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0.000000 0.750322 I\n0.666668 0.333333 0.832987 I\n0.333334 0.666668 0.083706 I\n0.333334 0.666668 0.583636 I\n0.666668 0.333333 0.166364 I\n","nsites":18,"nelements":2,"elements":["Cd","I"],"chemical_system":"Cd-I","density":5.556027034012476,"density_atomic":0.02740908390467587,"volume":656.7165857348949,"volume_molar":21.97133177067859,"formula_full":"Cd6 I12","formula_reduced":"CdI2","formula_anonymous":"AB2","energy_above_hull":0.0001066666666666,"spacegroup":156},{"id":"jvasp-115539","created_at":"2022-09-04T14:38:44.828113Z","updated_at":"2022-09-04T14:38:44.828132Z","structure_string":"Ba1 H1 Br1\n1.0\n7.831452 -0.000000 -0.000000\n-0.000000 7.831452 -0.000000\n0.000000 -0.000000 10.718069\nBa H Br\n1 1 1\ndirect\n0.000000 0.000000 0.369793 Ba\n0.000000 0.000000 0.149083 H\n0.000000 0.000000 0.646815 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