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0.608783 0.220032 S\n0.388751 0.168718 0.779968 S\n0.390792 0.606085 0.784707 S\n0.821378 0.606085 0.215293 S\n","nsites":14,"nelements":4,"elements":["Cr","Cd","Se","S"],"chemical_system":"Cd-Cr-S-Se","density":4.53605581044868,"density_atomic":0.04883497936353917,"volume":286.67975665108156,"volume_molar":12.33161319710971,"formula_full":"Cr4 Cd2 Se2 S6","formula_reduced":"Cr2CdSeS3","formula_anonymous":"ABC2D3","energy":-85.45563989,"energy_per_atom":-6.103974277857143,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-81.49363989,"band_gap":0.4039999999999999,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":11.9998727,"is_theoretical":true,"updated_at":"2021-11-28T01:34:52.231000Z","spacegroup":44}]}