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{
"id": "jvasp-12780",
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{
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"structure_string": "Ca4 Sn4 S12\n1.0\n6.648226 -0.000000 0.000000\n-0.000000 7.093764 0.000000\n0.000000 0.000000 9.618045\nCa Sn S\n4 4 12\ndirect\n0.463769 0.403988 0.750000 Ca\n0.036231 0.903988 0.750000 Ca\n0.536231 0.596011 0.250000 Ca\n0.963770 0.096011 0.250000 Ca\n0.500000 0.000000 0.500000 Sn\n0.000000 0.500000 0.000000 Sn\n0.500000 0.000000 0.000000 Sn\n0.000000 0.500000 0.500000 Sn\n0.681450 0.312817 0.433949 S\n0.818551 0.812817 0.066050 S\n0.681450 0.312817 0.066050 S\n0.818551 0.812817 0.433949 S\n0.318551 0.687183 0.566050 S\n0.859998 0.547447 0.750000 S\n0.140002 0.452553 0.250000 S\n0.359998 0.952553 0.250000 S\n0.181449 0.187183 0.566050 S\n0.640002 0.047447 0.750000 S\n0.181449 0.187183 0.933949 S\n0.318551 0.687183 0.933949 S\n",
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{
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"created_at": "2022-09-04T14:38:35.287675Z",
"updated_at": "2022-09-04T14:38:35.287712Z",
"structure_string": "Y6 Al2 O12\n1.0\n4.425955 5.541526 0.000000\n-4.425955 5.541526 0.000000\n0.000000 0.000000 5.384225\nY Al O\n6 2 12\ndirect\n0.298348 0.913332 0.469755 Y\n0.086669 0.701652 0.969756 Y\n0.396724 0.396724 0.424787 Y\n0.603276 0.603276 0.924787 Y\n0.701652 0.086669 0.969756 Y\n0.913332 0.298348 0.469755 Y\n0.194332 0.194332 0.004973 Al\n0.805668 0.805668 0.504974 Al\n0.891588 0.584324 0.670922 O\n0.415677 0.108413 0.170922 O\n0.955827 0.955827 0.631001 O\n0.785850 0.785850 0.176890 O\n0.214150 0.214150 0.676890 O\n0.323459 0.644433 0.698523 O\n0.584324 0.891588 0.670922 O\n0.108413 0.415677 0.170922 O\n0.644433 0.323459 0.698523 O\n0.355568 0.676541 0.198523 O\n0.044173 0.044173 0.131001 O\n0.676541 0.355568 0.198523 O\n",
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{
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{
"id": "jvasp-119133",
"created_at": "2022-09-04T14:38:35.284074Z",
"updated_at": "2022-09-04T14:38:35.284100Z",
"structure_string": "U1 Al6 Fe6\n1.0\n6.439920 -0.000018 -1.031701\n-1.568425 4.279024 -4.665509\n-0.019007 0.000018 6.522010\nU Al Fe\n1 6 6\ndirect\n0.000000 0.000000 0.000000 U\n0.651724 0.651723 -0.000001 Al\n0.348275 0.348275 -0.000000 Al\n0.342603 -0.000000 0.342603 Al\n0.657396 -0.000000 0.657397 Al\n0.199224 0.699225 0.499999 Al\n0.800774 0.300774 0.500000 Al\n0.499999 0.500000 0.500000 Fe\n0.500000 -0.000000 -0.000000 Fe\n-0.000000 0.500000 -0.000000 Fe\n-0.000000 0.000000 0.500000 Fe\n0.767863 0.499999 0.267863 Fe\n0.232136 0.500000 0.732136 Fe\n",
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{
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"created_at": "2022-09-04T14:38:35.283931Z",
"updated_at": "2022-09-04T14:38:35.283963Z",
