# generated using pymatgen data_Cr3B4Mo3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.89189804 _cell_length_b 5.89189804 _cell_length_c 3.00590400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.11389842 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cr3B4Mo3 _chemical_formula_sum 'Cr3 B4 Mo3' _cell_volume 104.34813554 _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 Cr Cr0 1 0.32619800 0.32619800 0.50000000 1.0 Cr Cr1 1 0.16865100 0.83278800 0.50000000 1.0 Cr Cr2 1 0.83278800 0.16865100 0.50000000 1.0 B B3 1 0.11200600 0.11200600 0.00000000 1.0 B B4 1 0.89382900 0.89382900 0.00000000 1.0 B B5 1 0.61055500 0.38034200 0.00000000 1.0 B B6 1 0.38034200 0.61055500 0.00000000 1.0 Mo Mo7 1 0.49579800 0.00586100 0.00000000 1.0 Mo Mo8 1 0.00586100 0.49579800 0.00000000 1.0 Mo Mo9 1 0.67397400 0.67397400 0.50000000 1.0