# generated using pymatgen data_PaMnAsN _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.91234925 _cell_length_b 3.91234925 _cell_length_c 8.67257462 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural PaMnAsN _chemical_formula_sum 'Pa2 Mn2 As2 N2' _cell_volume 132.74656060 _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 Pa Pa0 1 0.25000200 0.25000200 0.13833972 1.0 Pa Pa1 1 0.75000200 0.75000200 0.86166228 1.0 Mn Mn2 1 0.75000200 0.25000200 0.49999900 1.0 Mn Mn3 1 0.25000200 0.75000200 0.49999900 1.0 As As4 1 0.75000200 0.75000200 0.30687820 1.0 As As5 1 0.25000200 0.25000200 0.69312080 1.0 N N6 1 0.75000200 0.25000200 0.00000000 1.0 N N7 1 0.25000200 0.75000200 0.00000000 1.0