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{
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"structure_string": "Al16 Ag8 Cl40 O8\n1.0\n11.544827 0.000000 0.000000\n0.000000 12.588428 0.000000\n0.000000 0.000000 13.319284\nAl Ag Cl O\n16 8 40 8\ndirect\n0.794270 0.540973 0.864534 Al\n0.514678 0.895198 0.997549 Al\n0.014678 0.604802 0.002451 Al\n0.705730 0.040973 0.864534 Al\n0.985322 0.395198 0.997549 Al\n0.205730 0.459027 0.135466 Al\n0.514678 0.604802 0.497549 Al\n0.985322 0.104802 0.497549 Al\n0.485322 0.395198 0.502451 Al\n0.294270 0.540973 0.635466 Al\n0.205730 0.040973 0.635466 Al\n0.705730 0.459027 0.364534 Al\n0.014678 0.895198 0.502451 Al\n0.294270 0.959027 0.135466 Al\n0.485322 0.104802 0.002451 Al\n0.794270 0.959027 0.364534 Al\n0.017932 0.348760 0.691700 Ag\n0.982068 0.651240 0.308300 Ag\n0.517932 0.348760 0.808300 Ag\n0.517932 0.151240 0.308300 Ag\n0.482068 0.651240 0.191700 Ag\n0.982068 0.848760 0.808300 Ag\n0.017932 0.151240 0.191700 Ag\n0.482068 0.848760 0.691700 Ag\n0.212353 0.288485 0.143181 Cl\n0.632508 0.016661 0.425749 Cl\n0.613850 0.689962 0.606510 Cl\n0.287647 0.711515 0.643181 Cl\n0.113850 0.689962 0.893490 Cl\n0.132508 0.016661 0.074251 Cl\n0.886150 0.189962 0.606510 Cl\n0.712353 0.288485 0.356819 Cl\n0.712353 0.211515 0.856819 Cl\n0.787647 0.788485 0.356819 Cl\n0.675399 0.970472 0.719365 Cl\n0.287647 0.788485 0.143181 Cl\n0.113850 0.810038 0.393490 Cl\n0.445812 0.793191 0.883923 Cl\n0.886150 0.310038 0.106510 Cl\n0.367492 0.983339 0.574251 Cl\n0.367492 0.516661 0.074251 Cl\n0.824601 0.470472 0.719365 Cl\n0.787647 0.711515 0.856819 Cl\n0.054188 0.293191 0.883923 Cl\n0.554188 0.206809 0.116077 Cl\n0.945812 0.793191 0.616077 Cl\n0.212353 0.211515 0.643181 Cl\n0.613850 0.810038 0.106510 Cl\n0.445812 0.706809 0.383923 Cl\n0.945812 0.706809 0.116077 Cl\n0.132508 0.483339 0.574251 Cl\n0.324601 0.470472 0.780635 Cl\n0.175399 0.529528 0.280635 Cl\n0.386150 0.310038 0.393490 Cl\n0.554188 0.293191 0.616077 Cl\n0.386150 0.189962 0.893490 Cl\n0.867492 0.983339 0.925749 Cl\n0.324601 0.029528 0.280635 Cl\n0.054188 0.206809 0.383923 Cl\n0.175399 0.970472 0.780635 Cl\n0.632508 0.483339 0.925749 Cl\n0.824601 0.029528 0.219365 Cl\n0.867492 0.516661 0.425749 Cl\n0.675399 0.529528 0.219365 Cl\n0.412000 0.988643 0.052668 O\n0.912000 0.988643 0.447332 O\n0.912000 0.511357 0.947332 O\n0.088000 0.488643 0.052668 O\n0.588000 0.011357 0.947332 O\n0.412000 0.511357 0.552668 O\n0.088000 0.011357 0.552668 O\n0.588000 0.488643 0.447332 O\n",
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"formula_full": "Al16 Ag8 Cl40 O8",
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{
