# generated using pymatgen data_CrNF4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.63269200 _cell_length_b 7.63269200 _cell_length_c 6.28222600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CrNF4 _chemical_formula_sum 'Cr4 N4 F16' _cell_volume 365.98984169 _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 Cr Cr0 1 0.25000000 0.75000000 0.00000000 1.0 Cr Cr1 1 0.25000000 0.25000000 0.00000000 1.0 Cr Cr2 1 0.75000000 0.75000000 0.00000000 1.0 Cr Cr3 1 0.75000000 0.25000000 0.00000000 1.0 N N4 1 0.00000000 0.00000000 0.50000000 1.0 N N5 1 0.50000000 0.50000000 0.50000000 1.0 N N6 1 0.50000000 0.00000000 0.53448700 1.0 N N7 1 0.00000000 0.50000000 0.46551300 1.0 F F8 1 0.50000000 0.74892300 0.95931900 1.0 F F9 1 0.50000000 0.25107700 0.95931900 1.0 F F10 1 0.24892300 0.00000000 0.95931900 1.0 F F11 1 0.75107700 0.00000000 0.95931900 1.0 F F12 1 0.00000000 0.75107700 0.04068100 1.0 F F13 1 0.00000000 0.24892300 0.04068100 1.0 F F14 1 0.25107700 0.50000000 0.04068100 1.0 F F15 1 0.74892300 0.50000000 0.04068100 1.0 F F16 1 0.22283700 0.72283700 0.72284700 1.0 F F17 1 0.22283700 0.27716300 0.72284700 1.0 F F18 1 0.77716300 0.72283700 0.72284700 1.0 F F19 1 0.77716300 0.27716300 0.72284700 1.0 F F20 1 0.27716300 0.77716300 0.27715300 1.0 F F21 1 0.27716300 0.22283700 0.27715300 1.0 F F22 1 0.72283700 0.77716300 0.27715300 1.0 F F23 1 0.72283700 0.22283700 0.27715300 1.0