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{
"id": "jvasp-120492",
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"structure_string": "Yb4 Cd1 S7\n1.0\n6.565555 -0.050928 4.075577\n5.324056 3.842335 4.075577\n1.057169 0.337114 11.573440\nYb Cd S\n4 1 7\ndirect\n0.312006 0.312004 0.813863 Yb\n0.695771 0.695770 0.182309 Yb\n0.005702 0.005702 -0.004588 Yb\n0.915620 0.915619 0.414260 Yb\n0.075446 0.075445 0.595062 Cd\n0.302311 0.302311 0.366797 S\n0.682270 0.682269 0.641335 S\n0.666770 0.666768 0.835137 S\n0.341952 0.341952 0.157049 S\n0.895846 0.895844 0.873630 S\n0.107160 0.107160 0.126007 S\n0.499154 0.499153 0.499140 S\n",
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{
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"structure_string": "Zr10 Al2 Ni8\n1.0\n7.165628 -0.000000 0.000000\n0.000000 7.165628 0.000000\n0.000000 -0.000000 6.622876\nZr Al Ni\n10 2 8\ndirect\n0.316658 0.816658 0.250000 Zr\n0.000000 0.000000 0.000000 Zr\n0.341311 0.841311 0.750000 Zr\n0.658690 0.158690 0.750000 Zr\n0.158690 0.341311 0.250000 Zr\n0.500000 0.500000 0.500000 Zr\n0.816658 0.683342 0.750000 Zr\n0.183342 0.316658 0.750000 Zr\n0.683342 0.183342 0.250000 Zr\n0.841311 0.658690 0.250000 Zr\n0.000000 0.000000 0.500000 Al\n0.500000 0.500000 -0.000000 Al\n0.625528 0.874410 0.030525 Ni\n0.125590 0.625528 0.969476 Ni\n0.874410 0.374472 0.969476 Ni\n0.374410 0.125528 0.469475 Ni\n0.625590 0.874472 0.469475 Ni\n0.874472 0.374410 0.530525 Ni\n0.125528 0.625590 0.530525 Ni\n0.374472 0.125590 0.030525 Ni\n",
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{
"id": "jvasp-120490",
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"structure_string": "Zr1 U4 O10\n1.0\n3.770278 -0.002089 15.110826\n1.854915 3.282421 15.110826\n-0.003583 -0.002089 15.574082\nZr U O\n1 4 10\ndirect\n0.000000 0.000000 0.000000 Zr\n0.602345 0.602345 0.602346 U\n0.200805 0.200805 0.200805 U\n0.799195 0.799194 0.799196 U\n0.397655 0.397655 0.397655 U\n0.046779 0.046779 0.046779 O\n0.850313 0.850312 0.850313 O\n0.448516 0.448515 0.448516 O\n0.652543 0.652542 0.652543 O\n0.252153 0.252152 0.252153 O\n0.347458 0.347458 0.347458 O\n0.149688 0.149688 0.149688 O\n0.747848 0.747847 0.747848 O\n0.953222 0.953221 0.953222 O\n0.551485 0.551484 0.551485 O\n",
"nsites": 15,
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{
"id": "jvasp-12049",
"created_at": "2022-09-04T14:35:57.762871Z",
"updated_at": "2022-09-04T14:35:57.762892Z",
"structure_string": "Y2 Br2 O2\n1.0\n1.917620 1.107139 9.908901\n-1.917620 1.107139 9.908901\n0.000000 -2.214277 9.908901\nY Br O\n2 2 2\ndirect\n0.285312 0.285312 0.285312 Y\n0.714688 0.714688 0.714688 Y\n0.112700 0.112700 0.112700 Br\n0.887300 0.887300 0.887300 Br\n0.362146 0.362146 0.362146 O\n0.637854 0.637854 0.637854 O\n",
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},
{
"id": "jvasp-120485",
"created_at": "2022-09-04T14:38:50.959599Z",
"updated_at": "2022-09-04T14:38:50.959623Z",
"structure_string": "Ca2 Mg2 P2 O8 F2\n1.0\n5.328606 -0.026101 1.242889\n-1.883318 4.984760 1.242889\n0.011472 0.016511 6.929326\nCa Mg P O F\n2 2 2 8 2\ndirect\n0.662468 0.337532 0.750001 Ca\n0.337532 0.662468 0.250000 Ca\n-0.000000 -0.000000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.320739 0.679260 0.750001 P\n0.679261 0.320740 0.250000 P\n0.598442 0.742683 0.588233 O\n0.401558 0.257317 0.411768 O\n0.257317 0.401558 0.911768 O\n0.742683 0.598442 0.088232 O\n0.328827 0.890163 0.868828 O\n0.671173 0.109837 0.131173 O\n0.109836 0.671173 0.631174 O\n0.890164 0.328827 0.368827 O\n0.915552 0.084449 0.750000 F\n0.084448 0.915551 0.250000 F\n",
