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"structure_string": "Li4 Be4 H32 C4 N4 O4 F16\n1.0\n4.745512 0.000000 0.000000\n0.000000 9.819957 -1.644965\n0.000000 0.181006 12.227003\nLi Be H C N O F\n4 4 32 4 4 4 16\ndirect\n0.674482 0.149699 0.494784 Li\n0.325517 0.850302 0.505217 Li\n0.174482 0.350302 0.505216 Li\n0.825517 0.649699 0.494784 Li\n0.826527 0.883394 0.369367 Be\n0.326527 0.616607 0.630633 Be\n0.173473 0.116607 0.630633 Be\n0.673472 0.383394 0.369367 Be\n0.916445 0.329392 0.731460 H\n0.413355 0.259391 0.988021 H\n0.242856 0.573498 0.085649 H\n0.535407 0.539397 0.852218 H\n0.762549 0.748084 0.123182 H\n0.938992 0.824171 0.731625 H\n0.237450 0.251917 0.876818 H\n0.964592 0.039397 0.852218 H\n0.586645 0.740610 0.011979 H\n0.088797 0.446203 0.155802 H\n0.913355 0.240610 0.011979 H\n0.416446 0.170608 0.268540 H\n0.911203 0.553797 0.844199 H\n0.767086 0.943863 0.673748 H\n0.737450 0.248083 0.123182 H\n0.267086 0.556137 0.326253 H\n0.438992 0.675830 0.268375 H\n0.257143 0.073497 0.085649 H\n0.035407 0.960604 0.147782 H\n0.742856 0.926503 0.914351 H\n0.583554 0.829392 0.731460 H\n0.411203 0.946204 0.155802 H\n0.232914 0.056137 0.326253 H\n0.061008 0.175830 0.268375 H\n0.588797 0.053797 0.844198 H\n0.083554 0.670608 0.268540 H\n0.561008 0.324171 0.731625 H\n0.732914 0.443863 0.673747 H\n0.262550 0.751917 0.876818 H\n0.757143 0.426503 0.914351 H\n0.086645 0.759391 0.988021 H\n0.464593 0.460603 0.147782 H\n0.234544 0.016350 0.154687 C\n0.765455 0.983650 0.845314 C\n0.265456 0.516351 0.154687 C\n0.734544 0.483650 0.845314 C\n0.764364 0.887900 0.738589 N\n0.235636 0.112101 0.261411 N\n0.735635 0.387899 0.738589 N\n0.264364 0.612101 0.261411 N\n0.274228 0.780250 0.957422 O\n0.725771 0.219750 0.042578 O\n0.225771 0.280250 0.957422 O\n0.774228 0.719751 0.042578 O\n0.208385 0.675724 0.526647 F\n0.214213 0.472019 0.632977 F\n0.708385 0.824276 0.473354 F\n0.751530 0.280297 0.262957 F\n0.844616 0.111862 0.621616 F\n0.655383 0.611862 0.621617 F\n0.714213 0.027982 0.367023 F\n0.344617 0.388139 0.378384 F\n0.791614 0.324276 0.473354 F\n0.248470 0.719704 0.737043 F\n0.291615 0.175724 0.526646 F\n0.748470 0.780297 0.262957 F\n0.251530 0.219703 0.737043 F\n0.285787 0.972019 0.632977 F\n0.155383 0.888139 0.378384 F\n0.785786 0.527982 0.367024 F\n",
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"created_at": "2022-09-04T14:35:46.380882Z",
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"structure_string": "Sn2 Se4 O12\n1.0\n4.814834 -0.058101 0.000000\n-2.387671 6.565158 0.000000\n0.000000 0.000000 8.623289\nSn Se O\n2 4 12\ndirect\n0.000000 0.500000 0.500000 Sn\n0.500000 0.000000 0.000000 Sn\n0.808285 0.681554 0.848996 Se\n0.308285 0.181553 0.651004 Se\n0.191715 0.318447 0.151004 Se\n0.691715 0.818447 0.348996 Se\n0.357120 0.764299 0.442966 O\n0.579691 0.800413 0.156333 O\n0.420309 0.199588 0.843668 O\n0.762635 0.918562 0.841577 O\n0.642880 0.235701 0.557034 O\n0.237365 0.081439 0.158423 O\n0.262635 0.418561 0.658423 O\n0.920309 0.699588 0.656333 O\n0.079691 0.300412 0.343667 O\n0.142880 0.735702 0.942967 O\n0.857119 0.264299 0.057034 O\n0.737364 0.581439 0.341577 O\n",