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"structure_string": "Na4 Al4 P8 O28\n1.0\n7.814597 0.000000 0.000000\n0.000000 7.283697 0.000000\n0.000000 3.473368 8.747193\nNa Al P O\n4 4 8 28\ndirect\n0.474103 0.709568 0.297011 Na\n0.974103 0.290432 0.202989 Na\n0.525897 0.290432 0.702989 Na\n0.025897 0.709568 0.797011 Na\n0.989648 0.260052 0.752707 Al\n0.489648 0.739948 0.747293 Al\n0.010352 0.739948 0.247293 Al\n0.510352 0.260052 0.252707 Al\n0.755525 0.071442 0.049771 P\n0.255525 0.928558 0.450229 P\n0.244475 0.928558 0.950229 P\n0.744475 0.071442 0.549771 P\n0.707072 0.669790 0.047367 P\n0.207072 0.330210 0.452633 P\n0.292928 0.330210 0.952633 P\n0.792928 0.669790 0.547367 P\n0.690865 0.685442 0.881840 O\n0.190865 0.314558 0.618160 O\n0.309135 0.314558 0.118160 O\n0.809135 0.685442 0.381840 O\n0.793233 0.190678 0.882024 O\n0.293233 0.809322 0.617976 O\n0.206767 0.809322 0.117976 O\n0.706767 0.190678 0.382024 O\n0.894929 0.642552 0.100666 O\n0.394929 0.357448 0.399334 O\n0.105071 0.357448 0.899334 O\n0.605071 0.642552 0.600666 O\n0.917343 0.998097 0.146680 O\n0.417343 0.001903 0.353320 O\n0.082657 0.001903 0.853320 O\n0.582657 0.998097 0.646680 O\n0.854343 0.877029 0.560813 O\n0.354343 0.122971 0.939187 O\n0.145657 0.122971 0.439187 O\n0.645657 0.877029 0.060813 O\n0.914100 0.523137 0.658960 O\n0.414100 0.476863 0.841040 O\n0.085900 0.476863 0.341040 O\n0.585900 0.523137 0.158960 O\n0.861889 0.185508 0.614625 O\n0.361889 0.814492 0.885375 O\n0.138111 0.814492 0.385375 O\n0.638111 0.185508 0.114625 O\n",
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"formula_full": "Na4 Al4 P8 O28",
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{
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"created_at": "2022-09-04T14:39:22.174723Z",
"structure_string": "Ba4 Ca4 Eu4 W4 O24\n1.0\n8.555095 0.000000 0.000000\n0.000000 8.510930 0.000000\n0.000000 0.000000 8.530259\nBa Ca Eu W O\n4 4 4 4 24\ndirect\n-0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 Ba\n0.500000 0.500000 0.000000 Ba\n-0.000000 0.000000 0.500000 Ba\n-0.000000 0.500000 0.500000 Ca\n0.500000 0.000000 0.500000 Ca\n0.500000 0.000000 0.000000 Ca\n-0.000000 0.500000 0.000000 Ca\n0.750000 0.750000 0.750000 Eu\n0.250000 0.250000 0.750000 Eu\n0.250000 0.750000 0.250000 Eu\n0.750000 0.250000 0.250000 Eu\n0.250000 0.250000 0.250000 W\n0.750000 0.750000 0.250000 W\n0.750000 0.250000 0.750000 W\n0.250000 0.750000 0.750000 W\n0.025930 0.207137 0.281158 O\n0.974070 0.792863 0.281158 O\n0.974070 0.207137 0.718842 O\n0.025930 0.792863 0.718842 O\n0.291551 0.029764 0.192921 O\n0.291551 0.970236 0.807079 O\n0.708449 0.970236 0.192921 O\n0.708449 0.029764 0.807079 O\n0.202895 0.300024 0.028630 O\n0.797105 0.300024 0.971370 O\n0.202895 0.699976 0.971370 O\n0.797105 0.699976 0.028630 O\n0.474070 0.292863 0.218842 O\n0.525930 0.707137 0.218842 O\n0.525930 0.292863 0.781158 O\n0.474070 0.707137 0.781158 O\n0.208449 0.470236 0.307079 O\n0.208449 0.529764 0.692921 O\n0.791551 0.529764 0.307079 O\n0.791551 0.470236 0.692921 O\n0.297105 0.199976 0.471370 O\n0.702895 0.199976 0.528630 O\n0.297105 0.800024 0.528630 O\n0.702895 0.800024 0.471370 O\n",
