# generated using pymatgen data_MnCr2Fe3(PO4)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.42393028 _cell_length_b 8.42393028 _cell_length_c 8.42393082 _cell_angle_alpha 61.67823164 _cell_angle_beta 61.67823164 _cell_angle_gamma 61.67822719 _symmetry_Int_Tables_number 1 _chemical_formula_structural MnCr2Fe3(PO4)6 _chemical_formula_sum 'Mn1 Cr2 Fe3 P6 O24' _cell_volume 438.60098482 _cell_formula_units_Z 1 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 Mn Mn0 1 0.14510900 0.14510900 0.14510900 1.0 Cr Cr1 1 0.99951200 0.99951200 0.99951200 1.0 Cr Cr2 1 0.50048400 0.50048400 0.50048400 1.0 Fe Fe3 1 0.85368000 0.85368000 0.85368000 1.0 Fe Fe4 1 0.64686100 0.64686100 0.64686100 1.0 Fe Fe5 1 0.35343900 0.35343900 0.35343900 1.0 P P6 1 0.04963600 0.75012400 0.45177000 1.0 P P7 1 0.75012400 0.45177000 0.04963600 1.0 P P8 1 0.45177000 0.04963600 0.75012400 1.0 P P9 1 0.54807100 0.95073500 0.25052900 1.0 P P10 1 0.25052900 0.54807100 0.95073500 1.0 P P11 1 0.95073500 0.25052900 0.54807100 1.0 O O12 1 0.49555000 0.89514800 0.67590500 1.0 O O13 1 0.89514800 0.67590500 0.49555000 1.0 O O14 1 0.75135200 0.93765500 0.09549400 1.0 O O15 1 0.67590500 0.49555000 0.89514800 1.0 O O16 1 0.39540700 0.98881100 0.17776400 1.0 O O17 1 0.56486500 0.74704600 0.40544100 1.0 O O18 1 0.09549400 0.75135200 0.93765500 1.0 O O19 1 0.40544100 0.56486500 0.74704600 1.0 O O20 1 0.00560700 0.82494700 0.60557700 1.0 O O21 1 0.74704600 0.40544100 0.56486500 1.0 O O22 1 0.06151700 0.90453600 0.24873400 1.0 O O23 1 0.82494700 0.60557700 0.00560700 1.0 O O24 1 0.17776400 0.39540700 0.98881100 1.0 O O25 1 0.93765500 0.09549400 0.75135200 1.0 O O26 1 0.25268800 0.59567100 0.43698600 1.0 O O27 1 0.98881100 0.17776400 0.39540700 1.0 O O28 1 0.59567100 0.43698600 0.25268800 1.0 O O29 1 0.90453600 0.24873400 0.06151700 1.0 O O30 1 0.43698600 0.25268800 0.59567100 1.0 O O31 1 0.60557700 0.00560700 0.82494700 1.0 O O32 1 0.32519600 0.50288100 0.10527300 1.0 O O33 1 0.24873400 0.06151700 0.90453600 1.0 O O34 1 0.10527300 0.32519600 0.50288100 1.0 O O35 1 0.50288100 0.10527300 0.32519600 1.0