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{
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{
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{
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"structure_string": "K4 Na4 P8 H8 O28\n1.0\n8.016953 0.000000 0.000000\n-0.009204 8.038917 0.000000\n-1.061223 -3.259395 10.956611\nK Na P H O\n4 4 8 8 28\ndirect\n0.222861 0.646878 0.436148 K\n0.777139 0.353122 0.563852 K\n0.339402 0.764904 0.063322 K\n0.660598 0.235096 0.936678 K\n0.667971 0.851443 0.420022 Na\n0.332029 0.148557 0.579978 Na\n0.123649 0.210322 0.076934 Na\n0.876351 0.789678 0.923066 Na\n0.448672 0.159062 0.293209 P\n0.551328 0.840938 0.706791 P\n0.783554 0.068588 0.210592 P\n0.216446 0.931412 0.789408 P\n0.852351 0.446997 0.286008 P\n0.147649 0.553003 0.713992 P\n0.491823 0.471026 0.209216 P\n0.508177 0.528974 0.790784 P\n0.191342 0.004282 0.346490 H\n0.808658 0.995718 0.653510 H\n0.023553 0.968361 0.390250 H\n0.976447 0.031639 0.609750 H\n0.010347 0.593477 0.119048 H\n0.989653 0.406523 0.880952 H\n0.958389 0.783444 0.158247 H\n0.041611 0.216556 0.841753 H\n0.579013 0.078286 0.191159 O\n0.420987 0.921714 0.808841 O\n0.833949 0.255851 0.309549 O\n0.166051 0.744149 0.690451 O\n0.690433 0.442540 0.187567 O\n0.309567 0.557460 0.812433 O\n0.466883 0.367863 0.311104 O\n0.533117 0.632137 0.688896 O\n0.278442 0.091950 0.231876 O\n0.721558 0.908050 0.768124 O\n0.508905 0.132217 0.413888 O\n0.491095 0.867783 0.586112 O\n0.845226 0.057932 0.089471 O\n0.154774 0.942068 0.910529 O\n0.828901 0.932939 0.274059 O\n0.171099 0.067061 0.725941 O\n0.833771 0.577710 0.405876 O\n0.166229 0.422290 0.594124 O\n0.005769 0.450361 0.220889 O\n0.994231 0.549639 0.779111 O\n0.464663 0.658514 0.271470 O\n0.535337 0.341486 0.728530 O\n0.395831 0.381068 0.089579 O\n0.604169 0.618932 0.910421 O\n0.144743 0.971410 0.413928 O\n0.855257 0.028590 0.586072 O\n0.012190 0.700146 0.092921 O\n0.987810 0.299854 0.907079 O\n",
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{
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"energy_per_atom": -8.516204968,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -310.81619872,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 29.9998223,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:36.986000Z",
"spacegroup": 167
}
]
}