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{
"id": "mp-753611",
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{
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"structure_string": "Al8 W12 O48\n1.0\n9.222542 0.000000 0.000000\n0.000000 9.311044 0.000000\n0.000000 0.000000 12.892639\nAl W O\n8 12 48\ndirect\n0.001601 0.217384 0.882418 Al\n0.498259 0.217407 0.619702 Al\n0.501741 0.282593 0.119702 Al\n0.998399 0.282616 0.382418 Al\n0.501741 0.717407 0.880298 Al\n0.001601 0.782616 0.117582 Al\n0.498259 0.782593 0.380298 Al\n0.998399 0.717384 0.617582 Al\n0.145106 0.133022 0.145701 W\n0.642528 0.134622 0.356646 W\n0.854894 0.633022 0.354299 W\n0.223348 0.000000 0.500000 W\n0.642528 0.865378 0.643354 W\n0.145106 0.866978 0.854299 W\n0.776652 0.500000 0.000000 W\n0.854894 0.366978 0.645701 W\n0.357472 0.634622 0.143354 W\n0.274122 0.500000 0.500000 W\n0.725878 0.000000 0.000000 W\n0.357472 0.365378 0.856646 W\n0.336636 0.092670 0.593640 O\n0.564867 0.244688 0.255144 O\n0.436118 0.684739 0.020587 O\n0.435133 0.744688 0.244856 O\n0.158997 0.589416 0.594836 O\n0.107842 0.126838 0.434367 O\n0.393167 0.555070 0.834193 O\n0.563882 0.815261 0.520587 O\n0.841003 0.910584 0.094836 O\n0.383459 0.629242 0.431068 O\n0.563882 0.184739 0.479413 O\n0.163364 0.660372 0.138216 O\n0.338630 0.837381 0.856920 O\n0.892158 0.373162 0.934367 O\n0.060785 0.760511 0.753743 O\n0.939215 0.739489 0.253743 O\n0.435133 0.255312 0.755144 O\n0.663364 0.407330 0.093640 O\n0.888915 0.443198 0.334333 O\n0.606833 0.055070 0.665807 O\n0.068597 0.818472 0.978022 O\n0.841003 0.089416 0.905164 O\n0.836636 0.839628 0.638216 O\n0.892158 0.626838 0.065633 O\n0.661370 0.662619 0.356920 O\n0.888915 0.556802 0.665667 O\n0.163364 0.339628 0.861784 O\n0.393167 0.444930 0.165807 O\n0.931403 0.681528 0.478022 O\n0.111085 0.943198 0.165667 O\n0.564867 0.755312 0.744856 O\n0.836636 0.160372 0.361784 O\n0.107842 0.873162 0.565633 O\n0.939215 0.260511 0.746257 O\n0.931403 0.318472 0.521978 O\n0.158997 0.410584 0.405164 O\n0.436118 0.315261 0.979413 O\n0.111085 0.056802 0.834333 O\n0.661370 0.337381 0.643080 O\n0.060785 0.239489 0.246257 O\n0.616541 0.129242 0.068932 O\n0.068597 0.181528 0.021978 O\n0.336636 0.907330 0.406360 O\n0.338630 0.162619 0.143080 O\n0.616541 0.870758 0.931068 O\n0.383459 0.370758 0.568932 O\n0.606833 0.944930 0.334193 O\n0.663364 0.592670 0.906360 O\n",
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"formula_full": "Al8 W12 O48",
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{
"id": "mp-771195",
"created_at": "2022-09-04T14:40:28.753518Z",
"structure_string": "Na10 Ni4 As2 C8 O32\n1.0\n7.082823 7.016675 0.000000\n-7.082823 7.016675 0.000000\n0.000000 6.962109 7.040026\nNa Ni As C O\n10 4 2 8 32\ndirect\n0.903743 0.648374 0.762967 Na\n0.649793 0.904741 0.682879 Na\n0.648374 0.903743 0.262967 Na\n0.904741 0.649793 0.182879 Na\n0.910443 0.089557 0.750000 Na\n0.089557 0.910443 0.250000 Na\n0.095259 0.350207 0.817121 Na\n0.351626 0.096257 0.737033 Na\n0.350207 0.095259 0.317121 Na\n0.096257 0.351626 0.237033 Na\n0.500000 0.000000 0.000000 Ni\n0.500000 