# generated using pymatgen data_Ac2MnN3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.39505759 _cell_length_b 6.39505728 _cell_length_c 12.37014232 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 127.96805983 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ac2MnN3 _chemical_formula_sum 'Ac8 Mn4 N12' _cell_volume 398.82721050 _cell_formula_units_Z 4 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 Ac Ac0 1 0.43907398 0.56092602 0.35430639 1.0 Ac Ac1 1 0.56092602 0.43907398 0.64569361 1.0 Ac Ac2 1 0.06092602 0.93907398 0.85430639 1.0 Ac Ac3 1 0.93907398 0.06092602 0.14569361 1.0 Ac Ac4 1 0.14332855 0.85667145 0.42579458 1.0 Ac Ac5 1 0.85667145 0.14332855 0.57420542 1.0 Ac Ac6 1 0.35667145 0.64332855 0.92579458 1.0 Ac Ac7 1 0.64332855 0.35667145 0.07420542 1.0 Mn Mn8 1 0.25701108 0.74298892 0.16549618 1.0 Mn Mn9 1 0.74298892 0.25701108 0.83450382 1.0 Mn Mn10 1 0.24298892 0.75701108 0.66549618 1.0 Mn Mn11 1 0.75701108 0.24298892 0.33450382 1.0 N N12 1 0.15649628 0.84350372 0.04454229 1.0 N N13 1 0.84350372 0.15649628 0.95545771 1.0 N N14 1 0.34350372 0.65649628 0.54454229 1.0 N N15 1 0.65649628 0.34350372 0.45545771 1.0 N N16 1 0.42874495 0.57125505 0.13090785 1.0 N N17 1 0.57125505 0.42874495 0.86909215 1.0 N N18 1 0.07125505 0.92874495 0.63090785 1.0 N N19 1 0.92874495 0.07125505 0.36909215 1.0 N N20 1 0.99584307 0.50415693 0.25000000 1.0 N N21 1 0.50415693 0.99584307 0.75000000 1.0 N N22 1 0.00415693 0.49584307 0.75000000 1.0 N N23 1 0.49584307 0.00415693 0.25000000 1.0