# generated using pymatgen data_Zr4Mn4SiP3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.64910112 _cell_length_b 6.50170227 _cell_length_c 7.64397543 _cell_angle_alpha 89.89705378 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr4Mn4SiP3 _chemical_formula_sum 'Zr4 Mn4 Si1 P3' _cell_volume 181.35584501 _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 Zr Zr0 1 0.25000000 0.53238595 0.67756150 1.0 Zr Zr1 1 0.25000000 0.03107832 0.82162401 1.0 Zr Zr2 1 0.75000000 0.96365565 0.17652510 1.0 Zr Zr3 1 0.75000000 0.46879511 0.32562476 1.0 Mn Mn4 1 0.75000000 0.36720580 0.93717829 1.0 Mn Mn5 1 0.25000000 0.13501899 0.44023017 1.0 Mn Mn6 1 0.75000000 0.86367791 0.56175125 1.0 Mn Mn7 1 0.25000000 0.63768565 0.06056015 1.0 Si Si8 1 0.25000000 0.26596209 0.12355149 1.0 P P9 1 0.25000000 0.76485781 0.37372049 1.0 P P10 1 0.75000000 0.73421116 0.87322662 1.0 P P11 1 0.75000000 0.23546356 0.62844516 1.0