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{
"id": "jvasp-120483",
"created_at": "2022-09-04T14:38:53.019530Z",
"updated_at": "2022-09-04T14:38:53.019558Z",
"structure_string": "Er16 Mg4 Rh4\n1.0\n8.265412 -0.000000 4.772038\n2.755137 7.792705 4.772038\n-0.000000 -0.000000 9.544076\nEr Mg Rh\n16 4 4\ndirect\n0.347016 0.347017 0.347017 Er\n0.934595 0.934595 0.565406 Er\n0.565405 0.565406 0.934595 Er\n0.934595 0.565406 0.934595 Er\n0.565405 0.934595 0.565406 Er\n0.934595 0.565406 0.565406 Er\n0.812402 0.812402 0.187598 Er\n0.187598 0.187598 0.812402 Er\n0.565405 0.934595 0.934595 Er\n0.187598 0.812402 0.187598 Er\n0.187598 0.812402 0.812402 Er\n0.812402 0.187598 0.187599 Er\n0.958949 0.347017 0.347017 Er\n0.347016 0.958950 0.347017 Er\n0.347016 0.347017 0.958950 Er\n0.812402 0.187598 0.812402 Er\n0.579911 0.579912 0.579912 Mg\n0.579911 0.579912 0.260265 Mg\n0.579911 0.260265 0.579912 Mg\n0.260265 0.579912 0.579912 Mg\n0.141731 0.574808 0.141731 Rh\n0.141731 0.141731 0.141731 Rh\n0.141731 0.141731 0.574808 Rh\n0.574807 0.141731 0.141731 Rh\n",
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{
"id": "jvasp-120482",
"created_at": "2022-09-04T14:38:39.276440Z",
"updated_at": "2022-09-04T14:38:39.276468Z",
"structure_string": "Dy10 Co4 Bi2\n1.0\n6.847637 0.085853 -5.307665\n-1.593998 6.660081 -5.307665\n-0.066861 -0.085853 8.663543\nDy Co Bi\n10 4 2\ndirect\n0.000000 0.000000 0.000000 Dy\n0.500000 0.500000 -0.000001 Dy\n0.785581 0.285581 0.812336 Dy\n0.214419 0.714419 0.187664 Dy\n0.473246 0.973246 0.187664 Dy\n0.285581 0.473246 0.500000 Dy\n0.026754 0.214419 0.500000 Dy\n0.526755 0.026754 0.812335 Dy\n0.714419 0.526754 0.499999 Dy\n0.973246 0.785581 0.499999 Dy\n0.139779 0.639780 0.779558 Co\n0.860221 0.360220 0.220440 Co\n0.639779 0.860220 0.499999 Co\n0.360221 0.139779 0.500000 Co\n0.250000 0.250000 -0.000000 Bi\n0.750000 0.750000 -0.000001 Bi\n",
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},
{
"id": "jvasp-12048",
"created_at": "2022-09-04T14:37:56.728059Z",
"updated_at": "2022-09-04T14:37:56.728075Z",
"structure_string": "Bi4 Br12\n1.0\n7.164619 0.000000 -0.197611\n0.000000 12.416967 0.000000\n-2.188132 0.000000 6.479051\nBi Br\n4 12\ndirect\n0.500341 0.333647 0.000276 Bi\n-0.000341 0.833647 -0.000276 Bi\n0.000341 0.166353 0.000276 Bi\n0.499659 0.666354 -0.000276 Bi\n0.247590 0.168439 0.742949 Br\n0.254405 0.499822 0.736420 Br\n0.253406 0.331328 0.257909 Br\n0.246594 0.831328 0.742091 Br\n0.245595 -0.000178 0.263580 Br\n0.747590 0.331561 0.742949 Br\n0.252410 0.668439 0.257051 Br\n0.754405 0.000178 0.736420 Br\n0.753406 0.168672 0.257909 Br\n0.746594 0.668672 0.742092 Br\n0.745595 0.500178 0.263580 Br\n0.752410 0.831561 0.257051 Br\n",
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},
{
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"created_at": "2022-09-04T14:38:39.232183Z",
"updated_at": "2022-09-04T14:38:39.232210Z",
"structure_string": "K2 Dy6 F20\n1.0\n7.087053 -0.000000 4.091712\n2.362351 6.681738 4.091712\n-0.000000 -0.000000 8.183424\nK Dy F\n2 6 20\ndirect\n0.250000 0.250000 0.250000 K\n0.749999 0.750000 0.749999 K\n0.760159 0.239841 0.239841 Dy\n0.239840 0.760160 0.760159 Dy\n0.239840 0.760160 0.239840 Dy\n0.760159 0.239841 0.760159 Dy\n0.239841 0.239841 0.760159 Dy\n0.760159 0.760160 0.239840 Dy\n0.832539 0.167461 0.500000 F\n0.112223 0.112223 0.112223 F\n0.887776 0.887777 0.887776 F\n0.887777 0.336669 0.887776 F\n0.112223 0.663331 0.112223 F\n0.887776 0.887777 0.336668 F\n0.167460 0.832540 0.500000 F\n0.112223 0.112223 0.663331 F\n0.500000 0.500000 0.167460 F\n0.167460 0.500000 0.832539 F\n0.832539 0.500000 0.167460 F\n0.500000 0.167461 0.500000 F\n0.663331 0.112223 0.112223 F\n0.500000 0.832540 0.500000 F\n0.500000 0.167461 0.832539 F\n0.500000 0.832540 0.167460 F\n0.167460 0.500000 0.500000 F\n0.832539 0.500000 0.500000 F\n0.500000 0.500000 0.832539 F\n0.336669 0.887777 0.887776 F\n",
