# generated using pymatgen data_Ca2YUN4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.90124007 _cell_length_b 9.18553047 _cell_length_c 6.06191792 _cell_angle_alpha 29.09935222 _cell_angle_beta 55.30352122 _cell_angle_gamma 41.29546289 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca2YUN4 _chemical_formula_sum 'Ca2 Y1 U1 N4' _cell_volume 118.68632342 _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 Ca Ca0 1 0.75000000 0.50000000 0.00000000 1.0 Ca Ca1 1 0.50000000 0.00000000 0.00000000 1.0 Y Y2 1 0.25000000 0.50000000 0.00000000 1.0 U U3 1 0.00000000 0.00000000 0.00000000 1.0 N N4 1 0.49022672 0.50000000 0.51954657 1.0 N N5 1 0.21451226 1.00000000 0.57097448 1.0 N N6 1 0.00977328 0.50000000 0.48045343 1.0 N N7 1 0.78548774 0.00000000 0.42902552 1.0