0.500000 0.000000 Ni\n0.500000 0.500000 0.500000 Ni\n0.000000 0.500000 0.500000 Ni\n0.127148 0.872852 0.750000 As\n0.872852 0.127148 0.250000 As\n0.713904 0.286251 0.925791 C\n0.717518 0.643191 0.568392 C\n0.356809 0.282482 0.931608 C\n0.713749 0.286096 0.574209 C\n0.286251 0.713904 0.425791 C\n0.643191 0.717518 0.068392 C\n0.286096 0.713749 0.074209 C\n0.282482 0.356809 0.431608 C\n0.647115 0.860290 0.952430 O\n0.691841 0.646921 0.707709 O\n0.857244 0.398445 0.790185 O\n0.404227 0.687099 0.965418 O\n0.860290 0.647115 0.452430 O\n0.337302 0.953687 0.606065 O\n0.055996 0.943059 0.892653 O\n0.605404 0.645679 0.538708 O\n0.689920 0.141668 0.958962 O\n0.354321 0.394596 0.961292 O\n0.858332 0.310080 0.541038 O\n0.056941 0.944004 0.607347 O\n0.046313 0.662698 0.893935 O\n0.398445 0.857244 0.290185 O\n0.646921 0.691841 0.207709 O\n0.687099 0.404227 0.465418 O\n0.312901 0.595773 0.534582 O\n0.353079 0.308159 0.792291 O\n0.601555 0.142756 0.709815 O\n0.943059 0.055996 0.392653 O\n0.953687 0.337302 0.106065 O\n0.141668 0.689920 0.458962 O\n0.645679 0.605404 0.038708 O\n0.310080 0.858332 0.041038 O\n0.394596 0.354321 0.461292 O\n0.944004 0.056941 0.107347 O\n0.662698 0.046313 0.393935 O\n0.139710 0.352885 0.547570 O\n0.595773 0.312901 0.034582 O\n0.308159 0.353079 0.292291 O\n0.142756 0.601555 0.209815 O\n0.352885 0.139710 0.047570 O\n",
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"formula_full": "Na10 Ni4 As2 C8 O32",
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{
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"created_at": "2022-09-04T14:40:28.767411Z",
"structure_string": "Nd4 Sc4 S12\n1.0\n6.515513 0.000000 0.000000\n0.000000 7.170134 0.000000\n0.000000 0.000000 9.609433\nNd Sc S\n4 4 12\ndirect\n0.537867 0.402607 0.750000 Nd\n0.462133 0.597393 0.250000 Nd\n0.037867 0.097393 0.250000 Nd\n0.962133 0.902607 0.750000 Nd\n0.000000 0.500000 0.000000 Sc\n0.000000 0.500000 0.500000 Sc\n0.500000 0.000000 0.500000 Sc\n0.500000 0.000000 0.000000 Sc\n0.821850 0.188440 0.562515 S\n0.178150 0.811560 0.062515 S\n0.321850 0.311560 0.062515 S\n0.678150 0.688440 0.562515 S\n0.821850 0.188440 0.937485 S\n0.178150 0.811560 0.437485 S\n0.321850 0.311560 0.437485 S\n0.678150 0.688440 0.937485 S\n0.871298 0.462698 0.250000 S\n0.128702 0.537302 0.750000 S\n0.371298 0.037302 0.750000 S\n0.628702 0.962698 0.250000 S\n",
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{
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"structure_string": "Ce4 Mg2 Se8\n1.0\n-4.312669 4.312669 4.626343\n4.312669 -4.312669 4.626343\n4.312669 4.312669 -4.626343\nCe Mg Se\n4 2 8\ndirect\n0.875000 0.754962 0.379962 Ce\n0.504962 0.125000 0.879962 Ce\n0.375000 0.495038 0.620038 Ce\n0.245038 0.625000 0.120038 Ce\n0.000000 0.000000 0.000000 Mg\n0.750000 0.250000 0.500000 Mg\n0.504073 0.376277 0.267482 Se\n0.763409 0.495927 0.872204 Se\n0.108794 0.236591 0.732518 Se\n0.623723 0.891206 0.127796 Se\n0.245927 0.013409 0.372204 Se\n0.986591 0.358794 0.232518 Se\n0.641206 0.873723 0.627796 Se\n0.126277 0.754073 0.767482 Se\n",
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}