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{
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"structure_string": "Bi4 Se4\n1.0\n-0.578688 0.000000 4.879719\n5.751474 0.000000 -1.036716\n0.000000 8.934591 0.000000\nBi Se\n4 4\ndirect\n0.257442 0.845314 0.606964 Bi\n0.757443 0.345315 0.893036 Bi\n0.742557 0.154684 0.393036 Bi\n0.242556 0.654685 0.106964 Bi\n0.153097 0.312173 0.638553 Se\n0.653096 0.812172 0.861446 Se\n0.846903 0.687826 0.361447 Se\n0.346903 0.187827 0.138553 Se\n",
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{
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"structure_string": "Li6 V2 F12\n1.0\n0.000000 5.056707 0.026572\n5.138301 0.000000 0.000000\n0.000000 -5.046197 -7.689993\nLi V F\n6 2 12\ndirect\n0.500000 0.000000 0.500000 Li\n0.267474 0.532114 0.262757 Li\n0.732527 0.032114 0.237243 Li\n0.500000 0.500000 0.000000 Li\n0.267473 0.967886 0.762757 Li\n0.732526 0.467886 0.737243 Li\n0.000000 0.000000 0.000000 V\n-0.000000 0.500000 0.500000 V\n0.269077 0.323811 0.440423 F\n0.730923 0.823810 0.059577 F\n0.076927 0.817601 0.414886 F\n0.368791 0.594675 0.734621 F\n0.631209 0.405324 0.265379 F\n0.076927 0.682399 0.914886 F\n0.269077 0.176189 0.940423 F\n0.730923 0.676189 0.559577 F\n0.923073 0.317601 0.085114 F\n0.368791 0.905324 0.234621 F\n0.923073 0.182399 0.585113 F\n0.631208 0.094675 0.765379 F\n",
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{
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"structure_string": "Li4 V4 F20\n1.0\n0.000000 5.211461 -0.117201\n10.097070 0.000000 0.000000\n0.000000 -1.744013 -6.040381\nLi V F\n4 4 20\ndirect\n0.028665 0.735532 0.886269 Li\n0.028665 0.764468 0.386269 Li\n0.971335 0.235532 0.613731 Li\n0.971335 0.264468 0.113731 Li\n0.439301 0.959999 0.738733 V\n0.560700 0.459999 0.761266 V\n0.439300 0.540001 0.238733 V\n0.560700 0.040001 0.261266 V\n0.363962 0.919453 0.031392 F\n0.636038 0.419453 0.468608 F\n0.733005 0.850522 0.807604 F\n0.733005 0.649478 0.307604 F\n0.837704 0.578522 0.812087 F\n0.622052 0.415946 0.085753 F\n0.622052 0.084054 0.585753 F\n0.794673 0.316451 0.814708 F\n0.377948 0.915946 0.414247 F\n0.205328 0.683549 0.185292 F\n0.363962 0.580547 0.531392 F\n0.266995 0.149478 0.192395 F\n0.794672 0.183549 0.314708 F\n0.162296 0.421478 0.187912 F\n0.377948 0.584054 0.914247 F\n0.266996 0.350522 0.692395 F\n0.205328 0.816451 0.685292 F\n0.162297 0.078522 0.687912 F\n0.636039 0.080547 0.968608 F\n0.837704 0.921478 0.312087 F\n",
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{
