# generated using pymatgen data_Zr6SiGeN2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.83905589 _cell_length_b 5.83905467 _cell_length_c 8.63302465 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 145.29375023 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr6SiGeN2 _chemical_formula_sum 'Zr6 Si1 Ge1 N2' _cell_volume 167.58769335 _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 Zr Zr0 1 0.94272651 0.05727349 0.75000000 1.0 Zr Zr1 1 0.05974820 0.94025180 0.25000000 1.0 Zr Zr2 1 0.63021006 0.36978994 0.55013593 1.0 Zr Zr3 1 0.36898897 0.63101103 0.44514861 1.0 Zr Zr4 1 0.36898897 0.63101103 0.05485139 1.0 Zr Zr5 1 0.63021006 0.36978994 0.94986407 1.0 Si Si6 1 0.74633376 0.25366624 0.25000000 1.0 Ge Ge7 1 0.25257643 0.74742357 0.75000000 1.0 N N8 1 0.00011002 0.99988998 0.49998662 1.0 N N9 1 0.00011002 0.99988998 0.00001338 1.0