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{
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"structure_string": "Mn2 Nb6 S12\n1.0\n2.921146 -5.059573 0.000000\n2.921146 5.059573 -0.000000\n-0.000000 0.000000 12.297703\nMn Nb S\n2 6 12\ndirect\n0.666668 0.333334 0.250000 Mn\n0.333334 0.666668 0.750000 Mn\n0.333334 0.666668 0.498786 Nb\n0.666668 0.333334 0.998786 Nb\n0.666668 0.333334 0.501214 Nb\n0.333334 0.666668 0.001214 Nb\n0.000000 0.000000 0.500000 Nb\n0.000000 0.000000 0.000000 Nb\n0.330040 0.997367 0.128415 S\n0.332674 0.330040 0.628415 S\n0.669961 0.002635 0.628415 S\n0.330040 0.332674 0.371585 S\n0.667328 0.997367 0.371585 S\n0.669962 0.667328 0.871585 S\n0.002635 0.669961 0.371585 S\n0.997367 0.330040 0.871585 S\n0.002634 0.332673 0.128415 S\n0.332673 0.002634 0.871585 S\n0.667328 0.669962 0.128415 S\n0.997367 0.667328 0.628415 S\n",
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{
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"structure_string": "Mg2 H4 C6 O8\n1.0\n4.440735 -0.037821 1.678400\n1.331792 6.028754 1.676769\n-0.001991 0.000378 6.706179\nMg H C O\n2 4 6 8\ndirect\n0.976410 0.808150 0.434352 Mg\n0.976410 0.808150 0.934351 Mg\n0.265609 0.346202 0.471121 H\n0.265606 0.346203 0.971120 H\n0.687114 0.270063 0.384757 H\n0.687111 0.270063 0.884759 H\n0.476364 0.308134 0.838107 C\n0.476366 0.308133 0.338106 C\n0.454382 0.098589 0.781192 C\n0.498356 0.517685 0.665418 C\n0.498356 0.517684 0.165418 C\n0.454382 0.098589 0.281192 C\n0.245674 0.658281 0.156376 O\n0.760156 0.549499 0.049500 O\n0.760157 0.549499 0.549502 O\n0.192584 0.066816 0.312026 O\n0.192583 0.066817 0.812026 O\n0.707045 0.957955 0.216154 O\n0.707045 0.957957 0.716154 O\n0.245675 0.658281 0.656375 O\n",
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{
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"updated_at": "2022-09-04T14:37:03.941249Z",
"structure_string": "Cu4 Se12 Br4\n1.0\n4.597282 0.000000 0.000000\n0.000000 7.680839 0.000000\n0.000000 0.000000 14.525178\nCu Se Br\n4 12 4\ndirect\n0.802047 0.749995 0.757526 Cu\n0.197953 0.250005 0.757526 Cu\n0.197953 0.249995 0.257526 Cu\n0.802047 0.750005 0.257526 Cu\n0.901194 0.350564 0.132862 Se\n0.098762 0.649447 0.882247 Se\n0.098762 0.850554 0.382247 Se\n0.901238 0.350553 0.882247 Se\n0.168524 0.273376 0.507560 Se\n0.901238 0.149447 0.382247 Se\n0.831475 0.773377 0.007560 Se\n0.168524 0.226624 0.007560 Se\n0.831475 0.726624 0.507560 Se\n0.098805 0.850565 0.632862 Se\n0.901194 0.149436 0.632862 Se\n0.098805 0.649436 0.132862 Se\n0.500000 0.000000 0.192900 Br\n0.500000 0.500000 0.322210 Br\n0.500000 0.000000 0.822210 Br\n0.500000 0.500000 0.692900 Br\n",
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{
"id": "jvasp-55758",
"created_at": "2022-09-04T14:36:52.001697Z",
"updated_at": "2022-09-04T14:36:52.001715Z",
"structure_string": "Co4 Se4 O12\n1.0\n5.062615 -0.000000 0.000000\n-0.000000 5.919114 0.000000\n0.000000 0.000000 7.525417\nCo Se O\n4 4 12\ndirect\n0.000000 0.500000 0.500000 Co\n0.500000 0.000000 0.500000 Co\n0.500000 0.000000 0.000000 Co\n0.000000 0.500000 0.000000 Co\n0.017738 0.983110 0.750000 Se\n0.517737 0.516888 0.250000 Se\n0.482262 0.483111 0.750000 Se\n0.982261 0.016889 0.250000 Se\n0.826141 0.433426 0.750000 O\n0.326142 0.066574 0.250000 O\n0.863377 0.186143 0.073565 O\n0.363377 0.313856 0.926435 O\n0.636622 0.686143 0.426435 O\n0.363377 0.313856 0.573565 O\n0.136622 0.813856 0.926435 O\n0.636622 0.686143 0.073565 O\n0.673857 0.933426 0.750000 O\n0.863377 0.186143 0.426435 O\n0.136622 0.813856 0.573565 O\n0.173858 0.566573 0.250000 O\n",
