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"id": "jvasp-92193",
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"structure_string": "Rb1 Y1 Mg6\n1.0\n7.019341 -0.000253 0.000000\n-3.509889 6.078801 0.000000\n0.000000 0.000000 5.339966\nRb Y Mg\n1 1 6\ndirect\n0.416651 0.083349 0.750001 Rb\n0.083334 0.416666 0.250000 Y\n0.049730 0.899867 0.250000 Mg\n0.600132 0.450270 0.250000 Mg\n0.600170 0.899830 0.250000 Mg\n0.414207 0.582159 0.750001 Mg\n0.917841 0.085793 0.750001 Mg\n0.917933 0.582068 0.750001 Mg\n",
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{
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"structure_string": "Li2 Co2 P4 O14\n1.0\n6.119144 0.023011 0.443103\n0.679033 5.630615 2.433019\n0.050953 0.005644 6.621808\nLi Co P O\n2 2 4 14\ndirect\n0.016040 0.712858 0.822384 Li\n0.983958 0.287142 0.177616 Li\n0.637481 0.087084 0.788994 Co\n0.362517 0.912916 0.211007 Co\n0.595733 0.651661 0.654662 P\n0.874212 0.782268 0.235775 P\n0.125786 0.217732 0.764225 P\n0.404266 0.348339 0.345338 P\n0.613155 0.213430 0.474915 O\n0.042393 0.937973 0.252395 O\n0.787994 0.638988 0.477672 O\n0.212004 0.361012 0.522328 O\n0.037947 0.391260 0.862927 O\n0.962052 0.608740 0.137073 O\n0.319127 0.225521 0.211862 O\n0.680872 0.774479 0.788138 O\n0.386844 0.786570 0.525086 O\n0.333529 0.040281 0.883635 O\n0.423134 0.606041 0.195431 O\n0.576865 0.393959 0.804569 O\n0.957606 0.062027 0.747605 O\n0.666469 0.959719 0.116365 O\n",
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{
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"updated_at": "2022-09-04T14:36:21.978706Z",
"structure_string": "Ba4 Zr1 Pt1\n1.0\n-0.000000 4.847654 4.847654\n4.847654 -0.000000 4.847654\n4.847654 4.847654 -0.000000\nBa Zr Pt\n4 1 1\ndirect\n0.127393 0.624201 0.624201 Ba\n0.624201 0.624201 0.624201 Ba\n0.624201 0.127393 0.624201 Ba\n0.624201 0.624201 0.127393 Ba\n0.000000 0.000000 0.000000 Zr\n0.250000 0.250000 0.250000 Pt\n",
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{
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"updated_at": "2022-09-04T14:38:44.666170Z",
"structure_string": "H9 C13 S1 N1\n1.0\n3.576739 0.399095 -0.778507\n-1.124506 5.629725 0.228447\n-0.557361 0.301893 11.188456\nH C S N\n9 13 1 1\ndirect\n0.968465 0.085995 0.845197 H\n0.927548 0.127794 0.411808 H\n0.250964 0.279473 0.014523 H\n0.136553 0.800371 0.583768 H\n0.354521 0.859505 0.222654 H\n0.398511 0.803890 0.807434 H\n0.522729 0.791139 0.449293 H\n0.708564 0.082838 0.620381 H\n0.747525 0.191075 0.185985 H\n0.690499 0.322736 0.242695 C\n0.862866 0.241545 0.660196 C\n0.790654 0.285770 0.371314 C\n0.008088 0.243099 0.787633 C\n0.496580 0.602163 0.054346 C\n0.548240 0.534497 0.188028 C\n0.095708 0.642588 0.640723 C\n0.748132 0.457342 0.448215 C\n0.199851 0.446198 0.843178 C\n0.483486 0.700481 0.264703 C\n0.578831 0.661220 0.391698 C\n0.246632 0.646590 0.767384 C\n0.899855 0.442884 0.583687 C\n0.665712 0.871061 0.017263 S\n0.322786 0.436655 0.974021 N\n",
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"created_at": "2022-09-04T14:35:48.396340Z",
"updated_at": "2022-09-04T14:35:48.396355Z",
