# generated using pymatgen data_Mg3MnP6N13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.00399620 _cell_length_b 7.00399696 _cell_length_c 7.00399651 _cell_angle_alpha 109.53703616 _cell_angle_beta 109.53703241 _cell_angle_gamma 109.53704402 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg3MnP6N13 _chemical_formula_sum 'Mg3 Mn1 P6 N13' _cell_volume 263.84754566 _cell_formula_units_Z 1 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 0.00154331 0.70584752 0.00154331 1.0 Mg Mg1 1 0.70584752 0.00154331 0.00154331 1.0 Mg Mg2 1 0.00154331 0.00154331 0.70584752 1.0 Mn Mn3 1 0.29000578 0.29000578 0.29000578 1.0 P P4 1 0.49821112 0.24937665 0.74929057 1.0 P P5 1 0.49821112 0.74929057 0.24937665 1.0 P P6 1 0.74929057 0.24937665 0.49821112 1.0 P P7 1 0.24937665 0.49821112 0.74929057 1.0 P P8 1 0.74929057 0.49821112 0.24937665 1.0 P P9 1 0.24937665 0.74929057 0.49821112 1.0 N N10 1 0.01878929 0.01878929 0.01878929 1.0 N N11 1 0.99974375 0.73079190 0.45488935 1.0 N N12 1 0.26566394 0.71860294 0.26566394 1.0 N N13 1 0.27989964 0.54391633 0.54391633 1.0 N N14 1 0.54391633 0.54391633 0.27989964 1.0 N N15 1 0.54391633 0.27989964 0.54391633 1.0 N N16 1 0.73079190 0.99974375 0.45488935 1.0 N N17 1 0.45488935 0.99974375 0.73079190 1.0 N N18 1 0.73079190 0.45488935 0.99974375 1.0 N N19 1 0.26566394 0.26566394 0.71860294 1.0 N N20 1 0.71860294 0.26566394 0.26566394 1.0 N N21 1 0.99974375 0.45488935 0.73079190 1.0 N N22 1 0.45488935 0.73079190 0.99974375 1.0