# generated using pymatgen data_Zr4Mn4SiAs3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.74391316 _cell_length_b 6.65053404 _cell_length_c 7.83534453 _cell_angle_alpha 90.26962632 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr4Mn4SiAs3 _chemical_formula_sum 'Zr4 Mn4 Si1 As3' _cell_volume 195.09025468 _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 0.53034362 0.67663994 1.0 Zr Zr1 1 0.25000000 0.04012462 0.81798146 1.0 Zr Zr2 1 0.75000000 0.96236238 0.17934100 1.0 Zr Zr3 1 0.75000000 0.46181506 0.32510537 1.0 Mn Mn4 1 0.75000000 0.36202888 0.93307614 1.0 Mn Mn5 1 0.25000000 0.13763329 0.44427431 1.0 Mn Mn6 1 0.75000000 0.87237127 0.56279050 1.0 Mn Mn7 1 0.25000000 0.63403646 0.06210314 1.0 Si Si8 1 0.75000000 0.23893825 0.62408525 1.0 As As9 1 0.25000000 0.25858601 0.12953664 1.0 As As10 1 0.25000000 0.76130437 0.37413879 1.0 As As11 1 0.75000000 0.74045479 0.87092846 1.0