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{
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{
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},
{
"id": "mp-1237804",
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"structure_string": "Si1 N2 F6\n1.0\n2.866196 4.854277 0.000000\n-2.866196 4.854277 0.000000\n0.000000 0.087738 5.034760\nSi N F\n1 2 6\ndirect\n0.000000 0.000000 0.000000 Si\n0.754498 0.754498 0.276139 N\n0.245502 0.245502 0.723861 N\n0.889580 0.889580 0.755609 F\n0.899428 0.308289 0.828972 F\n0.308289 0.899428 0.828972 F\n0.110420 0.110420 0.244391 F\n0.100572 0.691711 0.171028 F\n0.691711 0.100572 0.171028 F\n",
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{
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"structure_string": "Dy2 P2 Ru4 C2\n1.0\n1.893827 -5.529255 0.000000\n1.893827 5.529255 0.000000\n0.000000 0.000000 7.058082\nDy P Ru C\n2 2 4 2\ndirect\n0.544401 0.455599 0.250000 Dy\n0.455599 0.544401 0.750000 Dy\n0.268172 0.731828 0.250000 P\n0.731828 0.268172 0.750000 P\n0.834805 0.165195 0.053024 Ru\n0.165195 0.834805 0.946976 Ru\n0.165195 0.834805 0.553024 Ru\n0.834805 0.165195 0.446976 Ru\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
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{
"id": "mp-1247188",
"created_at": "2022-09-04T14:46:25.259613Z",
"structure_string": "Mg2 Ti3 W1 S8\n1.0\n6.319406 -0.019167 3.604261\n2.084789 5.972124 3.610706\n-0.038244 -0.019269 7.274762\nMg Ti W S\n2 3 1 8\ndirect\n0.874879 0.874746 0.874903 Mg\n0.125122 0.125267 0.125090 Mg\n0.500009 0.499997 0.000007 Ti\n0.999989 0.499988 0.500025 Ti\n0.499992 0.999988 0.500003 Ti\n0.499992 0.500028 0.499986 W\n0.740103 0.740504 0.740131 S\n0.258843 0.259216 0.722949 S\n0.259439 0.722562 0.259459 S\n0.722940 0.259199 0.258836 S\n0.740553 0.277436 0.740527 S\n0.277064 0.740788 0.741168 S\n0.259897 0.259491 0.259877 S\n0.741182 0.740785 0.277039 S\n",
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"formula_full": "Mg2 Ti3 W1 S8",
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{
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"structure_string": "Ca1 La4 Ti3 Ru1 O15\n1.0\n2.775693 -4.807641 0.000000\n2.775693 4.807641 0.000000\n0.000000 0.000000 11.117096\nCa La Ti Ru O\n1 4 3 1 15\ndirect\n0.333333 0.666667 0.001504 Ca\n0.666667 0.333333 0.424334 La\n0.000000 0.000000 0.574786 La\n0.666667 0.333333 0.780423 La\n0.000000 0.000000 0.218682 La\n0.333333 0.666667 0.319370 Ti\n0.333333 0.666667 0.680773 Ti\n0.666667 0.333333 0.103096 Ti\n0.000000 0.000000 0.899261 Ru\n0.999123 0.499561 0.203289 O\n0.500439 0.499561 0.203289 O\n0.500439 0.000877 0.203289 O\n0.664867 0.832434 0.795622 O\n0.167566 0.832434 0.795622 O\n0.167566 0.335133 0.795622 O\n0.832197 0.167803 0.001409 O\n0.832197 0.664394 0.001409 O\n0.335606 0.167803 0.001409 O\n0.987073 0.493536 0.601716 O\n0.506464 0.493536 0.601716 O\n0.506464 0.012927 0.601716 O\n0.680098 0.840049 0.397208 O\n0.159951 0.840049 0.397208 O\n0.159951 0.319902 0.397208 O\n",