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"formula_full": "Ba4 Ca4 Eu4 W4 O24",
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{
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"structure_string": "K1 Cd6 H4 C12 Cl1 O26\n1.0\n9.360865 0.000000 0.000000\n4.610028 8.208270 0.000000\n4.590995 2.748818 8.895033\nK Cd H C Cl O\n1 6 4 12 1 26\ndirect\n0.993939 0.001552 0.000300 K\n0.276389 0.787144 0.271408 Cd\n0.800680 0.631022 0.270093 Cd\n0.642219 0.293475 0.275171 Cd\n0.349292 0.716833 0.731363 Cd\n0.213153 0.345916 0.720972 Cd\n0.696908 0.208242 0.727934 Cd\n0.858837 0.932902 0.302031 H\n0.945441 0.864552 0.299247 H\n0.142076 0.104934 0.701556 H\n0.061577 0.109036 0.699153 H\n0.572735 0.950405 0.045838 C\n0.424737 0.572653 0.040509 C\n0.559497 0.955749 0.435396 C\n0.977227 0.423546 0.025736 C\n0.036859 0.954749 0.570094 C\n0.049696 0.555735 0.432493 C\n0.942519 0.447886 0.563127 C\n0.955667 0.053195 0.437165 C\n0.045860 0.572962 0.953408 C\n0.444959 0.044198 0.561866 C\n0.564327 0.429634 0.964036 C\n0.428308 0.022734 0.971192 C\n0.455223 0.564036 0.498129 Cl\n0.455789 0.402430 0.638141 O\n0.304694 0.971461 0.038850 O\n0.987118 0.678943 0.022755 O\n0.052286 0.036629 0.309062 O\n0.558940 0.834779 0.172793 O\n0.430985 0.554749 0.168173 O\n0.035581 0.610198 0.301854 O\n0.195010 0.862169 0.539367 O\n0.672708 0.309533 0.030288 O\n0.865613 0.420431 0.153330 O\n0.589309 0.798291 0.471493 O\n0.390448 0.954237 0.692989 O\n0.144240 0.587278 0.466898 O\n0.845660 0.418116 0.530312 O\n0.615989 0.046725 0.305531 O\n0.409764 0.203431 0.525258 O\n0.160944 0.573184 0.826358 O\n0.317384 0.694379 0.974620 O\n0.796846 0.143768 0.467600 O\n0.959179 0.397908 0.691991 O\n0.556566 0.445887 0.837739 O\n0.445335 0.131951 0.842289 O\n0.943885 0.974032 0.698418 O\n0.034033 0.316634 0.957238 O\n0.691532 0.007723 0.976973 O\n0.603038 0.507043 0.361462 O\n",
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{
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"structure_string": "Sr14 Cu4 Hg2 Bi2 Sb2 O30\n1.0\n7.739152 0.000000 0.000000\n0.000000 9.022166 0.000000\n0.000000 0.000000 11.788465\nSr Cu Hg Bi Sb O\n14 4 2 2 2 30\ndirect\n0.500000 0.289893 0.000000 Sr\n0.000000 0.289893 0.000000 Sr\n0.500000 0.710107 0.000000 Sr\n0.000000 0.710107 0.000000 Sr\n0.492917 0.292746 0.656944 Sr\n0.507083 0.292746 0.343056 Sr\n0.007083 0.292746 0.656944 Sr\n0.992917 0.292746 0.343056 Sr\n0.507083 0.707254 0.343056 Sr\n0.492917 0.707254 0.656944 Sr\n0.992917 0.707254 0.343056 Sr\n0.007083 0.707254 0.656944 Sr\n0.750000 0.000000 0.840835 Sr\n0.250000 0.000000 0.159165 Sr\n0.250000 0.500000 0.826359 Cu\n0.750000 0.500000 0.173641 Cu\n0.750000 0.500000 0.499597 