# generated using pymatgen data_Nb14Ga3As5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.53312254 _cell_length_b 7.97473231 _cell_length_c 14.30685543 _cell_angle_alpha 104.14680900 _cell_angle_beta 90.00000001 _cell_angle_gamma 102.79831143 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb14Ga3As5 _chemical_formula_sum 'Nb14 Ga3 As5' _cell_volume 380.54423577 _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 0.00020101 0.00040102 0.99999019 1.0 Nb Nb1 1 0.49968303 0.99936606 0.49991523 1.0 Nb Nb2 1 0.42898909 0.85797819 0.82648353 1.0 Nb Nb3 1 0.57006490 0.14012981 0.17219843 1.0 Nb Nb4 1 0.19752520 0.39505040 0.30907770 1.0 Nb Nb5 1 0.80187176 0.60374353 0.69295744 1.0 Nb Nb6 1 0.20930914 0.41861829 0.79536157 1.0 Nb Nb7 1 0.79132131 0.58264362 0.20489133 1.0 Nb Nb8 1 0.33459916 0.66919832 0.03371842 1.0 Nb Nb9 1 0.66541662 0.33083525 0.96621602 1.0 Nb Nb10 1 0.00130209 0.00260418 0.66054902 1.0 Nb Nb11 1 0.00052677 0.00105454 0.33809846 1.0 Nb Nb12 1 0.17954906 0.35909713 0.54700668 1.0 Nb Nb13 1 0.82016978 0.64034156 0.45250474 1.0 Ga Ga14 1 0.17563802 0.35127505 0.10745236 1.0 Ga Ga15 1 0.82480882 0.64961963 0.89299357 1.0 Ga Ga16 1 0.37000114 0.74000428 0.59861336 1.0 As As17 1 0.63006726 0.26013451 0.40219913 1.0 As As18 1 0.37263714 0.74527228 0.33511092 1.0 As As19 1 0.62681153 0.25362507 0.66542085 1.0 As As20 1 0.06243308 0.12486716 0.84716061 1.0 As As21 1 0.93707206 0.87414213 0.15207843 1.0