# generated using pymatgen data_Ac2CrN3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.41237021 _cell_length_b 6.41237049 _cell_length_c 12.54594093 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 127.27615718 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ac2CrN3 _chemical_formula_sum 'Ac8 Cr4 N12' _cell_volume 410.49110911 _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 0.55912274 0.44087726 0.64402251 1.0 Ac Ac1 1 0.44087726 0.55912274 0.35597749 1.0 Ac Ac2 1 0.94087726 0.05912274 0.14402251 1.0 Ac Ac3 1 0.05912274 0.94087726 0.85597749 1.0 Ac Ac4 1 0.85679451 0.14320549 0.57342924 1.0 Ac Ac5 1 0.14320549 0.85679451 0.42657076 1.0 Ac Ac6 1 0.64320549 0.35679451 0.07342924 1.0 Ac Ac7 1 0.35679451 0.64320549 0.92657076 1.0 Cr Cr8 1 0.74025191 0.25974809 0.83741813 1.0 Cr Cr9 1 0.25974809 0.74025191 0.16258187 1.0 Cr Cr10 1 0.75974809 0.24025191 0.33741813 1.0 Cr Cr11 1 0.24025191 0.75974809 0.66258187 1.0 N N12 1 0.84640682 0.15359318 0.95689434 1.0 N N13 1 0.15359318 0.84640682 0.04310566 1.0 N N14 1 0.65359318 0.34640682 0.45689434 1.0 N N15 1 0.34640682 0.65359318 0.54310566 1.0 N N16 1 0.57240329 0.42759671 0.86981278 1.0 N N17 1 0.42759671 0.57240329 0.13018722 1.0 N N18 1 0.92759671 0.07240329 0.36981278 1.0 N N19 1 0.07240329 0.92759671 0.63018722 1.0 N N20 1 0.50927116 0.99072884 0.75000000 1.0 N N21 1 0.99072884 0.50927116 0.25000000 1.0 N N22 1 0.49072884 0.00927116 0.25000000 1.0 N N23 1 0.00927116 0.49072884 0.75000000 1.0