Cu\n0.250000 0.500000 0.500403 Cu\n0.750000 0.000000 0.502009 Hg\n0.250000 0.000000 0.497991 Hg\n0.250000 0.000000 0.820177 Bi\n0.750000 0.000000 0.179823 Bi\n0.750000 0.500000 0.832483 Sb\n0.250000 0.500000 0.167517 Sb\n0.750000 0.273807 0.836278 O\n0.250000 0.273807 0.163722 O\n0.250000 0.726193 0.163722 O\n0.750000 0.726193 0.836278 O\n0.750000 0.500000 0.001049 O\n0.250000 0.500000 0.998951 O\n0.500000 0.000000 0.000000 O\n0.000000 0.000000 0.000000 O\n0.750000 0.227014 0.504007 O\n0.250000 0.227014 0.495993 O\n0.250000 0.772986 0.495993 O\n0.750000 0.772986 0.504007 O\n0.750000 0.500000 0.665252 O\n0.250000 0.500000 0.334748 O\n0.494533 0.500000 0.830796 O\n0.505467 0.500000 0.169204 O\n0.005467 0.500000 0.830796 O\n0.994533 0.500000 0.169204 O\n0.250000 0.500000 0.660962 O\n0.750000 0.500000 0.339038 O\n0.471464 0.000000 0.710739 O\n0.528536 0.000000 0.289261 O\n0.028536 0.000000 0.710739 O\n0.971464 0.000000 0.289261 O\n0.250000 0.237163 0.834123 O\n0.750000 0.237163 0.165877 O\n0.750000 0.762837 0.165877 O\n0.250000 0.762837 0.834123 O\n0.500000 0.500000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
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{
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"structure_string": "Li2 Cr2 P10 O30\n1.0\n9.699341 0.000000 0.000000\n0.000000 5.262690 0.000000\n0.000000 4.336197 12.390209\nLi Cr P O\n2 2 10 30\ndirect\n0.607546 0.050708 0.567322 Li\n0.392454 0.050708 0.067322 Li\n0.003463 0.011271 0.495613 Cr\n0.996537 0.011271 0.995613 Cr\n0.824071 0.595516 0.411574 P\n0.177977 0.428391 0.580743 P\n0.527828 0.466752 0.143480 P\n0.822023 0.428391 0.080743 P\n0.472172 0.466752 0.643480 P\n0.983204 0.011566 0.245767 P\n0.530389 0.525114 0.359901 P\n0.469611 0.525114 0.859901 P\n0.175929 0.595516 0.911574 P\n0.016796 0.011566 0.745767 P\n0.593422 0.489061 0.252748 O\n0.940793 0.972640 0.651499 O\n0.881129 0.755171 0.292205 O\n0.869302 0.299567 0.999742 O\n0.847733 0.724840 0.056743 O\n0.939739 0.048003 0.839706 O\n0.060261 0.048003 0.339706 O\n0.848148 0.296282 0.438125 O\n0.410848 0.715699 0.339790 O\n0.118421 0.266207 0.700080 O\n0.582472 0.255943 0.662515 O\n0.337019 0.358565 0.599463 O\n0.059207 0.972640 0.151499 O\n0.510326 0.743046 0.572781 O\n0.663897 0.660052 0.396056 O\n0.336103 0.660052 0.896056 O\n0.151852 0.296282 0.938125 O\n0.881579 0.266207 0.200080 O\n0.152267 0.724840 0.556743 O\n0.118871 0.755171 0.792205 O\n0.494873 0.250354 0.938948 O\n0.662981 0.358565 0.099463 O\n0.871686 0.724986 0.492491 O\n0.130698 0.299567 0.499742 O\n0.489674 0.743046 0.072781 O\n0.406578 0.489061 0.752748 O\n0.417528 0.255943 0.162515 O\n0.505127 0.250354 0.438948 O\n0.589152 0.715699 0.839790 O\n0.128314 0.724986 0.992491 O\n",
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{
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