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{
"id": "jvasp-25772",
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"structure_string": "Na2 Ca2 C3 O9\n1.0\n4.981905 0.000000 0.000000\n0.000000 5.970168 -2.735072\n0.000000 -0.023104 6.566808\nNa Ca C O\n2 2 3 9\ndirect\n0.000000 0.925701 0.925701 Na\n0.500000 0.615482 0.615482 Na\n0.500000 0.212095 0.780186 Ca\n0.500000 0.780186 0.212094 Ca\n0.000000 0.876630 0.464228 C\n0.000000 0.464229 0.876630 C\n0.500000 0.224895 0.224895 C\n0.500000 0.414422 0.210230 O\n0.500000 0.210230 0.414422 O\n0.000000 0.885012 0.271780 O\n0.500000 0.038409 0.038409 O\n0.000000 0.271780 0.885012 O\n0.226495 0.869460 0.559061 O\n0.773506 0.559061 0.869460 O\n0.773506 0.869460 0.559061 O\n0.226495 0.559061 0.869460 O\n",
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"structure_string": "Tm4 In1 Ni2 Ge4\n1.0\n4.029514 0.000000 -1.102865\n-0.586228 6.615108 -2.141885\n0.008949 -0.001418 7.945398\nTm In Ni Ge\n4 1 2 4\ndirect\n0.344235 0.063084 0.688469 Tm\n0.655764 0.936916 0.311530 Tm\n0.408219 0.609125 0.816438 Tm\n0.591780 0.390875 0.183561 Tm\n0.000000 0.000000 0.000000 In\n0.218001 0.637613 0.436003 Ni\n0.781997 0.362387 0.563996 Ni\n0.066231 0.662868 0.132463 Ge\n0.933768 0.337132 0.867536 Ge\n0.201552 0.262323 0.403105 Ge\n0.798447 0.737677 0.596894 Ge\n",
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{
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"updated_at": "2022-09-04T14:37:46.740098Z",
"structure_string": "K4 Li2 Al2 F12\n1.0\n5.387175 0.001929 8.147248\n2.451439 4.797093 8.147248\n0.003151 0.001929 9.767256\nK Li Al F\n4 2 2 12\ndirect\n0.127722 0.127721 0.127721 K\n0.280927 0.280926 0.280927 K\n0.719074 0.719073 0.719074 K\n0.872279 0.872278 0.872279 K\n0.597348 0.597348 0.597348 Li\n0.402652 0.402652 0.402652 Li\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.271864 0.807080 0.807080 F\n0.610709 0.160049 0.610709 F\n0.610709 0.610708 0.160049 F\n0.160049 0.610708 0.610709 F\n0.192921 0.728136 0.192920 F\n0.389292 0.839950 0.389292 F\n0.389292 0.389291 0.839951 F\n0.807080 0.271864 0.807080 F\n0.807081 0.807080 0.271864 F\n0.192920 0.192920 0.728136 F\n0.728137 0.192920 0.192920 F\n0.839952 0.389291 0.389291 F\n",
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{
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"updated_at": "2022-09-04T14:37:46.718263Z",
"structure_string": "Rb2 Sc1 Tl1 I6\n1.0\n7.529679 -0.000000 4.347262\n2.509893 7.099049 4.347262\n-0.000000 -0.000000 8.694524\nRb Sc Tl I\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500000 Tl\n0.766394 0.233606 0.233606 I\n0.233606 0.233606 0.766393 I\n0.233606 0.766394 0.766393 I\n0.233606 0.766394 0.233606 I\n0.766394 0.233606 0.766393 I\n0.766394 0.766394 0.233606 I\n",
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{
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"structure_string": "Mo3 W1 Se2 S6\n1.0\n3.223571 0.000000 -0.000000\n-1.611786 2.791129 0.000090\n-0.000000 0.001017 33.084878\nMo W Se S\n3 1 2 6\ndirect\n0.333222 0.666447 0.092036 Mo\n0.333354 0.666710 0.467986 Mo\n0.666766 0.333534 0.662880 Mo\n0.666623 0.333249 0.280013 W\n0.333423 0.666846 0.714533 Se\n0.333466 0.666935 0.611161 Se\n0.333274 0.666552 0.327303 S\n0.666645 0.333291 0.045037 S\n0.666746 0.333494 0.420956 S\n0.666551 0.333104 0.139076 S\n0.666653 0.333306 0.515042 S\n0.333268 0.666539 0.232727 S\n",
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{
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"created_at": "2022-09-04T14:37:46.710354Z",
"updated_at": "2022-09-04T14:37:46.710374Z",
"structure_string": "Ba6 W2 Cl4 O10\n1.0\n5.839850 -0.000000 -0.000000\n-2.919924 6.913101 0.000000\n-0.000000 0.000000 11.603689\nBa W Cl O\n6 2 4 10\ndirect\n0.650352 0.300704 0.956755 Ba\n0.349649 0.699296 0.456755 Ba\n0.650352 0.300704 0.543245 Ba\n0.907661 0.815320 0.750000 Ba\n0.349649 0.699296 0.043245 Ba\n0.092340 0.184680 0.250000 Ba\n0.756888 0.513776 0.250000 W\n0.243113 0.486224 0.750000 W\n0.506256 0.012512 0.250000 Cl\n0.000000 0.000000 0.500000 Cl\n0.493745 0.987488 0.750000 Cl\n0.000000 0.000000 0.000000 Cl\n0.944968 0.441630 0.363387 O\n0.944968 0.441630 0.136613 O\n0.115110 0.230219 0.750000 O\n0.503338 0.558370 0.636613 O\n0.055032 0.558370 0.863387 O\n0.884891 0.769781 0.250000 O\n0.055032 0.558370 0.636613 O\n0.503338 0.558370 0.863387 O\n0.496663 0.441630 0.136613 O\n0.496663 0.441630 0.363387 O\n",
