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{
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"formula_full": "K4 Mn6 V4 C2 O22",
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{
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"structure_string": "Ca8 Cr4 H12 I8 O40\n1.0\n7.488050 0.000000 0.000000\n0.000000 10.416891 0.000000\n0.000000 3.743142 13.279105\nCa Cr H I O\n8 4 12 8 40\ndirect\n0.238562 0.882467 0.516688 Ca\n0.761438 0.117533 0.483312 Ca\n0.738562 0.117533 0.983312 Ca\n0.261438 0.882467 0.016688 Ca\n0.059752 0.704728 0.789771 Ca\n0.940248 0.295272 0.210229 Ca\n0.559752 0.295272 0.710229 Ca\n0.440248 0.704728 0.289771 Ca\n0.288817 0.567614 0.572642 Cr\n0.711183 0.432386 0.427358 Cr\n0.788817 0.432386 0.927358 Cr\n0.211183 0.567614 0.072642 Cr\n0.489054 0.602888 0.851295 H\n0.510946 0.397112 0.148705 H\n0.989054 0.397112 0.648705 H\n0.010946 0.602888 0.351295 H\n0.463189 0.560334 0.719036 H\n0.536811 0.439666 0.280964 H\n0.963189 0.439666 0.780964 H\n0.036811 0.560334 0.219036 H\n0.398694 0.608569 0.824861 H\n0.601306 0.391431 0.175139 H\n0.898694 0.391431 0.675139 H\n0.101306 0.608569 0.324861 H\n0.733389 0.753535 0.568049 I\n0.266611 0.246465 0.431951 I\n0.233389 0.246465 0.931951 I\n0.766611 0.753535 0.068049 I\n0.705332 0.953861 0.769735 I\n0.294668 0.046139 0.230265 I\n0.205332 0.046139 0.730265 I\n0.794668 0.953861 0.269735 I\n0.790445 0.732569 0.701226 O\n0.209555 0.267431 0.298774 O\n0.290445 0.267431 0.798774 O\n0.709555 0.732569 0.201226 O\n0.903605 0.871823 0.501208 O\n0.096395 0.128177 0.498792 O\n0.403605 0.128177 0.998792 O\n0.596395 0.871823 0.001208 O\n0.210398 0.421330 0.569485 O\n0.789602 0.578670 0.430515 O\n0.710398 0.578670 0.930515 O\n0.289602 0.421330 0.069485 O\n0.904467 0.878010 0.839763 O\n0.095533 0.121990 0.160237 O\n0.404467 0.121990 0.660237 O\n0.595533 0.878010 0.339763 O\n0.150559 0.680949 0.963488 O\n0.849441 0.319051 0.036512 O\n0.650559 0.319051 0.536512 O\n0.349441 0.680949 0.463488 O\n0.945815 0.873724 0.063185 O\n0.054185 0.126276 0.936815 O\n0.445815 0.126276 0.436815 O\n0.554185 0.873724 0.563185 O\n0.186809 0.901116 0.679023 O\n0.813191 0.098884 0.320977 O\n0.686809 0.098884 0.820977 O\n0.313191 0.901116 0.179023 O\n0.157472 0.655413 0.636573 O\n0.842528 0.344587 0.363427 O\n0.657472 0.344587 0.863427 O\n0.342528 0.655413 0.136573 O\n0.489282 0.532730 0.657982 O\n0.510718 0.467270 0.342018 O\n0.989282 0.467270 0.842018 O\n0.010718 0.532730 0.157982 O\n0.312388 0.951351 0.845730 O\n0.687612 0.048649 0.154270 O\n0.812388 0.048649 0.654270 O\n0.187612 0.951351 0.345730 O\n",
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{
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"created_at": "2022-09-04T14:39:13.991766Z",
"structure_string": "K6 Sn8 Au2\n1.0\n6.666758 0.000000 0.000000\n0.000000 6.944967 0.000000\n0.000000 0.000000 12.883165\nK Sn Au\n6 8 2\ndirect\n0.558209 0.000000 0.000000 K\n0.441791 0.500000 0.500000 K\n0.828016 0.500000 0.746852 K\n0.828016 0.500000 0.253148 K\n0.171984 0.000000 0.753148 K\n0.171984 0.000000 0.246852 K\n0.332790 0.500000 0.878057 Sn\n0.332790 0.500000 0.121943 Sn\n0.040061 0.268299 0.000000 Sn\n0.040061 0.731701 0.000000 Sn\n0.959939 0.768299 0.500000 Sn\n0.959939 0.231701 0.500000 Sn\n0.667210 0.000000 0.378057 Sn\n0.667210 0.000000 0.621943 Sn\n0.687282 0.500000 0.000000 Au\n0.312718 0.000000 0.500000 Au\n",
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{
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