"structure_string": "Pr3 Mg3 Ag3\n1.0\n0.000000 0.000000 -4.309903\n-3.906186 -6.765712 0.000000\n-3.906454 6.765866 0.000000\nPr Mg Ag\n3 3 3\ndirect\n0.500000 0.585008 0.000000 Pr\n0.500000 0.414974 0.414987 Pr\n0.500000 -0.000012 0.585013 Pr\n0.000000 0.240026 0.000000 Mg\n0.000000 0.759955 0.759965 Mg\n0.000000 0.999991 0.240036 Mg\n0.000000 0.333318 0.666666 Ag\n0.000000 0.666651 0.333335 Ag\n0.500000 -0.000014 -0.000000 Ag\n",
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{
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"structure_string": "H18 C12\n1.0\n5.100302 0.029966 -0.723876\n-1.377816 5.717869 -1.395202\n-0.026743 -0.015563 7.808125\nH C\n18 12\ndirect\n0.474811 0.313519 0.034104 H\n0.760988 0.103571 0.215487 H\n0.239011 0.896431 0.784514 H\n0.665443 0.954053 0.374878 H\n0.970457 0.170100 0.428460 H\n0.029543 0.829901 0.571541 H\n0.824624 0.378922 0.876829 H\n0.175375 0.621079 0.123171 H\n0.081902 0.423826 0.751071 H\n0.334557 0.045948 0.625122 H\n0.845798 0.152888 0.693662 H\n0.154202 0.847114 0.306339 H\n0.652714 0.937639 0.897057 H\n0.347286 0.062362 0.102944 H\n0.861984 0.747326 0.934882 H\n0.138016 0.252675 0.065119 H\n0.525189 0.686482 0.965896 H\n0.918098 0.576175 0.248929 H\n0.867861 0.342240 0.740967 C\n0.132139 0.657761 0.259034 C\n0.656052 0.753148 0.880049 C\n0.343948 0.246853 0.119952 C\n0.618173 0.314604 0.431307 C\n0.568909 0.617241 0.684393 C\n0.681626 0.428025 0.616323 C\n0.318374 0.571977 0.383678 C\n0.431091 0.382760 0.315608 C\n0.240498 0.874476 0.641446 C\n0.381826 0.685397 0.568693 C\n0.759502 0.125525 0.358555 C\n",
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{
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"created_at": "2022-09-04T14:38:47.978520Z",
"updated_at": "2022-09-04T14:38:47.978541Z",
"structure_string": "W4 C6 N12\n1.0\n2.912992 0.000426 -10.327724\n4.371588 2.521936 -0.000001\n0.002297 -0.003982 30.982092\nW C N\n4 6 12\ndirect\n0.000121 0.999958 0.166724 W\n0.000121 0.999923 0.666724 W\n0.999876 0.000056 0.833293 W\n0.999876 0.000069 0.333293 W\n0.007039 0.664259 0.085700 C\n-0.000006 0.664353 0.750007 C\n0.992959 0.671299 0.414318 C\n0.007040 0.328702 0.585700 C\n0.992959 0.335744 0.914318 C\n-0.000005 0.335654 0.250008 C\n0.028180 0.662903 0.386321 N\n0.017093 0.337064 0.549314 N\n0.954918 0.354025 0.195244 N\n0.028180 0.308918 0.886321 N\n0.045074 0.308933 0.304772 N\n0.971814 0.691098 0.113696 N\n0.971814 0.337089 0.613696 N\n0.982906 0.662950 0.450705 N\n0.045074 0.645995 0.804772 N\n0.017092 0.645846 0.049314 N\n0.982907 0.354144 0.950705 N\n0.954917 0.691058 0.695244 N\n",
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{
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"created_at": "2022-09-04T14:35:59.470533Z",
"updated_at": "2022-09-04T14:35:59.470559Z",
"structure_string": "Ba4 Te1 Ru1\n1.0\n0.000000 4.847277 4.847277\n4.847277 0.000000 4.847277\n4.847277 4.847277 0.000000\nBa Te Ru\n4 1 1\ndirect\n0.125944 0.624686 0.624686 Ba\n0.624686 0.624686 0.624686 Ba\n0.624686 0.125944 0.624686 Ba\n0.624686 0.624686 0.125944 Ba\n0.000000 0.000000 0.000000 Te\n0.250000 0.250000 0.250000 Ru\n",
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}