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Mn\n0.968323 0.968323 0.531677 Mn\n0.280561 0.280561 0.219439 Mn\n0.219439 0.219439 0.280561 Mn\n0.718427 0.718427 0.781573 Mn\n0.781573 0.781573 0.718427 Mn\n0.468870 0.468870 0.031130 Mn\n0.031130 0.031130 0.468870 Mn\n0.656545 0.656545 0.843455 Mn\n0.843455 0.843455 0.656545 Mn\n0.175623 0.324377 0.175623 O\n0.324377 0.175623 0.324377 O\n0.645359 0.854641 0.854641 O\n0.854641 0.645359 0.645359 O\n0.297431 0.516009 0.692787 O\n0.516009 0.297431 0.493773 O\n0.493773 0.692787 0.516009 O\n0.692787 0.493773 0.297431 O\n0.939842 0.054640 0.633844 O\n0.054640 0.939842 0.371675 O\n0.371675 0.633844 0.054640 O\n0.633844 0.371675 0.939842 O\n0.710339 0.971143 0.227045 O\n0.971143 0.710339 0.091473 O\n0.091473 0.227045 0.971143 O\n0.227045 0.091473 0.710339 O\n0.050702 0.823218 0.469434 O\n0.823218 0.050702 0.656646 O\n0.656646 0.469434 0.823218 O\n0.469434 0.656646 0.050702 O\n0.296959 0.395785 0.784897 O\n0.395785 0.296959 0.522359 O\n0.522359 0.784897 0.395785 O\n0.784897 0.522359 0.296959 O\n0.845668 0.774895 0.559961 O\n0.774895 0.845668 0.819476 O\n0.819476 0.559961 0.774895 O\n0.559961 0.819476 0.845668 O\n0.185903 0.444883 0.257900 O\n0.444883 0.185903 0.111314 O\n0.111314 0.257900 0.444883 O\n0.257900 0.111314 0.185903 O\n0.891338 0.049079 0.155809 O\n0.049079 0.891338 0.903774 O\n0.903774 0.155809 0.049079 O\n0.155809 0.903774 0.891338 O\n0.868161 0.692910 0.101922 O\n0.692910 0.868161 0.337006 O\n0.337006 0.101922 0.692910 O\n0.101922 0.337006 0.868161 O\n0.593833 0.340210 0.511344 O\n0.340210 0.593833 0.554613 O\n0.554613 0.511344 0.340210 O\n0.511344 0.554613 0.593833 O\n0.293819 0.457006 0.245317 O\n0.457006 0.293819 0.003858 O\n0.003858 0.245317 0.457006 O\n0.245317 0.003858 0.293819 O\n0.997653 0.755454 0.617220 O\n0.755454 0.997653 0.629673 O\n0.629673 0.617220 0.755454 O\n0.617220 0.629673 0.997653 O\n0.959879 0.853827 0.183258 O\n0.853827 0.959879 0.003036 O\n0.003036 0.183258 0.853827 O\n0.183258 0.003036 0.959879 O\n0.466402 0.405045 0.165504 O\n0.405045 0.466402 0.963048 O\n0.963048 0.165504 0.405045 O\n0.165504 0.963048 0.466402 O\n0.708243 0.732189 0.167220 O\n0.732189 0.708243 0.392347 O\n0.392347 0.167220 0.732189 O\n0.167220 0.392347 0.708243 O\n","nsites":140,"nelements":3,"elements":["Rb","Mn","O"],"chemical_system":"Mn-O-Rb","density":3.7655632461456925,"density_atomic":0.04852449471467601,"volume":2885.140810289729,"volume_molar":12.410517194275148,"formula_full":"Rb44 Mn32 O64","formula_reduced":"Rb11Mn8O16","formula_anonymous":"A8B11C16","energy":-900.16196853,"energy_per_atom":-6.4297283466428565,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-802.81796853,"band_gap":0.1485999999999996,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":140.5399178,"is_theoretical":false,"updated_at":"2021-11-28T01:37:24.295000Z","spacegroup":22},{"id":"mp-542153","created_at":"2022-09-04T14:46:14.940816Z","structure_string":"Co12 B4 O20\n1.0\n2.992554 0.000000 0.000000\n0.000000 9.367874 0.000000\n0.000000 0.000000 12.043752\nCo B O\n12 4 20\ndirect\n0.500000 0.757620 0.387728 Co\n0.500000 0.242380 0.612272 Co\n0.500000 0.257620 0.112272 Co\n0.500000 0.742380 0.887728 Co\n0.000000 0.003596 0.222949 Co\n0.000000 0.996404 0.777051 Co\n0.000000 0.503596 0.277051 Co\n0.000000 0.496404 0.722949 Co\n0.000000 0.000000 0.500000 Co\n0.000000 0.500000 0.000000 Co\n0.500000 0.500000 0.500000 Co\n0.500000 0.000000 0.000000 Co\n0.500000 0.735580 0.138898 B\n0.500000 0.264420 0.861102 B\n0.500000 0.235580 0.361102 B\n0.500000 0.764420 0.638898 B\n0.500000 0.881676 0.141112 O\n0.500000 0.118324 0.858888 O\n0.500000 0.381676 0.358888 O\n0.500000 0.618324 0.641112 O\n0.500000 0.842289 0.539766 O\n0.500000 0.157711 0.460234 O\n0.500000 0.342289 0.960234 O\n0.500000 0.657711 0.039766 O\n0.500000 0.661274 0.238956 O\n0.500000 0.338726 0.761044 O\n0.500000 0.161274 0.261044 O\n0.500000 0.838726 0.738956 O\n0.000000 0.624463 0.419986 O\n0.000000 0.375537 0.580014 O\n0.000000 0.124463 0.080014 O\n0.000000 0.875537 0.919986 O\n0.000000 0.884029 0.357340 O\n0.000000 0.115971 0.642660 O\n0.000000 0.384029 0.142660 O\n0.000000 0.615971 0.857340 O\n","nsites":36,"nelements":3,"elements":["Co","B","O"],"chemical_system":"B-Co-O","density":5.264567117356927,"density_atomic":0.10662466016773164,"volume":337.63296355053575,"volume_molar":5.647981199214655,"formula_full":"Co12 B4 O20","formula_reduced":"Co3BO5","formula_anonymous":"AB3C5","energy":-272.51449679,"energy_per_atom":-7.569847133055556,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-239.11849679,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":24.0007574,"is_theoretical":false,"updated_at":"2021-11-28T01:37:27.840000Z","spacegroup":55}]}