# generated using pymatgen data_Co2Re5P12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.06008700 _cell_length_b 11.92649400 _cell_length_c 14.91046400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Co2Re5P12 _chemical_formula_sum 'Co4 Re10 P24' _cell_volume 544.17392304 _cell_formula_units_Z 2 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Co Co0 1 0.50000000 0.13095100 0.34545600 1.0 Co Co1 1 0.50000000 0.86904900 0.65454400 1.0 Co Co2 1 0.00000000 0.36904900 0.84545600 1.0 Co Co3 1 0.00000000 0.63095100 0.15454400 1.0 Re Re4 1 0.50000000 0.31775500 0.10081900 1.0 Re Re5 1 0.50000000 0.68224500 0.89918100 1.0 Re Re6 1 0.00000000 0.18224500 0.60081900 1.0 Re Re7 1 0.00000000 0.81775500 0.39918100 1.0 Re Re8 1 0.50000000 0.92284700 0.25788800 1.0 Re Re9 1 0.50000000 0.07715300 0.74211200 1.0 Re Re10 1 0.00000000 0.57715300 0.75788800 1.0 Re Re11 1 0.00000000 0.42284700 0.24211200 1.0 Re Re12 1 0.50000000 0.50000000 0.50000000 1.0 Re Re13 1 0.00000000 0.00000000 0.00000000 1.0 P P14 1 0.50000000 0.57717200 0.26190000 1.0 P P15 1 0.50000000 0.42282800 0.73810000 1.0 P P16 1 0.00000000 0.92282800 0.76190000 1.0 P P17 1 0.00000000 0.07717200 0.23810000 1.0 P P18 1 0.50000000 0.65422700 0.40047900 1.0 P P19 1 0.50000000 0.34577300 0.59952100 1.0 P P20 1 0.00000000 0.84577300 0.90047900 1.0 P P21 1 0.00000000 0.15422700 0.09952100 1.0 P P22 1 0.50000000 0.89976600 0.09545100 1.0 P P23 1 0.50000000 0.10023400 0.90454900 1.0 P P24 1 0.00000000 0.60023400 0.59545100 1.0 P P25 1 0.00000000 0.39976600 0.40454900 1.0 P P26 1 0.50000000 0.72551800 0.74217900 1.0 P P27 1 0.50000000 0.27448200 0.25782100 1.0 P P28 1 0.00000000 0.77448200 0.24217900 1.0 P P29 1 0.00000000 0.22551800 0.75782100 1.0 P P30 1 0.50000000 0.97204500 0.42628500 1.0 P P31 1 0.50000000 0.02795500 0.57371500 1.0 P P32 1 0.00000000 0.52795500 0.92628500 1.0 P P33 1 0.00000000 0.47204500 0.07371500 1.0 P P34 1 0.50000000 0.71161100 0.06285200 1.0 P P35 1 0.50000000 0.28838900 0.93714800 1.0 P P36 1 0.00000000 0.78838900 0.56285200 1.0 P P37 1 0.00000000 0.21161100 0.43714800 1.0