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{
"id": "mp-30021",
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{
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"structure_string": "Te12 I4 O12 F60\n1.0\n10.015222 0.000000 0.000000\n0.000000 10.681534 0.000000\n0.000000 0.483387 14.894266\nTe I O F\n12 4 12 60\ndirect\n0.280050 0.315260 0.554227 Te\n0.780050 0.184740 0.445773 Te\n0.157932 0.602410 0.210058 Te\n0.641897 0.625787 0.113626 Te\n0.719950 0.684740 0.445773 Te\n0.842068 0.397590 0.789942 Te\n0.657932 0.897590 0.789942 Te\n0.141897 0.874213 0.886374 Te\n0.358103 0.374213 0.886374 Te\n0.219950 0.815260 0.554227 Te\n0.858103 0.125787 0.113626 Te\n0.342068 0.102410 0.210058 Te\n0.474135 0.535998 0.308481 I\n0.025865 0.035998 0.308481 I\n0.974135 0.964002 0.691519 I\n0.525865 0.464002 0.691519 I\n0.187999 0.998911 0.228613 O\n0.534402 0.663271 0.220489 O\n0.657690 0.551885 0.375658 O\n0.965598 0.163271 0.220489 O\n0.465598 0.336729 0.779511 O\n0.157690 0.948115 0.624342 O\n0.842310 0.051885 0.375658 O\n0.034402 0.836729 0.779511 O\n0.687999 0.501089 0.771387 O\n0.342310 0.448115 0.624342 O\n0.312001 0.498911 0.228613 O\n0.812001 0.001089 0.771387 O\n0.074135 0.538176 0.314599 F\n0.856228 0.582401 0.492929 F\n0.108905 0.865933 0.454831 F\n0.084835 0.703910 0.593753 F\n0.835140 0.747398 0.355489 F\n0.452691 0.523514 0.903462 F\n0.008791 0.705261 0.190420 F\n0.923500 0.522260 0.856384 F\n0.765933 0.535518 0.184531 F\n0.981644 0.215148 0.042837 F\n0.230886 0.674085 0.104355 F\n0.234782 0.725494 0.868351 F\n0.491209 0.205261 0.190420 F\n0.891095 0.134067 0.545169 F\n0.574135 0.961824 0.685401 F\n0.730886 0.825915 0.895645 F\n0.047309 0.023514 0.903462 F\n0.508791 0.794739 0.809580 F\n0.782836 0.812211 0.518615 F\n0.518356 0.715148 0.042837 F\n0.356228 0.917599 0.507071 F\n0.664860 0.247398 0.355489 F\n0.244544 0.904577 0.987417 F\n0.734782 0.774506 0.131649 F\n0.643772 0.082401 0.492929 F\n0.584835 0.796090 0.406247 F\n0.765218 0.274506 0.131649 F\n0.744544 0.595423 0.012583 F\n0.335140 0.752602 0.644511 F\n0.231709 0.732680 0.277399 F\n0.164860 0.252602 0.644511 F\n0.265933 0.964482 0.815469 F\n0.391095 0.365933 0.454831 F\n0.425865 0.038176 0.314599 F\n0.255456 0.404577 0.987417 F\n0.547309 0.476486 0.096538 F\n0.991209 0.294739 0.809580 F\n0.143772 0.417599 0.507071 F\n0.734067 0.035518 0.184531 F\n0.018356 0.784852 0.957163 F\n0.915165 0.296090 0.406247 F\n0.217164 0.187789 0.481385 F\n0.076500 0.477740 0.143616 F\n0.282836 0.687789 0.481385 F\n0.423500 0.977740 0.143616 F\n0.768291 0.267320 0.722601 F\n0.717164 0.312211 0.518615 F\n0.234067 0.464482 0.815469 F\n0.769114 0.325915 0.895645 F\n0.952691 0.976486 0.096538 F\n0.415165 0.203910 0.593753 F\n0.731709 0.767320 0.722601 F\n0.265218 0.225494 0.868351 F\n0.269114 0.174085 0.104355 F\n0.925865 0.461824 0.685401 F\n0.481644 0.284852 0.957163 F\n0.755456 0.095423 0.012583 F\n0.576500 0.022260 0.856384 F\n0.268291 0.232680 0.277399 F\n0.608905 0.634067 0.545169 F\n",
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{
"id": "mp-984107",
"created_at": "2022-09-04T14:47:56.499327Z",
"structure_string": "K6 I2 O10\n1.0\n6.319490 0.000000 0.000000\n0.000000 6.319490 0.000000\n0.000000 0.000000 8.336736\nK I O\n6 2 10\ndirect\n0.000000 0.000000 0.500000 K\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.000000 K\n0.000000 0.500000 0.218412 K\n0.500000 0.000000 0.781588 K\n0.000000 0.500000 0.742530 I\n0.500000 0.000000 0.257470 I\n0.794311 0.294311 0.788612 O\n0.205689 0.705689 0.788612 O\n0.294311 0.205689 0.211388 O\n0.705689 0.794311 0.211388 O\n0.705689 0.205689 0.211388 O\n0.294311 0.794311 0.211388 O\n0.794311 0.705689 0.788612 O\n0.205689 0.294311 0.788612 O\n0.000000 0.500000 0.523788 O\n0.500000 0.000000 0.476212 O\n",
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"volume": 332.93550423983464,
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"formula_full": "K6 I2 O10",
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{
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"created_at": "2022-09-04T14:47:56.503480Z",
