# generated using pymatgen data_Nb2(CrSi)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.26376562 _cell_length_b 7.26376562 _cell_length_c 4.86236600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 121.14044929 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb2(CrSi)3 _chemical_formula_sum 'Nb4 Cr6 Si6' _cell_volume 219.58134425 _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 Nb Nb0 1 0.76678300 0.76678300 0.50000000 1.0 Nb Nb1 1 0.75915000 0.00141900 0.00000000 1.0 Nb Nb2 1 0.00141900 0.75915000 0.00000000 1.0 Nb Nb3 1 0.22266800 0.22266800 0.00000000 1.0 Cr Cr4 1 0.66670600 0.33752100 0.25241100 1.0 Cr Cr5 1 0.33752100 0.66670600 0.25241100 1.0 Cr Cr6 1 0.33752100 0.66670600 0.74758900 1.0 Cr Cr7 1 0.66670600 0.33752100 0.74758900 1.0 Cr Cr8 1 0.25087000 0.99601000 0.50000000 1.0 Cr Cr9 1 0.99601000 0.25087000 0.50000000 1.0 Si Si10 1 0.59662300 0.00871500 0.50000000 1.0 Si Si11 1 0.00871500 0.59662300 0.50000000 1.0 Si Si12 1 0.38999800 0.38999800 0.50000000 1.0 Si Si13 1 0.40872800 0.00169800 0.00000000 1.0 Si Si14 1 0.00169800 0.40872800 0.00000000 1.0 Si Si15 1 0.58866900 0.58866900 0.00000000 1.0