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{
"id": "jvasp-120477",
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"updated_at": "2022-09-04T14:38:52.790945Z",
"structure_string": "K1 Li1 Al2 Si4 O10 F2\n1.0\n5.289807 -0.005804 0.499156\n-2.718660 4.537728 0.499156\n-0.008150 -0.014365 10.344890\nK Li Al Si O F\n1 1 2 4 10 2\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.500000 Li\n0.830140 0.169861 0.500000 Al\n0.169861 0.830139 0.500000 Al\n0.585721 0.248953 0.231384 Si\n0.414279 0.751047 0.768617 Si\n0.751047 0.414279 0.768617 Si\n0.248953 0.585721 0.231384 Si\n0.546233 0.546232 0.824584 O\n0.453768 0.453768 0.175417 O\n0.171460 0.537112 0.396838 O\n0.828541 0.462889 0.603163 O\n0.462889 0.828541 0.603163 O\n0.571853 0.059600 0.831700 O\n0.940401 0.428148 0.168300 O\n0.059600 0.571852 0.831701 O\n0.428148 0.940400 0.168300 O\n0.537112 0.171460 0.396838 O\n0.878498 0.878498 0.412126 F\n0.121503 0.121502 0.587875 F\n",
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{
"id": "jvasp-120473",
"created_at": "2022-09-04T14:38:39.124830Z",
"updated_at": "2022-09-04T14:38:39.124851Z",
"structure_string": "Nd16 Mg4 Pt4\n1.0\n8.697640 -0.000000 5.021585\n2.899213 8.200213 5.021585\n-0.000000 -0.000000 10.043169\nNd Mg Pt\n16 4 4\ndirect\n0.348884 0.348884 0.348884 Nd\n0.934647 0.934647 0.565353 Nd\n0.565353 0.565353 0.934647 Nd\n0.934647 0.565353 0.934646 Nd\n0.565353 0.934647 0.565353 Nd\n0.934647 0.565353 0.565353 Nd\n0.809302 0.809302 0.190698 Nd\n0.190698 0.190698 0.809302 Nd\n0.565353 0.934647 0.934647 Nd\n0.190698 0.809302 0.190698 Nd\n0.190698 0.809302 0.809302 Nd\n0.809302 0.190698 0.190698 Nd\n0.953350 0.348884 0.348883 Nd\n0.348883 0.953349 0.348883 Nd\n0.348884 0.348884 0.953350 Nd\n0.809302 0.190698 0.809301 Nd\n0.579419 0.579419 0.579419 Mg\n0.579419 0.579419 0.261744 Mg\n0.579419 0.261744 0.579419 Mg\n0.261744 0.579419 0.579419 Mg\n0.142908 0.571275 0.142908 Pt\n0.142909 0.142908 0.142908 Pt\n0.142909 0.142908 0.571275 Pt\n0.571275 0.142908 0.142908 Pt\n",
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{
"id": "jvasp-120472",
"created_at": "2022-09-04T14:38:50.898527Z",
"updated_at": "2022-09-04T14:38:50.898545Z",
"structure_string": "Nd2 Al20 Ru4\n1.0\n6.876896 0.011389 0.000000\n-0.814292 6.828525 0.000000\n0.000000 0.000000 9.216241\nNd Al Ru\n2 20 4\ndirect\n0.874698 0.125302 0.750000 Nd\n0.125303 0.874698 0.250000 Nd\n0.481875 0.219004 0.250000 Al\n0.518126 0.780997 0.750000 Al\n0.780997 0.518126 0.250000 Al\n0.219004 0.481875 0.750000 Al\n0.586743 0.856298 0.250000 Al\n0.413257 0.143703 0.750000 Al\n0.143703 0.413257 0.250000 Al\n0.856298 0.586743 0.750000 Al\n0.841072 0.158929 0.398222 Al\n0.158929 0.841072 0.601778 Al\n0.841072 0.158929 0.101778 Al\n0.226408 0.226408 -0.000000 Al\n0.773593 0.773593 -0.000000 Al\n0.773593 0.773593 0.500000 Al\n0.226408 0.226408 0.500000 Al\n0.623251 0.376749 0.952585 Al\n0.376749 0.623252 0.047415 Al\n0.376749 0.623252 0.452585 Al\n0.623251 0.376749 0.547415 Al\n0.158929 0.841072 0.898222 Al\n0.500000 0.000000 -0.000000 Ru\n0.000000 0.500000 0.500000 Ru\n0.000000 0.500000 -0.000000 Ru\n0.500000 0.000000 0.500000 Ru\n",
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}
]
}