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{
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{
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"structure_string": "Lu4 H32 S6 O40\n1.0\n0.000000 -6.649160 0.000000\n-6.884483 3.324580 0.000000\n4.205833 0.000000 -17.938449\nLu H S O\n4 32 6 40\ndirect\n0.146852 0.336495 0.393110 Lu\n0.810357 0.663505 0.106890 Lu\n0.853148 0.663505 0.606890 Lu\n0.189643 0.336495 0.893110 Lu\n0.494342 0.705512 0.481678 H\n0.788830 0.294488 0.018322 H\n0.505658 0.294488 0.518322 H\n0.211170 0.705512 0.981678 H\n0.279208 0.744480 0.487747 H\n0.534728 0.255520 0.012253 H\n0.720792 0.255520 0.512253 H\n0.465272 0.744480 0.987747 H\n0.200583 0.440729 0.248399 H\n0.759855 0.559271 0.251601 H\n0.799417 0.559271 0.751601 H\n0.240145 0.440729 0.748399 H\n0.370763 0.642289 0.304845 H\n0.728474 0.357711 0.195155 H\n0.629237 0.357711 0.695155 H\n0.271526 0.642289 0.804845 H\n0.692265 0.017992 0.393462 H\n0.674274 0.982008 0.106538 H\n0.307735 0.982008 0.606538 H\n0.325726 0.017992 0.893462 H\n0.836172 0.994988 0.455862 H\n0.841183 0.005012 0.044138 H\n0.163828 0.005012 0.544138 H\n0.158817 0.994988 0.955862 H\n0.052231 0.905622 0.356629 H\n0.146610 0.094378 0.143371 H\n0.947769 0.094378 0.643371 H\n0.853390 0.905622 0.856629 H\n0.310571 0.029449 0.345642 H\n0.281122 0.970551 0.154358 H\n0.689429 0.970551 0.654358 H\n0.718878 0.029449 0.845642 H\n0.247314 0.441914 0.588145 S\n0.805400 0.558086 0.911855 S\n0.752686 0.558086 0.411855 S\n0.194600 0.441914 0.088145 S\n0.691194 0.000000 0.250000 S\n0.308806 0.000000 0.750000 S\n0.224977 0.305601 0.513007 O\n0.919377 0.694399 0.986993 O\n0.775023 0.694399 0.486993 O\n0.080623 0.305601 0.013007 O\n0.481341 0.601391 0.603548 O\n0.879950 0.398609 0.896452 O\n0.518659 0.398609 0.396452 O\n0.120050 0.601391 0.103548 O\n0.093160 0.532570 0.583113 O\n0.560590 0.467430 0.916887 O\n0.906840 0.467430 0.416887 O\n0.439410 0.532570 0.083113 O\n0.191321 0.323695 0.645484 O\n0.867626 0.676305 0.854516 O\n0.808679 0.676305 0.354516 O\n0.132374 0.323695 0.145484 O\n0.904207 0.165485 0.289936 O\n0.738722 0.834515 0.210064 O\n0.095793 0.834515 0.710064 O\n0.261278 0.165485 0.789936 O\n0.527734 0.928683 0.305442 O\n0.599051 0.071317 0.194558 O\n0.472266 0.071317 0.694558 O\n0.400949 0.928683 0.805442 O\n0.351910 0.676239 0.454246 O\n0.675671 0.323761 0.045754 O\n0.648090 0.323761 0.545754 O\n0.324329 0.676239 0.954246 O\n0.263685 0.502102 0.300886 O\n0.761583 0.497898 0.199114 O\n0.736315 0.497898 0.699114 O\n0.238417 0.502102 0.800886 O\n0.810764 0.094426 0.436477 O\n0.716338 0.905574 0.063523 O\n0.189236 0.905574 0.563523 O\n0.283662 0.094426 0.936477 O\n0.179172 0.040931 0.366269 O\n0.138242 0.959069 0.133731 O\n0.820828 0.959069 0.633731 O\n0.861758 0.040931 0.866269 O\n",
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{
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