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{
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{
"id": "jvasp-34660",
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{
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"structure_string": "Si4 O8\n1.0\n4.592410 -0.000023 1.368214\n2.167217 4.467757 1.117036\n0.028292 0.165200 8.296093\nSi O\n4 8\ndirect\n0.701114 0.061882 0.313697 Si\n0.298886 0.938119 0.686302 Si\n0.923319 0.561864 0.813693 Si\n0.076681 0.438137 0.186307 Si\n0.854595 0.283815 0.320900 O\n0.459297 0.216220 0.179103 O\n0.004309 0.249992 0.749994 O\n0.995690 0.750009 0.250005 O\n0.145405 0.716186 0.679100 O\n0.540703 0.783781 0.820896 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n",
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{
"id": "jvasp-57434",
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"updated_at": "2022-09-04T14:37:08.414951Z",
"structure_string": "Si8 O16\n1.0\n5.748884 0.070715 0.000000\n-0.529226 5.724909 0.000000\n0.000000 0.000000 11.345948\nSi O\n8 16\ndirect\n0.510968 0.383115 0.871046 Si\n0.616884 0.489031 0.371046 Si\n0.989031 0.116884 0.871046 Si\n0.010968 0.883116 0.128954 Si\n0.883115 0.010967 0.371046 Si\n0.489031 0.616884 0.128954 Si\n0.116884 0.989032 0.628954 Si\n0.383115 0.510968 0.628954 Si\n0.250000 0.250000 0.637540 O\n0.749999 0.749999 0.362460 O\n0.458862 0.458863 0.250000 O\n0.000000 0.000000 0.000000 O\n0.499999 0.500000 0.000000 O\n0.041137 0.041137 0.250000 O\n0.749999 0.749999 0.137540 O\n0.499999 0.500000 0.500000 O\n0.749999 0.249999 0.373278 O\n0.958862 0.958862 0.750000 O\n0.249999 0.750000 0.626723 O\n0.250000 0.250000 0.862460 O\n0.749999 0.249999 0.873278 O\n0.541136 0.541137 0.750000 O\n0.249999 0.750000 0.126723 O\n0.000000 0.000000 0.500000 O\n",
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{
"id": "jvasp-57447",
"created_at": "2022-09-04T14:38:33.464340Z",
"updated_at": "2022-09-04T14:38:33.464351Z",
"structure_string": "Si6 O12\n1.0\n4.568097 0.000105 -0.821579\n-0.332101 4.695044 -1.845923\n-0.009359 -0.030966 6.846603\nSi O\n6 12\ndirect\n0.670742 0.691040 0.673335 Si\n0.329259 0.308957 0.326664 Si\n0.750000 0.356627 -0.000000 Si\n0.170741 0.982292 0.673335 Si\n0.250000 0.643371 0.000000 Si\n0.829259 0.017705 0.326664 Si\n0.539201 0.547935 0.850587 O\n0.317768 0.656199 0.517086 O\n0.539699 0.036543 0.818977 O\n0.182232 0.139113 0.482913 O\n0.682232 0.343798 0.482913 O\n0.960301 0.217565 0.181022 O\n0.960800 0.697348 0.149412 O\n0.039699 0.782432 0.818978 O\n0.039200 0.302650 0.850587 O\n0.460301 0.963454 0.181022 O\n0.817768 0.860884 0.517086 O\n0.460800 0.452062 0.149412 O\n",
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{
"id": "jvasp-57276",
"created_at": "2022-09-04T14:38:34.329495Z",
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"structure_string": "Si4 O8\n1.0\n4.820529 -0.003402 1.560058\n1.598101 6.420980 1.997864\n0.005035 -0.291411 6.905753\nSi O\n4 8\ndirect\n0.350897 0.949218 0.742519 Si\n0.649102 0.050783 0.257480 Si\n0.850897 0.742520 0.949217 Si\n0.149102 0.257480 0.050782 Si\n0.926161 0.137893 0.227222 O\n0.750000 0.838988 0.161012 O\n0.249999 0.161013 0.838987 O\n-0.000000 0.500000 -0.000000 O\n0.573837 0.772778 0.862107 O\n0.073837 0.862107 0.772777 O\n0.500000 0.000000 0.500000 O\n0.426161 0.227222 0.137893 O\n",
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{
"id": "jvasp-51622",
"created_at": "2022-09-04T14:38:34.309986Z",