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{
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"created_at": "2022-09-04T14:37:46.540336Z",
"updated_at": "2022-09-04T14:37:46.540357Z",
"structure_string": "Rb2 Hg1 Au1 Br6\n1.0\n6.726338 -0.000000 3.883453\n2.242113 6.341652 3.883453\n-0.000000 -0.000000 7.766906\nRb Hg Au Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Au\n0.755362 0.244638 0.244638 Br\n0.244638 0.244638 0.755362 Br\n0.244638 0.755362 0.755362 Br\n0.244638 0.755362 0.244638 Br\n0.755362 0.244638 0.755362 Br\n0.755362 0.755362 0.244638 Br\n",
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{
"id": "jvasp-25627",
"created_at": "2022-09-04T14:37:59.634106Z",
"updated_at": "2022-09-04T14:37:59.634126Z",
"structure_string": "As8 Cl12 O4 F20\n1.0\n0.000000 5.830150 -0.060938\n18.399294 0.000000 0.000000\n0.000000 -2.287563 -7.460645\nAs Cl O F\n8 12 4 20\ndirect\n0.560072 0.620780 0.169722 As\n0.145168 0.611142 0.797159 As\n0.560072 0.879219 0.669722 As\n0.439929 0.379220 0.830279 As\n0.854833 0.388858 0.202842 As\n0.439929 0.120780 0.330279 As\n0.854833 0.111142 0.702842 As\n0.145168 0.888858 0.297158 As\n0.670896 0.134782 0.893675 Cl\n0.329105 0.634782 0.606326 Cl\n0.882546 0.531952 0.694270 Cl\n0.882546 0.968047 0.194269 Cl\n0.028244 0.207599 0.663986 Cl\n0.117455 0.031952 0.805731 Cl\n0.028244 0.292401 0.163986 Cl\n0.971756 0.792401 0.336015 Cl\n0.329105 0.865218 0.106326 Cl\n0.971757 0.707599 0.836015 Cl\n0.670896 0.365218 0.393675 Cl\n0.117455 0.468047 0.305731 Cl\n0.673487 0.072076 0.513995 O\n0.673487 0.427924 0.013994 O\n0.326513 0.927924 0.486006 O\n0.326513 0.572076 -0.013994 O\n0.431292 0.039293 0.207784 F\n0.326293 0.844985 0.749817 F\n0.214352 0.412197 0.919680 F\n0.225950 0.339686 0.646848 F\n0.214352 0.087803 0.419680 F\n0.462060 0.300247 0.965323 F\n0.774051 0.660314 0.353153 F\n0.774051 0.839686 0.853153 F\n0.568709 0.960707 0.792217 F\n0.462059 0.199753 0.465323 F\n0.326293 0.655015 0.249817 F\n0.537941 0.800247 0.534678 F\n0.431293 0.460707 0.707784 F\n0.568708 0.539293 0.292217 F\n0.785649 0.912197 0.580321 F\n0.673708 0.155015 0.250184 F\n0.537941 0.699753 0.034677 F\n0.673708 0.344985 0.750184 F\n0.785649 0.587803 0.080321 F\n0.225949 0.160314 0.146848 F\n",
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{
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"created_at": "2022-09-04T14:37:38.227820Z",
"updated_at": "2022-09-04T14:37:38.227831Z",
"structure_string": "Dy1 Bi2 Br1 O4\n1.0\n3.908639 0.000000 0.000000\n0.000000 3.908639 -0.000000\n0.000000 -0.000000 9.232082\nDy Bi Br O\n1 2 1 4\ndirect\n0.000000 0.000000 0.000000 Dy\n0.500000 0.500000 0.728813 Bi\n0.500000 0.500000 0.271187 Bi\n0.000000 0.000000 0.500000 Br\n0.500000 0.000000 0.148933 O\n0.500000 0.000000 0.851067 O\n0.000000 0.500000 0.148933 O\n0.000000 0.500000 0.851067 O\n",
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{
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"created_at": "2022-09-04T14:37:53.744554Z",
"updated_at": "2022-09-04T14:37:53.744574Z",
"structure_string": "Rb2 Sn2 I2 O12\n1.0\n2.686736 -4.653563 0.000000\n2.686736 4.653563 0.000000\n0.000000 -0.000000 12.460027\nRb Sn I O\n2 2 2 12\ndirect\n0.000000 0.000000 0.000000 Rb\n0.000000 0.000000 0.500000 Rb\n0.666668 0.333334 0.250000 Sn\n0.333334 0.666668 0.750000 Sn\n0.333334 0.666668 0.250000 I\n0.666668 0.333334 0.750000 I\n0.974893 0.369797 0.660766 O\n0.605097 0.630205 0.339234 O\n0.025109 0.630204 0.160766 O\n0.394904 0.025108 0.660766 O\n0.394905 0.369797 0.839234 O\n0.630204 0.025109 0.839234 O\n0.974893 0.605097 0.839234 O\n0.630205 0.605097 0.660766 O\n0.369797 0.394905 0.160766 O\n0.025108 0.394904 0.339234 O\n0.605097 0.974893 0.160766 O\n0.369797 0.974893 0.339234 O\n",
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{
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{
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"created_at": "2022-09-04T14:38:01.219770Z",
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]
}