320 0.517473 0.188801 H\n0.640320 0.482527 0.311199 H\n0.859680 0.482527 0.811199 H\n0.359680 0.517473 0.688801 H\n0.098846 0.490751 0.096879 H\n0.598846 0.509249 0.403121 H\n0.901154 0.509249 0.903121 H\n0.401154 0.490751 0.596879 H\n0.008722 0.606774 0.124500 H\n0.508722 0.393226 0.375500 H\n0.991278 0.393226 0.875500 H\n0.491278 0.606774 0.624500 H\n0.353781 0.814547 0.168687 H\n0.853781 0.185453 0.331313 H\n0.646219 0.185453 0.831313 H\n0.146219 0.814547 0.668687 H\n0.251531 0.678133 0.222881 H\n0.751531 0.321867 0.277119 H\n0.748469 0.321867 0.777119 H\n0.248469 0.678133 0.722881 H\n0.179969 0.834611 0.164537 H\n0.679969 0.165389 0.335463 H\n0.820031 0.165389 0.835463 H\n0.320031 0.834611 0.664537 H\n0.033898 0.855124 0.057594 H\n0.533898 0.144876 0.442406 H\n0.966102 0.144876 0.942406 H\n0.466102 0.855124 0.557594 H\n0.037960 0.827151 0.963427 H\n0.537960 0.172849 0.536573 H\n0.962040 0.172849 0.036573 H\n0.462040 0.827151 0.463427 H\n0.134518 0.954054 0.974384 H\n0.634518 0.045946 0.525616 H\n0.865482 0.045946 0.025616 H\n0.365482 0.954054 0.474384 H\n0.450012 0.825899 0.954769 H\n0.950012 0.174101 0.545231 H\n0.549988 0.174101 0.045231 H\n0.049988 0.825899 0.454769 H\n0.470035 0.851836 0.049235 H\n0.970035 0.148164 0.450765 H\n0.529965 0.148164 0.950765 H\n0.029965 0.851836 0.549235 H\n0.360732 0.952731 0.970444 H\n0.860732 0.047269 0.529556 H\n0.639268 0.047269 0.029556 H\n0.139268 0.952731 0.470444 H\n0.657438 0.757207 0.156606 H\n0.157438 0.242793 0.343394 H\n0.342562 0.242793 0.843394 H\n0.842562 0.757207 0.656606 H\n0.594796 0.859462 0.198363 H\n0.094796 0.140538 0.301637 H\n0.405204 0.140538 0.801637 H\n0.905204 0.859462 0.698363 H\n0.399407 0.563897 0.118090 N\n0.899407 0.436103 0.381910 N\n0.600593 0.436103 0.881910 N\n0.100593 0.563897 0.618090 N\n0.242062 0.654540 0.955815 N\n0.742062 0.345460 0.544185 N\n0.757938 0.345460 0.044185 N\n0.257938 0.654540 0.455815 N\n0.108177 0.567646 0.123264 N\n0.608177 0.432354 0.376736 N\n0.891823 0.432354 0.876736 N\n0.391823 0.567646 0.623264 N\n0.260065 0.766940 0.164774 N\n0.760065 0.233060 0.335226 N\n0.739935 0.233060 0.835226 N\n0.239935 0.766940 0.664774 N\n0.099292 0.852123 0.007522 N\n0.599292 0.147877 0.492478 N\n0.900708 0.147877 0.992478 N\n0.400708 0.852123 0.507522 N\n0.397712 0.851228 0.001959 N\n0.897712 0.148772 0.498041 N\n0.602288 0.148772 0.998041 N\n0.102288 0.851228 0.501959 N\n0.257654 0.444675 0.318126 Cl\n0.757654 0.555325 0.181874 Cl\n0.742346 0.555325 0.681874 Cl\n0.242346 0.444675 0.818126 Cl\n0.772029 0.827330 0.299799 O\n0.272029 0.172670 0.200201 O\n0.227971 0.172670 0.700201 O\n0.727971 0.827330 0.799799 O\n0.956122 0.874128 0.157497 O\n0.456122 0.125872 0.342503 O\n0.043878 0.125872 0.842503 O\n0.543878 0.874128 0.657497 O\n0.060450 0.862588 0.313845 O\n0.560450 0.137412 0.186155 O\n0.939550 0.137412 0.686155 O\n0.439550 0.862588 0.813845 O\n0.909324 0.086939 0.212630 O\n0.409324 0.913061 0.287370 O\n0.090676 0.913061 0.787370 O\n0.590676 0.086939 0.712630 O\n0.876234 0.651851 0.464021 O\n0.376234 0.348149 0.035979 O\n0.123766 0.348149 0.535979 O\n0.623766 0.651851 0.964021 O\n0.596267 0.675420 0.439127 O\n0.096267 0.324580 0.060873 O\n0.403733 0.324580 0.560873 O\n0.903733 0.675420 0.939127 O\n0.745340 0.893031 0.450910 O\n0.245340 0.106969 0.049090 O\n0.254660 0.106969 0.549090 O\n0.754660 0.893031 0.950910 O\n0.590634 0.836879 0.144942 O\n0.090634 0.163121 0.355058 O\n0.409366 0.163121 0.855058 O\n0.909366 0.836879 0.644942 O\n",
