# generated using pymatgen data_MnCrB2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.14874651 _cell_length_b 4.14874651 _cell_length_c 2.93118837 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 138.07363485 _symmetry_Int_Tables_number 1 _chemical_formula_structural MnCrB2 _chemical_formula_sum 'Mn1 Cr1 B2' _cell_volume 33.71069783 _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 0.85544447 0.14455553 -0.00000000 1.0 Cr Cr1 1 0.14293173 0.85706827 0.50000000 1.0 B B2 1 0.43375737 0.56624263 0.50000000 1.0 B B3 1 0.56786743 0.43213257 0.00000000 1.0