# generated using pymatgen data_Mn3FeAs4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.47291000 _cell_length_b 5.42667600 _cell_length_c 6.02084004 _cell_angle_alpha 89.81309113 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn3FeAs4 _chemical_formula_sum 'Mn3 Fe1 As4' _cell_volume 113.47029909 _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 0.00000000 0.00778400 0.80574800 1.0 Mn Mn1 1 0.50000000 0.49786800 0.30282600 1.0 Mn Mn2 1 0.50000000 0.99854500 0.19346400 1.0 Fe Fe3 1 0.00000000 0.50205800 0.69530700 1.0 As As4 1 0.00000000 0.69706300 0.07782200 1.0 As As5 1 0.00000000 0.19571200 0.42203000 1.0 As As6 1 0.50000000 0.30922600 0.91170300 1.0 As As7 1 0.50000000 0.79174400 0.59110200 1.0