# generated using pymatgen data_SrNd(NbSe2)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.10500618 _cell_length_b 6.10500659 _cell_length_c 15.26757013 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000322 _symmetry_Int_Tables_number 1 _chemical_formula_structural SrNd(NbSe2)6 _chemical_formula_sum 'Sr1 Nd1 Nb6 Se12' _cell_volume 492.80236753 _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 Sr Sr0 1 0.33333300 0.66666700 0.25000000 1.0 Nd Nd1 1 0.66666700 0.33333300 0.75000000 1.0 Nb Nb2 1 0.33333300 0.66666700 0.99435688 1.0 Nb Nb3 1 0.00000000 0.00000000 0.99323194 1.0 Nb Nb4 1 0.66666700 0.33333300 0.99112234 1.0 Nb Nb5 1 0.33333300 0.66666700 0.50564312 1.0 Nb Nb6 1 0.00000000 0.00000000 0.50676806 1.0 Nb Nb7 1 0.66666700 0.33333300 0.50887766 1.0 Se Se8 1 0.67181258 0.66520453 0.39881197 1.0 Se Se9 1 0.66570271 0.67413770 0.61564498 1.0 Se Se10 1 0.00843499 0.67413770 0.88435502 1.0 Se Se11 1 0.66570271 0.99156501 0.88435502 1.0 Se Se12 1 0.67181258 0.00660805 0.10118803 1.0 Se Se13 1 0.33479547 0.00660805 0.39881197 1.0 Se Se14 1 0.00843499 0.33429729 0.61564498 1.0 Se Se15 1 0.32586230 0.99156501 0.61564498 1.0 Se Se16 1 0.99339195 0.66520453 0.10118803 1.0 Se Se17 1 0.32586230 0.33429729 0.88435502 1.0 Se Se18 1 0.99339195 0.32818742 0.39881197 1.0 Se Se19 1 0.33479547 0.32818742 0.10118803 1.0