# generated using pymatgen data_Mn3CrN3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.64218831 _cell_length_b 6.61718045 _cell_length_c 3.95422100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.23617231 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn3CrN3 _chemical_formula_sum 'Mn6 Cr2 N6' _cell_volume 150.15412160 _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 Mn Mn0 1 0.82990700 0.65904500 0.25000000 1.0 Mn Mn1 1 0.82877200 0.17048600 0.25000000 1.0 Mn Mn2 1 0.34165900 0.17195900 0.25000000 1.0 Mn Mn3 1 0.17009300 0.34095500 0.75000000 1.0 Mn Mn4 1 0.17122800 0.82951400 0.75000000 1.0 Mn Mn5 1 0.65834100 0.82804100 0.75000000 1.0 Cr Cr6 1 0.66652700 0.33233700 0.75000000 1.0 Cr Cr7 1 0.33347300 0.66766300 0.25000000 1.0 N N8 1 0.82661000 0.65194300 0.75000000 1.0 N N9 1 0.82529100 0.17369100 0.75000000 1.0 N N10 1 0.34823500 0.17549500 0.75000000 1.0 N N11 1 0.17339000 0.34805700 0.25000000 1.0 N N12 1 0.17470900 0.82630900 0.25000000 1.0 N N13 1 0.65176500 0.82450500 0.25000000 1.0