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"structure_string": "Na12 Co4 O12\n1.0\n0.000000 6.223950 -0.018615\n9.776590 0.000000 0.000000\n0.000000 -2.914727 -6.152921\nNa Co O\n12 4 12\ndirect\n0.068033 0.227473 0.009936 Na\n0.568033 0.272527 0.009936 Na\n0.255045 0.056040 0.754747 Na\n0.169137 0.779072 0.540567 Na\n0.755045 0.443960 0.754748 Na\n0.330863 0.279072 0.459433 Na\n0.669137 0.720928 0.540567 Na\n0.244955 0.556040 0.245253 Na\n0.830863 0.220928 0.459434 Na\n0.744955 0.943960 0.245253 Na\n0.431967 0.727473 0.990065 Na\n0.931967 0.772527 0.990065 Na\n0.787134 0.509579 0.266325 Co\n0.287134 0.990421 0.266325 Co\n0.712866 0.009579 0.733676 Co\n0.212866 0.490421 0.733675 Co\n0.058804 0.605373 0.833919 O\n0.183488 0.308329 0.739144 O\n0.558804 0.894627 0.833919 O\n0.414532 0.577037 0.653408 O\n0.683488 0.191671 0.739144 O\n0.085468 0.077037 0.346592 O\n0.914532 0.922963 0.653409 O\n0.316512 0.808329 0.260856 O\n0.585468 0.422963 0.346592 O\n0.441196 0.105373 0.166081 O\n0.816512 0.691671 0.260857 O\n0.941196 0.394627 0.166082 O\n",
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{
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"structure_string": "Sr4 H16 N8\n1.0\n6.361483 0.000000 -4.406018\n0.000000 7.695736 0.000000\n-0.026043 0.000000 6.597189\nSr H N\n4 16 8\ndirect\n0.250307 0.378511 0.252716 Sr\n0.749692 0.878511 0.247283 Sr\n0.749693 0.621490 0.747283 Sr\n0.250307 0.121490 0.752716 Sr\n0.544844 0.402467 0.901842 H\n0.455156 0.902467 0.598158 H\n0.455156 0.597534 0.098158 H\n0.544844 0.097534 0.401841 H\n0.626721 0.262815 0.789780 H\n0.373279 0.762816 0.710220 H\n0.626721 0.237185 0.289779 H\n0.373279 0.737185 0.210220 H\n0.106487 0.821084 0.874423 H\n0.106487 0.678917 0.374423 H\n0.893513 0.178917 0.125577 H\n0.066090 0.469710 0.682152 H\n0.933910 0.969710 0.817848 H\n0.933910 0.530291 0.317847 H\n0.066090 0.030290 0.182152 H\n0.893513 0.321084 0.625577 H\n0.489452 0.854845 0.763882 N\n0.023562 0.113958 0.269141 N\n0.976437 0.613958 0.230859 N\n0.976438 0.886042 0.730859 N\n0.023563 0.386042 0.769141 N\n0.510548 0.145156 0.236118 N\n0.489451 0.645156 0.263882 N\n0.510549 0.354845 0.736118 N\n",
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{
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"updated_at": "2022-09-04T14:35:47.138897Z",
"structure_string": "La4 Cd4 B20 O40\n1.0\n7.949549 0.000000 0.000000\n0.000000 8.790536 -0.230401\n0.000000 -0.005337 9.690457\nLa Cd B O\n4 4 20 40\ndirect\n0.675533 0.310584 0.265645 La\n0.324468 0.689416 0.734355 La\n0.824468 0.810584 0.765645 La\n0.175533 0.189416 0.234355 La\n0.908635 0.891808 0.374444 Cd\n0.408635 0.608193 0.125556 Cd\n0.091365 0.108192 0.625556 Cd\n0.591365 0.391807 0.874445 Cd\n0.031068 0.782031 0.057196 B\n0.531068 0.717969 0.442805 B\n0.968932 0.217969 0.942805 B\n0.468932 0.282031 0.557196 B\n0.825663 0.018112 0.099905 B\n0.325663 0.481888 0.400095 B\n0.422362 0.082901 0.744949 B\n0.674337 0.518112 0.599905 B\n0.174337 0.981889 0.900095 B\n0.602513 0.851639 0.997115 B\n0.675107 0.067564 0.591945 B\n0.175106 0.432436 0.908055 B\n0.324894 0.932436 0.408055 B\n0.102513 