"structure_string": "Li3 Co4 O4 F3\n1.0\n-1.485606 1.485606 14.931477\n1.485606 -1.485606 14.931477\n1.485606 1.485606 -14.931477\nLi Co O F\n3 4 4 3\ndirect\n0.568706 0.568706 0.000000 Li\n0.431294 0.431294 0.000000 Li\n0.000000 0.000000 0.000000 Li\n0.140810 0.140810 0.000000 Co\n0.718286 0.718286 0.000000 Co\n0.281714 0.281714 0.000000 Co\n0.859190 0.859190 0.000000 Co\n0.641256 0.641256 0.000000 O\n0.212844 0.212844 0.000000 O\n0.787156 0.787156 0.000000 O\n0.358744 0.358744 0.000000 O\n0.066532 0.066532 0.000000 F\n0.933468 0.933468 0.000000 F\n0.500000 0.500000 0.000000 F\n",
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"formula_full": "Li3 Co4 O4 F3",
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{
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"created_at": "2022-09-04T14:47:56.510557Z",
"structure_string": "Tb6 Rh1 Br10\n1.0\n7.419623 0.000000 0.000000\n-2.464654 8.930845 0.000000\n-1.158806 -3.351043 8.591797\nTb Rh Br\n6 1 10\ndirect\n0.634273 0.860646 0.818880 Tb\n0.365727 0.139354 0.181120 Tb\n0.974111 0.299962 0.095193 Tb\n0.025889 0.700038 0.904807 Tb\n0.124306 0.045017 0.753803 Tb\n0.875694 0.954983 0.246197 Tb\n0.000000 0.000000 0.000000 Rh\n0.640737 0.541795 0.726082 Br\n0.359263 0.458205 0.273918 Br\n0.548419 0.175066 0.915356 Br\n0.451581 0.824934 0.084644 Br\n0.207731 0.739934 0.650084 Br\n0.792269 0.260066 0.349916 Br\n0.085958 0.370077 0.828960 Br\n0.914042 0.629923 0.171040 Br\n0.748191 0.916337 0.541892 Br\n0.251809 0.083663 0.458108 Br\n",
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{
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{
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"structure_string": "Ca1 Y2 Fe4 O8\n1.0\n5.338732 -0.075907 3.853569\n1.648814 5.084635 3.838201\n0.180979 0.138986 7.467695\nCa Y Fe O\n1 2 4 8\ndirect\n0.500000 0.500000 0.500000 Ca\n0.721577 0.721707 0.577323 Y\n0.278423 0.278293 0.422677 Y\n0.000000 0.500000 0.000000 Fe\n0.000000 0.000000 0.000000 Fe\n0.500000 0.000000 0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.292933 0.824686 0.662341 O\n0.228624 0.229322 0.803437 O\n0.176209 0.707118 0.337366 O\n0.239360 0.239757 0.173937 O\n0.771376 0.770678 0.196563 O\n0.707067 0.175314 0.337659 O\n0.823791 0.292882 0.662634 O\n0.760640 0.760243 0.826063 O\n",
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{
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"structure_string": "Pr10 Sn20 Rh8\n1.0\n14.273749 0.000000 0.000000\n0.000000 14.273749 0.000000\n0.000000 0.000000 4.655361\nPr Sn Rh\n10 20 8\ndirect\n0.500000 0.500000 0.000000 Pr\n0.000000 0.000000 0.000000 Pr\n0.677948 0.177948 0.500000 Pr\n0.322052 0.822052 0.500000 Pr\n0.177948 0.322052 0.500000 Pr\n0.822052 0.677948 0.500000 Pr\n0.887981 0.387981 0.500000 Pr\n0.112019 0.612019 0.500000 Pr\n0.387981 0.112019 0.500000 Pr\n0.612019 0.887981 0.500000 Pr\n0.569351 0.069351 0.000000 Sn\n0.430649 0.930649 0.000000 Sn\n0.069351 0.430649 0.000000 Sn\n0.930649 0.569351 0.000000 Sn\n0.654098 0.697587 0.000000 Sn\n0.345902 0.302413 0.000000 Sn\n0.154098 0.802413 0.000000 Sn\n0.845902 0.197587 0.000000 Sn\n0.302413 0.654098 0.000000 Sn\n0.697587 0.345902 0.000000 Sn\n0.197587 0.154098 0.000000 Sn\n0.802413 0.845902 0.000000 Sn\n0.663761 0.504927 0.500000 Sn\n0.336239 0.495073 0.500000 Sn\n0.163761 0.995073 0.500000 Sn\n0.836239 0.004927 0.500000 Sn\n0.495073 0.663761 0.500000 Sn\n0.504927 0.336239 0.500000 Sn\n0.004927 0.163761 0.500000 Sn\n0.995073 0.836239 0.500000 Sn\n0.746248 0.527638 0.000000 Rh\n0.253752 0.472362 0.000000 Rh\n0.246248 0.972362 0.000000 Rh\n0.753752 0.027638 0.000000 Rh\n0.472362 0.746248 0.000000 Rh\n0.527638 0.253752 0.000000 Rh\n0.027638 0.246248 0.000000 Rh\n0.972362 0.753752 0.000000 Rh\n",
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{
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{
"id": "mp-755057",
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"structure_string": "Rb4 Pr2 O6\n1.0\n3.769061 -5.732614 0.000000\n3.769061 5.732614 0.000000\n0.000000 0.000000 6.581137\nRb Pr O\n4 2 6\ndirect\n0.812793 0.477123 0.266590 Rb\n0.522877 0.187207 0.766590 Rb\n0.187207 0.522877 0.766590 Rb\n0.477123 0.812793 0.266590 Rb\n0.102008 0.102008 0.237573 Pr\n0.897992 0.897992 0.737573 Pr\n0.852313 0.114069 0.999039 O\n0.885931 0.147687 0.499039 O\n0.608524 0.608524 0.671170 O\n0.391476 0.391476 0.171170 O\n0.114069 0.852313 0.999039 O\n0.147687 0.885931 0.499039 O\n",
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}
]
}