# generated using pymatgen data_ZrMo2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.37696957 _cell_length_b 5.37693267 _cell_length_c 5.37700851 _cell_angle_alpha 59.99954529 _cell_angle_beta 59.99977142 _cell_angle_gamma 59.99944902 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrMo2 _chemical_formula_sum 'Zr2 Mo4' _cell_volume 109.92433615 _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 Zr Zr0 1 0.12499314 0.12499667 0.12500549 1.0 Zr Zr1 1 0.87500686 0.87500333 0.87499451 1.0 Mo Mo2 1 0.00000000 0.50000000 0.50000000 1.0 Mo Mo3 1 0.50000000 -0.00000000 0.50000000 1.0 Mo Mo4 1 0.50000000 0.50000000 -0.00000000 1.0 Mo Mo5 1 0.50000000 0.50000000 0.50000000 1.0