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{
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"structure_string": "Cu2 H24 N4 Cl8 O4\n1.0\n7.478141 0.000000 0.000000\n-0.000000 7.478141 0.000000\n0.000000 0.000000 7.861199\nCu H N Cl O\n2 24 4 8 4\ndirect\n0.500000 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.075750 0.415290 0.174041 H\n0.924250 0.584710 0.174041 H\n0.575750 0.084710 0.674041 H\n0.424250 0.915290 0.674041 H\n0.924250 0.584710 0.825959 H\n0.424250 0.915290 0.325959 H\n0.575750 0.084710 0.325959 H\n0.415290 0.075750 0.174041 H\n0.584710 0.924250 0.174041 H\n0.084710 0.575750 0.674041 H\n0.915290 0.424250 0.674041 H\n0.075750 0.415290 0.825959 H\n0.415290 0.075750 0.825959 H\n0.915290 0.424250 0.325959 H\n0.084710 0.575750 0.325959 H\n0.077199 0.077199 0.322294 H\n0.922801 0.922801 0.322294 H\n0.422801 0.577199 0.822295 H\n0.577199 0.422801 0.822295 H\n0.922801 0.922801 0.677706 H\n0.077199 0.077199 0.677706 H\n0.577199 0.422801 0.177706 H\n0.422801 0.577199 0.177706 H\n0.584710 0.924250 0.825959 H\n0.500000 0.000000 0.250000 N\n0.000000 0.500000 0.750000 N\n0.500000 0.000000 0.750000 N\n0.000000 0.500000 0.250000 N\n0.280615 0.719384 0.500000 Cl\n0.719384 0.280615 0.500000 Cl\n0.219384 0.219384 0.000000 Cl\n0.780615 0.780615 0.000000 Cl\n0.279832 0.720168 0.000000 Cl\n0.720168 0.279832 0.000000 Cl\n0.220168 0.220168 0.500000 Cl\n0.779832 0.779832 0.500000 Cl\n0.500000 0.500000 0.748302 O\n0.500000 0.500000 0.251698 O\n0.000000 0.000000 0.751698 O\n0.000000 0.000000 0.248302 O\n",
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"structure_string": "Li21 Ta3 O18\n1.0\n5.529877 0.000000 -0.000000\n-2.764939 4.789014 0.000000\n-0.000000 0.000000 14.668236\nLi Ta O\n21 3 18\ndirect\n0.382578 0.388988 0.115966 Li\n0.666667 0.333333 0.987344 Li\n0.000000 0.000000 0.654004 Li\n0.712527 0.728697 0.217840 Li\n0.016170 0.287473 0.217840 Li\n0.271302 0.983829 0.217840 Li\n0.339741 0.284087 0.782631 Li\n0.944345 0.660258 0.782631 Li\n0.715913 0.055655 0.782631 Li\n0.379194 0.062030 0.551172 Li\n0.333333 0.666666 0.320678 Li\n0.937970 0.317163 0.551172 Li\n0.673076 0.950753 0.449300 Li\n0.277678 0.326924 0.449300 Li\n0.049246 0.722322 0.449300 Li\n0.045857 0.395361 0.884505 Li\n0.349504 0.954142 0.884505 Li\n0.604639 0.650496 0.884505 Li\n0.006410 0.617421 0.115966 Li\n0.611011 0.993589 0.115966 Li\n0.682837 0.620806 0.551172 Li\n0.333333 0.666666 0.668056 Ta\n0.000000 0.000000 0.001392 Ta\n0.666667 0.333333 0.334725 Ta\n0.980702 0.613170 0.252448 O\n0.323260 0.952710 0.749113 O\n0.629449 0.676739 0.749113 O\n0.047289 0.370550 0.749113 O\n0.299132 0.352629 0.585780 O\n0.053498 0.700867 0.585780 O\n0.647370 0.946501 0.585780 O\n0.386829 0.367531 0.252448 O\n0.656593 0.619374 0.415782 O\n0.380625 0.037219 0.415782 O\n0.965804 0.685965 0.919115 O\n0.720162 0.034196 0.919115 O\n0.314034 0.279838 0.919115 O\n0.632469 0.019298 0.252448 O\n0.296115 0.010072 0.082449 O\n0.713957 0.703885 0.082449 O\n0.962781 0.343406 0.415782 O\n0.989928 0.286043 0.082449 O\n",
