# generated using pymatgen data_Mn4VN4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.96246035 _cell_length_b 4.96093768 _cell_length_c 7.69229523 _cell_angle_alpha 72.22577636 _cell_angle_beta 84.60372648 _cell_angle_gamma 70.00191014 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn4VN4 _chemical_formula_sum 'Mn8 V2 N8' _cell_volume 169.44838324 _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 0.73669600 0.62687100 0.21554900 1.0 Mn Mn1 1 0.26330400 0.37312900 0.78445100 1.0 Mn Mn2 1 0.74114100 0.25960700 0.99960200 1.0 Mn Mn3 1 0.25885900 0.74039300 0.00039800 1.0 Mn Mn4 1 0.75442100 0.45063000 0.60121500 1.0 Mn Mn5 1 0.24557900 0.54937000 0.39878500 1.0 Mn Mn6 1 0.25011000 0.95335900 0.60525800 1.0 Mn Mn7 1 0.74989000 0.04664100 0.39474200 1.0 V V8 1 0.74328900 0.85091000 0.78149800 1.0 V V9 1 0.25671100 0.14909000 0.21850200 1.0 N N10 1 0.00183800 0.70465100 0.59689400 1.0 N N11 1 0.99816200 0.29534900 0.40310600 1.0 N N12 1 0.85297900 0.84883600 0.00641100 1.0 N N13 1 0.14702100 0.15116400 0.99358900 1.0 N N14 1 0.50147600 0.59592200 0.81177900 1.0 N N15 1 0.49852400 0.40407800 0.18822100 1.0 N N16 1 0.49840000 0.79942900 0.39782600 1.0 N N17 1 0.50160000 0.20057100 0.60217400 1.0