# generated using pymatgen data_Y2Ni3N4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.72893756 _cell_length_b 7.73554600 _cell_length_c 7.53271949 _cell_angle_alpha 90.00000312 _cell_angle_beta 79.58070800 _cell_angle_gamma 132.46418872 _symmetry_Int_Tables_number 1 _chemical_formula_structural Y2Ni3N4 _chemical_formula_sum 'Y4 Ni6 N8' _cell_volume 238.74648435 _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 Y Y0 1 0.70489100 0.23193100 0.63133400 1.0 Y Y1 1 0.29510900 0.52704000 0.86866600 1.0 Y Y2 1 0.29510900 0.76806900 0.36866600 1.0 Y Y3 1 0.70489100 0.47296000 0.13133400 1.0 Ni Ni4 1 0.24421100 0.99472100 0.00596400 1.0 Ni Ni5 1 0.75578900 0.75051000 0.49403600 1.0 Ni Ni6 1 0.75578900 0.00527900 0.99403600 1.0 Ni Ni7 1 0.24421100 0.24949000 0.50596400 1.0 Ni Ni8 1 0.00000000 0.90882000 0.75000000 1.0 Ni Ni9 1 0.00000000 0.09118000 0.25000000 1.0 N N10 1 0.20920400 0.98601600 0.50844400 1.0 N N11 1 0.79079600 0.77681200 0.99155600 1.0 N N12 1 0.79079600 0.01398400 0.49155600 1.0 N N13 1 0.20920400 0.22318800 0.00844400 1.0 N N14 1 0.72629100 0.23640100 0.94819200 1.0 N N15 1 0.27370900 0.51011000 0.55180800 1.0 N N16 1 0.27370900 0.76359900 0.05180800 1.0 N N17 1 0.72629100 0.48989000 0.44819200 1.0