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{
"id": "jvasp-97413",
"created_at": "2022-09-04T14:35:52.669428Z",
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"structure_string": "Na6 Si6 B6 O24\n1.0\n8.068432 0.000000 0.000000\n-4.034216 6.987467 -0.000000\n-0.000000 0.000000 7.702520\nNa Si B O\n6 6 6 24\ndirect\n0.000000 0.000000 0.231101 Na\n0.333333 0.666667 0.266421 Na\n0.666667 0.333333 0.766421 Na\n0.666667 0.333333 0.197393 Na\n0.000000 0.000000 0.731101 Na\n0.333333 0.666667 0.697393 Na\n0.683580 0.660926 0.512394 Si\n0.339074 0.022655 0.512394 Si\n0.316420 0.339074 0.012394 Si\n0.022654 0.683580 0.012394 Si\n0.977345 0.316420 0.512394 Si\n0.660925 0.977346 0.012394 Si\n0.661674 0.981167 0.392866 B\n0.981167 0.319493 0.892866 B\n0.680507 0.661675 0.892866 B\n0.319492 0.338326 0.392866 B\n0.338325 0.018833 0.892866 B\n0.018833 0.680508 0.392866 B\n0.529647 0.074056 0.968322 O\n0.749228 0.888456 0.492740 O\n0.728178 0.631625 0.713309 O\n0.809722 0.599302 0.389196 O\n0.544408 0.470353 0.968322 O\n0.455592 0.529648 0.468322 O\n0.860772 0.749228 0.992740 O\n0.271821 0.368376 0.213309 O\n0.903445 0.271821 0.713309 O\n0.925944 0.455592 0.968322 O\n0.250772 0.111544 0.992740 O\n0.139228 0.250772 0.492740 O\n0.210420 0.809723 0.889196 O\n0.470352 0.925945 0.468322 O\n0.111544 0.860773 0.492740 O\n0.400698 0.210421 0.389196 O\n0.631624 0.903446 0.213309 O\n0.888455 0.139228 0.992740 O\n0.368375 0.096554 0.713309 O\n0.599301 0.789580 0.889196 O\n0.096554 0.728179 0.213309 O\n0.190277 0.400698 0.889196 O\n0.074055 0.544408 0.468322 O\n0.789579 0.190278 0.389196 O\n",
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{
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"created_at": "2022-09-04T14:35:52.350972Z",
"updated_at": "2022-09-04T14:35:52.350994Z",
"structure_string": "Hf2 Cl8 O32\n1.0\n7.075939 0.017120 1.935448\n2.906866 6.451305 1.935448\n0.023764 0.015398 12.946848\nHf Cl O\n2 8 32\ndirect\n0.398453 0.354144 0.589435 Hf\n0.354144 0.398453 0.089435 Hf\n0.712562 0.153798 0.420978 Cl\n0.393820 0.986984 0.184661 Cl\n0.765650 0.358709 -0.005751 Cl\n0.598904 0.039976 0.757847 Cl\n0.358709 0.765651 0.494249 Cl\n0.153798 0.712563 0.920978 Cl\n0.986983 0.393820 0.684661 Cl\n0.039976 0.598905 0.257847 Cl\n0.913405 0.814339 0.234362 O\n0.194366 0.481493 0.951112 O\n0.565092 0.798093 0.164014 O\n0.629733 0.432759 0.100232 O\n0.187424 0.954499 0.514954 O\n0.271054 0.558294 0.227743 O\n0.484919 0.034626 0.674457 O\n0.839171 0.938370 0.444436 O\n0.786377 0.529058 0.916488 