"structure_string": "Li4 Ag4 O4\n1.0\n0.000033 -0.000000 3.755796\n4.608515 -4.608691 1.877939\n4.608482 4.608691 -1.877857\nLi Ag O\n4 4 4\ndirect\n0.749992 0.136576 0.136576 Li\n0.386552 0.863451 0.136555 Li\n0.113447 0.136555 0.863452 Li\n0.750008 0.863430 0.863430 Li\n0.411316 0.177376 0.500018 Ag\n0.088675 0.500018 0.177376 Ag\n0.088687 0.822630 0.499987 Ag\n0.411329 0.499987 0.822630 Ag\n0.249990 0.177914 0.177914 O\n0.927888 0.822115 0.177891 O\n0.572112 0.177891 0.822115 O\n0.250010 0.822092 0.822092 O\n",
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{
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"created_at": "2022-09-04T14:38:35.279015Z",
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"structure_string": "Ca1 Bi4 O8\n1.0\n3.489496 0.004615 0.003432\n1.735092 6.872268 0.604221\n1.732608 2.429330 9.080281\nCa Bi O\n1 4 8\ndirect\n0.675265 0.872184 0.789258 Ca\n0.390675 0.754304 0.476344 Bi\n0.903920 0.350279 0.853857 Bi\n0.135194 0.611545 0.130045 Bi\n0.668046 0.227351 0.448549 Bi\n0.062446 0.517237 0.369855 O\n0.558407 0.826189 0.068969 O\n0.511865 0.231460 0.756788 O\n0.860451 0.628628 0.662460 O\n0.839506 -0.030378 0.363348 O\n0.242508 0.624762 0.902193 O\n0.207507 0.002366 0.594606 O\n0.721808 0.393441 0.174934 O\n",
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"structure_string": "K4 Pd6 S8\n1.0\n6.004332 0.000000 1.428765\n3.002165 5.362393 0.714383\n0.088351 0.000000 12.959575\nK Pd S\n4 6 8\ndirect\n0.547789 0.750000 0.904424 K\n0.702212 0.750000 0.595577 K\n0.452212 0.250000 0.095577 K\n0.297788 0.250000 0.404424 K\n0.125001 0.750000 0.750000 Pd\n0.625929 0.250000 0.748141 Pd\n0.124071 0.250000 0.751859 Pd\n0.374071 0.750000 0.251859 Pd\n0.875930 0.750000 0.248141 Pd\n0.875000 0.250000 0.250000 Pd\n0.109527 0.916695 0.125963 S\n0.235489 0.416696 0.874038 S\n0.026221 0.083304 0.625963 S\n0.347816 0.416696 0.625963 S\n0.652185 0.583304 0.374038 S\n0.973779 0.916695 0.374038 S\n0.764512 0.583304 0.125963 S\n0.890474 0.083304 0.874038 S\n",
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{
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"structure_string": "Mg4 Mo6 O16\n1.0\n2.897363 -5.018379 0.000000\n2.897363 5.018379 -0.000000\n0.000000 0.000000 9.956130\nMg Mo O\n4 6 16\ndirect\n0.666667 0.333332 0.008177 Mg\n0.333332 0.666667 0.508177 Mg\n0.666667 0.333332 0.442814 Mg\n0.333332 0.666667 0.942814 Mg\n0.146072 0.853927 0.246334 Mo\n0.853926 0.707853 0.746334 Mo\n0.292146 0.146073 0.746334 Mo\n0.853927 0.146072 0.746334 Mo\n0.707853 0.853926 0.246334 Mo\n0.146073 0.292146 0.246334 Mo\n0.487425 0.974850 0.362550 O\n0.974850 0.487425 0.862550 O\n0.333332 0.666667 0.140483 O\n0.000000 0.000000 0.889121 O\n0.000000 0.000000 0.389121 O\n0.512574 0.025149 0.862550 O\n0.025149 0.512574 0.362550 O\n0.167274 0.334548 0.628752 O\n0.167274 0.832725 0.628752 O\n0.334548 0.167274 0.128752 O\n0.832725 0.665451 0.128752 O\n0.487425 0.512574 0.362550 O\n0.665451 0.832725 0.628752 O\n0.832725 0.167274 0.128752 O\n0.512574 0.487425 0.862550 O\n0.666667 0.333332 0.640483 O\n",
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}