"updated_at": "2022-09-04T14:38:34.310011Z",
"structure_string": "Si3 O6\n1.0\n2.285250 -3.958168 0.000000\n2.285250 3.958168 -0.000000\n0.000000 -0.000000 6.773493\nSi O\n3 6\ndirect\n0.915155 -0.000000 0.666667 Si\n0.084845 0.084845 0.000000 Si\n-0.000000 0.915155 0.333333 Si\n0.119014 0.462566 0.921019 O\n0.537434 0.656448 0.587686 O\n0.462566 0.119014 0.078981 O\n0.343552 0.880986 0.254353 O\n0.880986 0.343552 0.745646 O\n0.656448 0.537434 0.412314 O\n",
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"spacegroup": 154
},
{
"id": "jvasp-57816",
"created_at": "2022-09-04T14:38:31.246015Z",
"updated_at": "2022-09-04T14:38:31.246046Z",
"structure_string": "Si8 O16\n1.0\n3.879735 0.000000 0.000000\n0.000000 8.699506 0.000000\n0.000000 0.000000 9.865029\nSi O\n8 16\ndirect\n0.343093 0.325127 0.608076 Si\n0.656906 0.674873 0.608076 Si\n0.343093 0.825127 0.891924 Si\n0.656906 0.174873 0.891924 Si\n0.343093 0.174873 0.108076 Si\n0.656906 0.825127 0.108076 Si\n0.343093 0.674873 0.391924 Si\n0.656906 0.325127 0.391924 Si\n0.499999 0.250000 0.750000 O\n0.499999 0.250000 0.250000 O\n0.499999 0.500000 0.633902 O\n0.499999 0.750000 0.750000 O\n0.000000 0.644680 0.500000 O\n0.499999 0.699420 0.000000 O\n0.499999 0.000000 0.866098 O\n0.499999 0.500000 0.366098 O\n0.499999 0.000000 0.133902 O\n0.000000 0.144680 0.000000 O\n0.000000 0.855321 0.000000 O\n0.499999 0.300580 0.000000 O\n0.499999 0.750000 0.250000 O\n0.000000 0.355320 0.500000 O\n0.499999 0.199420 0.500000 O\n0.499999 0.800581 0.500000 O\n",
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{
"id": "jvasp-97862",
"created_at": "2022-09-04T14:35:53.019091Z",
"updated_at": "2022-09-04T14:35:53.019118Z",
"structure_string": "Si16 O32\n1.0\n8.371167 0.000000 0.000000\n0.000000 9.428439 -0.000000\n0.000000 0.000000 9.459697\nSi O\n16 32\ndirect\n0.313143 0.192207 0.099856 Si\n0.186898 0.899358 0.191827 Si\n0.686858 0.692207 0.400145 Si\n0.313143 0.692207 0.400145 Si\n0.813102 0.399358 0.308173 Si\n0.686858 0.807794 0.900145 Si\n0.813102 0.600642 0.691827 Si\n0.813102 0.899358 0.191827 Si\n0.686858 0.192207 0.099856 Si\n0.686858 0.307793 0.599856 Si\n0.813102 0.100642 0.808174 Si\n0.186898 0.600642 0.691827 Si\n0.313143 0.807794 0.900145 Si\n0.313143 0.307793 0.599856 Si\n0.186898 0.399358 0.308173 Si\n0.186898 0.100642 0.808174 Si\n0.749443 0.846080 0.345426 O\n0.208249 0.429821 0.679232 O\n0.250557 0.653920 0.845427 O\n0.000000 0.640243 0.670752 O\n0.749443 0.346080 0.154574 O\n0.749443 0.653920 0.845427 O\n0.250557 0.846080 0.345426 O\n0.291214 0.318659 0.429522 O\n0.708786 0.318659 0.429522 O\n0.749443 0.153920 0.654574 O\n0.791752 0.929821 0.820768 O\n0.291214 0.681341 0.570479 O\n0.000000 0.359758 0.329249 O\n0.291214 0.818659 0.070478 O\n0.250557 0.153920 0.654574 O\n0.708786 0.181341 0.929522 O\n0.208249 0.570180 0.320768 O\n0.291214 0.181341 0.929522 O\n0.500000 0.330339 0.638772 O\n0.000000 0.140242 0.829249 O\n0.208249 0.929821 0.820768 O\n0.791752 0.570180 0.320768 O\n0.708786 0.818659 0.070478 O\n0.708786 0.681341 0.570479 O\n0.500000 0.169661 0.138772 O\n0.000000 0.859758 0.170752 O\n0.791752 0.429821 0.679232 O\n0.250557 0.346080 0.154574 O\n0.208249 0.070180 0.179232 O\n0.500000 0.669661 0.361228 O\n0.500000 0.830339 0.861228 O\n0.791752 0.070180 0.179232 O\n",
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{
"id": "jvasp-90508",
