# generated using pymatgen data_Mg2CrN3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.76141339 _cell_length_b 5.80024505 _cell_length_c 4.89437305 _cell_angle_alpha 89.99987715 _cell_angle_beta 90.00005208 _cell_angle_gamma 120.22245837 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg2CrN3 _chemical_formula_sum 'Mg4 Cr2 N6' _cell_volume 141.32701209 _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 Mg Mg0 1 0.32406740 0.33253932 0.46791672 1.0 Mg Mg1 1 0.67594310 0.00848495 0.46792774 1.0 Mg Mg2 1 0.67594286 0.66746322 0.96791489 1.0 Mg Mg3 1 0.32404578 0.99150666 0.96792578 1.0 Cr Cr4 1 0.00000474 0.67207412 0.47785386 1.0 Cr Cr5 1 -0.00000291 0.32792591 0.97784821 1.0 N N6 1 0.29900848 0.33362977 0.90400393 1.0 N N7 1 0.70098207 0.03462083 0.90400789 1.0 N N8 1 0.70098553 0.66637068 0.40399926 1.0 N N9 1 0.29902318 0.96538546 0.40400474 1.0 N N10 1 -0.00000301 0.62844213 0.85030537 1.0 N N11 1 0.00000278 0.37155696 0.35029560 1.0