# generated using pymatgen data_Nb4Ga3TcN _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.65629178 _cell_length_b 7.65629153 _cell_length_c 5.27591253 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000108 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb4Ga3TcN _chemical_formula_sum 'Nb8 Ga6 Tc2 N2' _cell_volume 267.83365733 _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 0.23138234 0.00000000 0.25445235 1.0 Nb Nb1 1 0.76861766 0.00000000 0.74554765 1.0 Nb Nb2 1 0.00000000 0.23138234 0.25445235 1.0 Nb Nb3 1 1.00000000 0.76861766 0.74554765 1.0 Nb Nb4 1 0.76861766 0.76861766 0.25445235 1.0 Nb Nb5 1 0.23138234 0.23138234 0.74554765 1.0 Nb Nb6 1 0.66666700 0.33333300 0.50000000 1.0 Nb Nb7 1 0.33333300 0.66666700 0.50000000 1.0 Ga Ga8 1 0.58995038 0.00000000 0.23287867 1.0 Ga Ga9 1 0.41004962 0.00000000 0.76712133 1.0 Ga Ga10 1 1.00000000 0.58995038 0.23287867 1.0 Ga Ga11 1 0.00000000 0.41004962 0.76712133 1.0 Ga Ga12 1 0.41004962 0.41004962 0.23287867 1.0 Ga Ga13 1 0.58995038 0.58995038 0.76712133 1.0 Tc Tc14 1 0.33333300 0.66666700 0.00000000 1.0 Tc Tc15 1 0.66666700 0.33333300 0.00000000 1.0 N N16 1 0.00000000 0.00000000 0.00000000 1.0 N N17 1 0.00000000 0.00000000 0.50000000 1.0