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{
"id": "jvasp-103940",
"created_at": "2022-09-04T14:36:51.748268Z",
"updated_at": "2022-09-04T14:36:51.748278Z",
"structure_string": "Mg2 H4 C6 O8\n1.0\n4.430871 0.003373 -1.560805\n-0.597716 5.623625 -1.682741\n-0.032265 -0.019033 6.977235\nMg H C O\n2 4 6 8\ndirect\n0.522574 0.482781 0.185362 Mg\n0.030327 0.982790 0.185360 Mg\n0.847332 0.511885 0.715282 H\n0.937631 0.812336 0.694732 H\n0.124640 0.312323 0.694720 H\n0.235547 0.011894 0.715283 H\n0.171621 0.826060 0.698703 C\n0.894630 0.326050 0.698702 C\n0.400785 0.789520 0.896471 C\n0.183348 0.699819 0.479697 C\n0.663879 0.199817 0.479698 C\n0.863226 0.289518 0.896478 C\n0.406677 0.110598 0.454532 O\n0.743969 0.213605 0.321745 O\n0.415356 0.610591 0.454527 O\n0.610955 0.319531 0.920292 O\n0.676872 0.819533 0.920272 O\n0.097308 0.243844 0.038475 O\n0.308700 0.743837 0.038478 O\n0.945315 0.713605 0.321745 O\n",
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},
{
"id": "jvasp-55320",
"created_at": "2022-09-04T14:36:51.936999Z",
"updated_at": "2022-09-04T14:36:51.937023Z",
"structure_string": "Ca2 Fe2 Si4 O12\n1.0\n5.114136 -0.137438 1.070761\n1.258324 6.546833 0.619812\n-0.183744 0.182021 6.690417\nCa Fe Si O\n2 2 4 12\ndirect\n0.750001 0.303227 0.696772 Ca\n0.250000 0.696772 0.303228 Ca\n0.750000 0.918229 0.081771 Fe\n0.250001 0.081771 0.918230 Fe\n0.268240 0.192788 0.385828 Si\n0.768240 0.385828 0.192788 Si\n0.731761 0.807211 0.614172 Si\n0.231761 0.614171 0.807212 Si\n-0.014338 0.624947 0.672269 O\n0.014339 0.375052 0.327732 O\n0.828933 0.886565 0.382224 O\n0.671067 0.617775 0.113434 O\n0.846388 0.217208 0.027503 O\n0.328934 0.382224 0.886566 O\n0.514339 0.327731 0.375052 O\n0.153613 0.782791 0.972497 O\n0.346388 0.027503 0.217208 O\n0.653613 0.972496 0.782792 O\n0.171068 0.113434 0.617776 O\n0.485662 0.672268 0.624948 O\n",
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{
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"created_at": "2022-09-04T14:36:51.920933Z",
"updated_at": "2022-09-04T14:36:51.920959Z",
"structure_string": "Zn4 Ni2 W2 O12\n1.0\n0.000000 5.171336 0.005980\n5.201082 0.000000 0.000000\n0.000000 -5.036947 -7.692705\nZn Ni W O\n4 2 2 12\ndirect\n0.260552 0.965373 0.253543 Zn\n0.739448 0.465374 0.246457 Zn\n0.739448 0.034626 0.746456 Zn\n0.260551 0.534626 0.753543 Zn\n0.500000 0.000000 -0.000000 Ni\n0.500000 0.500000 0.500000 Ni\n-0.000001 0.000000 0.500000 W\n0.000000 0.500000 0.000000 W\n0.643187 0.079729 0.261293 O\n0.356813 0.579729 0.238707 O\n0.737987 0.673989 0.057131 O\n0.262013 0.173990 0.442869 O\n0.262013 0.326010 0.942868 O\n0.913045 0.185497 0.075111 O\n0.086954 0.814502 0.924888 O\n0.913045 0.314503 0.575111 O\n0.356812 0.920271 0.738706 O\n0.086955 0.685497 0.424888 O\n0.737986 0.826010 0.557131 O\n0.643187 0.420271 0.761293 O\n",
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{
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"created_at": "2022-09-04T14:37:04.396180Z",
