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P\n0.868752 0.565538 0.689516 P\n0.905381 0.867570 0.831665 P\n0.405381 0.132430 0.668335 P\n0.094619 0.132430 0.168335 P\n0.594619 0.867570 0.331665 P\n0.949737 0.669094 0.805072 O\n0.449737 0.330906 0.694928 O\n0.050263 0.330906 0.194928 O\n0.550263 0.669094 0.305072 O\n0.736752 0.914128 0.255259 O\n0.236752 0.085872 0.244741 O\n0.263248 0.085872 0.744741 O\n0.763248 0.914128 0.755259 O\n0.576314 0.365900 0.236489 O\n0.076314 0.634100 0.263511 O\n0.423686 0.634100 0.763511 O\n0.923686 0.365900 0.736489 O\n0.590463 0.854850 0.503552 O\n0.090463 0.145150 0.996448 O\n0.409537 0.145150 0.496448 O\n0.909537 0.854850 0.003552 O\n0.604398 0.673183 0.021790 O\n0.104398 0.326817 0.478210 O\n0.395602 0.326817 0.978210 O\n0.895602 0.673183 0.521790 O\n0.496871 0.009303 0.226774 O\n0.996871 0.990697 0.273226 O\n0.503129 0.990697 0.773226 O\n0.003129 0.009303 0.726774 O\n0.781637 0.554774 0.244026 O\n0.281637 0.445226 0.255974 O\n0.218363 0.445226 0.755974 O\n0.718363 0.554774 0.744026 O\n","nsites":44,"nelements":4,"elements":["Rb","Mn","P","O"],"chemical_system":"Mn-O-P-Rb","density":3.322919414074234,"density_atomic":0.07002467150745956,"volume":628.3499665587548,"volume_molar":8.600027148086623,"formula_full":"Rb4 Mn4 P8 O28","formula_reduced":"RbMnP2O7","formula_anonymous":"ABC2D7","energy":-336.03154723,"energy_per_atom":-7.637080618863636,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-310.12354723,"band_gap":1.1481,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":16.0057146,"is_theoretical":false,"updated_at":"2021-11-28T01:34:49.544000Z","spacegroup":14}]}