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"structure_string": "Si3 O6\n1.0\n4.903635 -0.722480 -0.141777\n-3.077503 3.885434 0.141777\n-0.049862 0.028788 5.716901\nSi O\n3 6\ndirect\n0.064221 0.533694 0.985606 Si\n0.554364 0.554363 0.666667 Si\n0.533695 0.064220 0.347727 Si\n0.047032 0.567419 0.281266 O\n0.245462 0.392823 0.875810 O\n0.666915 0.928074 0.541781 O\n0.392823 0.245462 0.457522 O\n0.928076 0.666913 0.791552 O\n0.567420 0.047032 0.052068 O\n",
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"volume": 96.18171910445191,
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{
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"structure_string": "Si3 O6\n1.0\n5.273615 0.017146 -0.695418\n-0.795361 5.213321 -0.695422\n0.014687 0.017149 5.319248\nSi O\n3 6\ndirect\n0.716509 0.283491 0.500000 Si\n0.499999 0.716510 0.283492 Si\n0.283491 0.499999 0.716510 Si\n0.308451 0.691549 0.500002 O\n0.499998 0.308451 0.691550 O\n0.691551 0.500000 0.308450 O\n0.000002 0.331956 0.668046 O\n0.668046 0.000001 0.331954 O\n0.331954 0.668044 -0.000002 O\n",
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"formula_full": "Si3 O6",
"formula_reduced": "SiO2",
"formula_anonymous": "AB2",
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"spacegroup": 155
},
{
"id": "jvasp-34674",
"created_at": "2022-09-04T14:38:08.322090Z",
"updated_at": "2022-09-04T14:38:08.322116Z",
"structure_string": "Si4 O8\n1.0\n4.776527 0.000000 0.000000\n0.000000 5.838264 -0.709773\n0.000000 0.108275 5.880253\nSi O\n4 8\ndirect\n0.362714 0.034367 0.348877 Si\n0.862714 0.965632 0.651123 Si\n0.137287 0.651122 0.965632 Si\n0.637287 0.348877 0.034367 Si\n0.398575 0.479442 0.896724 O\n0.601425 0.896723 0.479443 O\n0.000000 0.733866 0.733867 O\n0.898576 0.520557 0.103276 O\n0.101425 0.103275 0.520557 O\n0.250000 0.872745 0.127255 O\n0.500000 0.266132 0.266132 O\n0.750001 0.127254 0.872745 O\n",
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"volume": 164.3474933233029,
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"formula_full": "Si4 O8",
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"spacegroup": 20
},
{
"id": "jvasp-99099",
"created_at": "2022-09-04T14:36:19.143535Z",
"updated_at": "2022-09-04T14:36:19.143576Z",
"structure_string": "Si12 O24\n1.0\n12.732535 0.000000 0.000000\n-6.366268 11.026699 -0.000000\n0.000000 0.000000 3.782341\nSi O\n12 24\ndirect\n0.141909 0.455724 0.342460 Si\n0.858091 0.313815 0.657540 Si\n0.313815 0.858091 0.342460 Si\n0.544276 0.686185 0.342460 Si\n0.141909 0.686185 0.657540 Si\n0.455725 0.313815 0.342460 Si\n0.313815 0.455724 0.657540 Si\n0.858091 0.544276 0.342460 Si\n0.686185 0.544276 0.657540 Si\n0.455725 0.141909 0.657540 Si\n0.686185 0.141909 0.342460 Si\n0.544276 0.858091 0.657540 Si\n0.184017 0.592009 0.500000 O\n0.245850 0.491700 0.000000 O\n0.815983 0.407991 0.500000 O\n0.387301 -0.000000 0.500000 O\n0.179540 0.820460 0.500000 O\n-0.000000 0.387301 0.500000 O\n0.508300 0.754150 0.000000 O\n0.640920 0.820460 0.500000 O\n0.387301 0.387301 0.500000 O\n0.359080 0.179540 0.500000 O\n-0.000000 0.612699 0.500000 O\n0.407991 0.815983 0.500000 O\n0.754150 0.245850 0.000000 O\n0.491700 0.245850 0.000000 O\n0.179540 0.359080 0.500000 O\n0.245850 0.754150 0.000000 O\n0.592009 0.184017 0.500000 O\n0.820460 0.179540 0.500000 O\n0.612699 -0.000000 0.500000 O\n0.592009 0.407991 0.500000 O\n0.820460 0.640920 0.500000 O\n0.754150 0.508300 0.000000 O\n0.407991 0.592009 0.500000 O\n0.612699 0.612699 0.500000 O\n",
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}
]
}