# generated using pymatgen data_Nb2CrMo2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.39477441 _cell_length_b 11.28035155 _cell_length_c 2.76453493 _cell_angle_alpha 85.35750717 _cell_angle_beta 80.64861076 _cell_angle_gamma 13.99388207 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb2CrMo2 _chemical_formula_sum 'Nb2 Cr1 Mo2' _cell_volume 80.28358318 _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 Nb Nb0 1 0.79820700 0.79820700 0.20179300 1.0 Nb Nb1 1 0.40903500 0.40903500 0.59096500 1.0 Cr Cr2 1 0.00444800 0.00444800 0.99555200 1.0 Mo Mo3 1 0.59435400 0.59435400 0.40564600 1.0 Mo Mo4 1 0.19395600 0.19395600 0.80604400 1.0