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"structure_string": "Pr4 Rh4 O12\n1.0\n5.423285 0.000000 0.000000\n0.000000 5.876873 0.000000\n0.000000 0.000000 7.865688\nPr Rh O\n4 4 12\ndirect\n0.476490 0.574456 0.750000 Pr\n0.976490 0.925544 0.250000 Pr\n0.023511 0.074456 0.750000 Pr\n0.523511 0.425544 0.250000 Pr\n0.500000 0.000000 0.500000 Rh\n0.000000 0.500000 0.500000 Rh\n0.000000 0.500000 0.000000 Rh\n0.500000 0.000000 0.000000 Rh\n0.893658 0.468246 0.750000 O\n0.393658 0.031754 0.250000 O\n0.813591 0.197247 0.051607 O\n0.313591 0.302752 0.948393 O\n0.686410 0.697247 0.448393 O\n0.313591 0.302752 0.551607 O\n0.186410 0.802752 0.948393 O\n0.686410 0.697247 0.051607 O\n0.106343 0.531754 0.250000 O\n0.813591 0.197247 0.448393 O\n0.186410 0.802752 0.551607 O\n0.606343 0.968245 0.750000 O\n",
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{
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"structure_string": "Ag10 Sb2 S8\n1.0\n7.321709 0.018803 0.000000\n-3.157197 6.606049 -0.000000\n-0.000000 -0.000000 8.785371\nAg Sb S\n10 2 8\ndirect\n0.559448 0.804966 0.488909 Ag\n0.868574 0.744810 0.669288 Ag\n0.440552 0.195034 0.988909 Ag\n0.857615 0.142385 0.831818 Ag\n0.142385 0.857615 0.331818 Ag\n0.255190 0.131426 0.669288 Ag\n0.744809 0.868574 0.169288 Ag\n0.195034 0.440552 0.488909 Ag\n0.131426 0.255190 0.169288 Ag\n0.804966 0.559448 0.988909 Ag\n0.325841 0.674159 0.898569 Sb\n0.674159 0.325841 0.398569 Sb\n0.499628 0.967407 0.725684 S\n0.500372 0.032593 0.225684 S\n0.028814 0.971186 0.978606 S\n0.971185 0.028814 0.478606 S\n0.516052 0.483948 0.797747 S\n0.483948 0.516052 0.297747 S\n0.032593 0.500372 0.725684 S\n0.967407 0.499628 0.225684 S\n",
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{
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"updated_at": "2022-09-04T14:36:44.956222Z",
"structure_string": "Sr4 Lu2 Bi2 O12\n1.0\n0.000000 5.891334 0.002603\n5.998500 0.000000 0.000000\n0.000000 -5.881086 -8.384524\nSr Lu Bi O\n4 2 2 12\ndirect\n0.239679 0.542923 0.250078 Sr\n0.760320 0.042923 0.249922 Sr\n0.239679 0.957077 0.750078 Sr\n0.760319 0.457077 0.749922 Sr\n0.500000 0.500000 0.000000 Lu\n0.499999 0.000000 0.500000 Lu\n0.000000 0.000000 0.000000 Bi\n-0.000001 0.500000 0.500000 Bi\n0.663103 0.470570 0.252579 O\n0.336897 0.970570 0.247421 O\n0.155035 0.709570 0.952312 O\n0.844963 0.209570 0.547688 O\n0.844963 0.290430 0.047688 O\n0.755774 0.794502 0.047033 O\n0.244224 0.205498 0.952967 O\n0.755774 0.705498 0.547033 O\n0.663102 0.029430 0.752579 O\n0.244225 0.294502 0.452967 O\n0.155036 0.790430 0.452312 O\n0.336896 0.529430 0.747421 O\n",
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"structure_string": "Ca4 Ti4 O12\n1.0\n5.387806 -0.000000 0.000000\n-0.000000 5.490889 0.000000\n0.000000 0.000000 7.667134\nCa Ti O\n4 4 12\ndirect\n0.990649 0.044368 0.250000 Ca\n0.490648 0.455632 0.750000 Ca\n0.509352 0.544368 0.250000 Ca\n0.009352 0.955632 0.750000 Ca\n0.500000 0.000000 0.000000 Ti\n0.000000 0.500000 0.000000 Ti\n0.000000 0.500000 0.500000 Ti\n0.500000 0.000000 0.500000 Ti\n0.207898 0.208742 0.958271 O\n0.707898 0.291258 0.041728 O\n0.292103 0.708742 0.958271 O\n0.792103 0.791258 0.041728 O\n0.207898 0.208742 0.541728 O\n0.420430 0.979893 0.250000 O\n0.079570 0.479893 0.250000 O\n0.579570 0.020107 0.750000 O\n0.292103 0.708742 0.541728 O\n0.920431 0.520107 0.750000 O\n0.707898 0.291258 0.458272 O\n0.792103 0.791258 0.458272 O\n",
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{
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}
]
}