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"formula_full": "Cr8 Co4 H80 N24 Cl4 O32",
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{
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"created_at": "2022-09-04T14:39:46.885181Z",
"structure_string": "Li6 Mo4 P6 O24\n1.0\n2.739979 4.196770 0.000000\n-2.739979 4.196770 0.000000\n0.000000 0.046556 19.362749\nLi Mo P O\n6 4 6 24\ndirect\n0.999845 0.999845 0.835935 Li\n0.668109 0.668109 0.910829 Li\n0.665811 0.665811 0.238941 Li\n0.334189 0.334189 0.761059 Li\n0.331891 0.331891 0.089171 Li\n0.000155 0.000155 0.164065 Li\n0.000000 0.000000 0.500000 Mo\n0.000000 0.000000 0.000000 Mo\n0.996538 0.996538 0.328898 Mo\n0.003462 0.003462 0.671102 Mo\n0.346868 0.346868 0.247882 P\n0.352053 0.352053 0.919796 P\n0.352161 0.352161 0.587699 P\n0.647947 0.647947 0.080204 P\n0.647839 0.647839 0.412301 P\n0.653132 0.653132 0.752118 P\n0.308712 0.763089 0.750243 O\n0.698154 0.227621 0.585046 O\n0.694801 0.240990 0.920150 O\n0.759010 0.305199 0.079850 O\n0.301846 0.772379 0.414954 O\n0.227621 0.698154 0.585046 O\n0.240990 0.694801 0.920150 O\n0.305199 0.759010 0.079850 O\n0.772379 0.301846 0.414954 O\n0.236911 0.691288 0.249757 O\n0.755943 0.755943 0.686527 O\n0.754422 0.754422 0.475466 O\n0.745936 0.745936 0.011932 O\n0.752847 0.752847 0.143642 O\n0.691288 0.236911 0.249757 O\n0.738012 0.738012 0.342962 O\n0.261988 0.261988 0.657038 O\n0.248534 0.248534 0.182391 O\n0.247153 0.247153 0.856358 O\n0.254064 0.254064 0.988068 O\n0.245578 0.245578 0.524534 O\n0.244057 0.244057 0.313473 O\n0.763089 0.308712 0.750243 O\n0.751466 0.751466 0.817609 O\n",
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{
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{
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"structure_string": "Ca1 Tb4 Al2 Fe2 O12\n1.0\n6.138348 -0.108854 0.207202\n-0.106758 6.253619 0.021289\n0.314234 0.024706 7.074131\nCa Tb Al Fe O\n1 4 2 2 12\ndirect\n0.359147 0.304263 0.195744 Ca\n0.688707 0.636887 0.297231 Tb\n0.853682 0.121893 0.212073 Tb\n0.542253 0.406831 0.740295 Tb\n0.935749 0.943522 0.739320 Tb\n0.112001 0.475012 0.525162 Al\n0.394477 0.909048 0.982676 Al\n0.005691 0.535741 0.971939 Fe\n0.458450 0.990644 0.515735 Fe\n0.482044 0.955436 0.215695 O\n0.031440 0.457400 0.286167 O\n0.570078 0.025989 0.784841 O\n0.902109 0.563490 0.691856 O\n0.842794 0.812276 0.035524 O\n0.618816 0.303636 0.434791 O\n0.179643 0.203930 0.579045 O\n0.329172 0.629013 0.950657 O\n0.177321 0.103744 0.987930 O\n0.357792 0.641586 0.528396 O\n0.819935 0.895794 0.454641 O\n0.701200 0.369581 0.030998 O\n",
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{
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