O\n0.253236 0.757072 0.813424 O\n0.122839 0.319868 0.578644 O\n0.481492 0.194367 0.451112 O\n0.814338 0.913406 0.734362 O\n-0.004594 0.499509 0.365403 O\n0.529057 0.786378 0.416487 O\n0.717934 0.267759 0.504370 O\n0.289275 0.621319 0.461998 O\n0.954498 0.187424 0.014954 O\n0.757071 0.253237 0.313424 O\n0.966334 0.223409 0.762397 O\n0.938369 0.839171 0.944436 O\n0.432758 0.629733 0.600232 O\n0.558293 0.271054 0.727743 O\n0.499508 -0.004593 0.865403 O\n0.267759 0.717935 0.004370 O\n0.319867 0.122839 0.078644 O\n0.034626 0.484920 0.174457 O\n0.798092 0.565092 0.664014 O\n0.223408 0.966335 0.262397 O\n0.621318 0.289275 0.961998 O\n0.463246 0.131331 0.216902 O\n0.131330 0.463247 0.716902 O\n",
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{
"id": "jvasp-97601",
"created_at": "2022-09-04T14:35:41.735100Z",
"updated_at": "2022-09-04T14:35:41.735124Z",
"structure_string": "Th6 Fe24 P12\n1.0\n3.711848 0.000000 0.000000\n0.000000 10.707980 -0.000000\n0.000000 -0.000000 14.277972\nTh Fe P\n6 24 12\ndirect\n0.000000 0.000000 0.000000 Th\n0.500000 0.375956 0.225808 Th\n0.500000 0.624044 0.774192 Th\n0.500000 0.500000 0.500000 Th\n0.000000 0.124044 0.725808 Th\n0.000000 0.875957 0.274192 Th\n0.000000 0.432875 0.674982 Fe\n0.000000 0.567125 0.325018 Fe\n0.500000 0.932875 0.825018 Fe\n0.500000 0.067125 0.174982 Fe\n0.000000 0.822350 0.710192 Fe\n0.000000 0.177651 0.289808 Fe\n0.500000 0.322350 0.789808 Fe\n0.500000 0.240378 0.037384 Fe\n0.500000 0.766052 0.578139 Fe\n0.000000 0.733948 0.078139 Fe\n0.000000 0.266052 0.921861 Fe\n0.500000 0.908799 0.448411 Fe\n0.000000 0.922151 0.553531 Fe\n0.500000 0.677651 0.210192 Fe\n0.500000 0.233948 0.421861 Fe\n0.500000 0.759622 0.962616 Fe\n0.000000 0.259622 0.537384 Fe\n0.500000 0.422151 0.946469 Fe\n0.500000 0.091201 0.551589 Fe\n0.000000 0.408799 0.051589 Fe\n0.000000 0.591201 0.948411 Fe\n0.500000 0.577849 0.053531 Fe\n0.000000 0.077849 0.446469 Fe\n0.000000 0.740378 0.462616 Fe\n0.500000 0.149989 0.886312 P\n0.000000 0.350011 0.386312 P\n0.000000 0.649989 0.613688 P\n0.500000 0.701107 0.367120 P\n0.500000 0.298893 0.632880 P\n0.000000 0.429268 0.834015 P\n0.500000 0.929268 0.665985 P\n0.000000 0.570732 0.165985 P\n0.000000 0.201107 0.132880 P\n0.000000 0.798893 0.867120 P\n0.500000 0.070732 0.334015 P\n0.500000 0.850011 0.113688 P\n",
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{
"id": "jvasp-95689",
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"updated_at": "2022-09-04T14:35:52.503151Z",