0.648362 0.502885 B\n0.397487 0.148361 0.002885 B\n0.922363 0.417099 0.755051 B\n0.577638 0.917099 0.255051 B\n0.077638 0.582901 0.244949 B\n0.824894 0.567565 0.091945 B\n0.897487 0.351639 0.497115 B\n0.879992 0.686414 0.014441 O\n0.470398 0.580622 0.362462 O\n0.970398 0.919378 0.137539 O\n0.612189 0.674414 0.576383 O\n0.112189 0.825586 0.923618 O\n0.387811 0.325586 0.423617 O\n0.620008 0.186414 0.514441 O\n0.270072 0.041744 0.019284 O\n0.229928 0.541744 0.519284 O\n0.729929 0.958256 0.980716 O\n0.029602 0.080622 0.862462 O\n0.120008 0.313586 0.985559 O\n0.379992 0.813586 0.485559 O\n0.887811 0.174414 0.076383 O\n0.770072 0.458256 0.480716 O\n0.529603 0.419378 0.637539 O\n0.859501 0.308435 0.856094 O\n0.640500 0.808435 0.356094 O\n0.787244 0.529845 0.725802 O\n0.330980 0.499952 0.922642 O\n0.830980 0.000048 0.577358 O\n0.669020 0.500048 0.077358 O\n0.169020 -0.000048 0.422642 O\n0.554653 0.763201 0.887100 O\n0.054653 0.736799 0.612901 O\n0.445347 0.236799 0.112901 O\n0.287244 0.970155 0.774199 O\n0.140500 0.691565 0.143906 O\n0.945347 0.263201 0.387099 O\n0.212756 0.470155 0.274199 O\n0.467075 0.166286 0.874742 O\n0.532925 0.833714 0.125259 O\n0.032925 0.666287 0.374741 O\n0.576185 0.006489 0.694172 O\n0.076185 0.493511 0.805829 O\n0.423815 0.993511 0.305828 O\n0.923815 0.506490 0.194172 O\n0.359501 0.191565 0.643906 O\n0.712756 0.029845 0.225801 O\n0.967075 0.333713 0.625259 O\n",
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{
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"structure_string": "Cu8 Se8 O24\n1.0\n7.604611 0.000000 -1.179844\n0.000000 8.353040 0.000000\n0.066181 0.000000 8.567783\nCu Se O\n8 8 24\ndirect\n0.470397 0.797544 0.030988 Cu\n0.411410 0.391649 0.613350 Cu\n0.588590 0.608351 0.386651 Cu\n0.088590 0.891649 0.886650 Cu\n0.529603 0.202456 0.969012 Cu\n0.911410 0.108351 0.113350 Cu\n0.029603 0.297544 0.469012 Cu\n0.970397 0.702456 0.530988 Cu\n0.189856 0.866653 0.295695 Se\n0.677068 0.975292 0.329421 Se\n0.689855 0.633347 0.795695 Se\n0.322932 0.024708 0.670579 Se\n0.810144 0.133347 0.704305 Se\n0.177068 0.524708 0.829420 Se\n0.310144 0.366653 0.204305 Se\n0.822932 0.475292 0.170580 Se\n0.662366 0.931884 0.129069 O\n0.432232 0.424346 0.389247 O\n0.381884 0.789491 0.239006 O\n0.567767 0.575653 0.610754 O\n0.745146 0.790206 0.425093 O\n0.120037 0.930865 0.659790 O\n0.618116 0.210509 0.760994 O\n0.620037 0.569135 0.159791 O\n0.837634 0.431884 0.370932 O\n0.881884 0.710509 0.739006 O\n0.067768 0.924346 0.110754 O\n0.754854 0.290206 0.074907 O\n0.118116 0.289491 0.260994 O\n0.879963 0.069135 0.340210 O\n0.337634 0.068116 0.870931 O\n0.245146 0.709794 0.925093 O\n0.081983 0.694709 0.335636 O\n0.918017 0.305291 0.664364 O\n0.254854 0.209794 0.574907 O\n0.162366 0.568116 0.629068 O\n0.379963 0.430865 0.840210 O\n0.418017 0.194709 0.164364 O\n0.581983 0.805291 0.835636 O\n0.932232 0.075654 0.889247 O\n",
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