# generated using pymatgen data_Sr3Cu2(OF)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.99658038 _cell_length_b 11.99658038 _cell_length_c 11.99658038 _cell_angle_alpha 161.72405652 _cell_angle_beta 161.72405652 _cell_angle_gamma 25.95809040 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr3Cu2(OF)4 _chemical_formula_sum 'Sr3 Cu2 O4 F4' _cell_volume 169.73129037 _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 Sr Sr0 1 0.25000000 0.75000000 0.50000000 1.0 Sr Sr1 1 0.42246200 0.92246200 0.50000000 1.0 Sr Sr2 1 0.07753800 0.57753800 0.50000000 1.0 Cu Cu3 1 0.66006100 0.16006100 0.50000000 1.0 Cu Cu4 1 0.83993900 0.33993900 0.50000000 1.0 O O5 1 0.65831700 0.65831700 0.00000000 1.0 O O6 1 0.34168300 0.34168300 0.00000000 1.0 O O7 1 0.83561800 0.83561800 0.00000000 1.0 O O8 1 0.16438200 0.16438200 0.00000000 1.0 F F9 1 0.75000000 0.25000000 0.50000000 1.0 F F10 1 0.57146700 0.07146700 0.50000000 1.0 F F11 1 0.92853300 0.42853300 0.50000000 1.0 F F12 1 0.00000000 0.00000000 0.00000000 1.0