"structure_string": "Ca10 P6 Cl2 O24\n1.0\n9.723931 -0.000000 0.000000\n-4.861965 8.421170 -0.000000\n-0.000000 0.000000 6.704572\nCa P Cl O\n10 6 2 24\ndirect\n0.013727 0.753331 0.750000 Ca\n0.260396 0.013727 0.250000 Ca\n0.666667 0.333333 0.504231 Ca\n0.246669 0.260396 0.750000 Ca\n0.753331 0.739604 0.250000 Ca\n0.333333 0.666667 0.495769 Ca\n0.986272 0.246669 0.250000 Ca\n0.666667 0.333333 0.995769 Ca\n0.333333 0.666667 0.004231 Ca\n0.739603 0.986273 0.750000 Ca\n0.967494 0.589150 0.250000 P\n0.410850 0.378346 0.250000 P\n0.621654 0.032505 0.250000 P\n0.032505 0.410850 0.750000 P\n0.589150 0.621654 0.750000 P\n0.378345 0.967495 0.750000 P\n0.000000 0.000000 0.500000 Cl\n0.000000 0.000000 0.000000 Cl\n0.403649 0.533278 0.750000 O\n0.466722 0.870370 0.750000 O\n0.731473 0.086539 0.435875 O\n0.086539 0.355066 0.564125 O\n0.644934 0.731473 0.935875 O\n0.147486 0.650857 0.250000 O\n0.731473 0.086539 0.064125 O\n0.355065 0.268527 0.435875 O\n0.870370 0.403649 0.250000 O\n0.086539 0.355066 0.935875 O\n0.596351 0.466722 0.250000 O\n0.533278 0.129630 0.250000 O\n0.129630 0.596351 0.750000 O\n0.913461 0.644934 0.435875 O\n0.268526 0.913461 0.564125 O\n0.913461 0.644934 0.064125 O\n0.852514 0.349143 0.750000 O\n0.355065 0.268527 0.064125 O\n0.503371 0.852514 0.250000 O\n0.349142 0.496629 0.250000 O\n0.644934 0.731473 0.564125 O\n0.496629 0.147486 0.750000 O\n0.268526 0.913461 0.935875 O\n0.650857 0.503371 0.750000 O\n",
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{
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"structure_string": "Na6 Li6 S6 O24\n1.0\n7.596430 -0.000000 0.000000\n-3.798215 6.578701 -0.000000\n-0.000000 0.000000 9.884198\nNa Li S O\n6 6 6 24\ndirect\n0.543346 0.516898 0.489201 Na\n0.483102 0.026448 0.489201 Na\n0.973552 0.456655 0.489201 Na\n0.456655 0.973552 0.989201 Na\n0.026448 0.483102 0.989201 Na\n0.516899 0.543345 0.989201 Na\n0.037782 0.792457 0.761372 Li\n0.207543 0.245325 0.761372 Li\n0.754676 0.962218 0.761372 Li\n0.792457 0.037782 0.261372 Li\n0.245325 0.207543 0.261372 Li\n0.962219 0.754675 0.261372 Li\n0.000000 0.000000 0.501852 S\n0.666667 0.333333 0.195416 S\n0.333333 0.666667 0.695416 S\n0.000000 0.000000 0.001852 S\n0.333333 0.666667 0.263357 S\n0.666667 0.333333 0.763357 S\n0.787478 0.886699 0.952042 O\n0.473991 0.312856 0.814721 O\n0.687144 0.161135 0.814721 O\n0.838866 0.526009 0.814721 O\n0.312856 0.473991 0.314721 O\n0.161135 0.687144 0.314721 O\n0.526010 0.838865 0.314721 O\n0.000000 0.000000 0.155139 O\n0.000000 0.000000 0.655139 O\n0.666667 0.333333 0.344876 O\n0.333333 0.666667 0.844876 O\n0.229954 0.775519 0.643216 O\n0.224481 0.454434 0.643216 O\n0.545566 0.770046 0.643216 O\n0.775520 0.229954 0.143216 O\n0.454435 0.224481 0.143216 O\n0.770046 0.545565 0.143216 O\n0.212522 0.099221 0.452042 O\n0.900779 0.113301 0.452042 O\n0.886700 0.787478 0.452042 O\n0.333333 0.666667 0.113706 O\n0.113301 0.900778 0.952042 O\n0.666667 0.333333 0.613706 O\n0.099222 0.212522 0.952042 O\n",
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{
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