# generated using pymatgen data_Ni5O7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 2.90690200 _cell_length_b 5.12726518 _cell_length_c 16.97827100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 106.46770774 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ni5O7 _chemical_formula_sum 'Ni10 O14' _cell_volume 242.67164034 _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 Ni Ni0 1 0.26852200 0.53704200 0.57907500 1.0 Ni Ni1 1 0.00000000 0.00000000 0.50000000 1.0 Ni Ni2 1 0.00000000 0.00000000 0.00000000 1.0 Ni Ni3 1 0.73147800 0.46295700 0.42092500 1.0 Ni Ni4 1 0.73147800 0.46295700 0.07907500 1.0 Ni Ni5 1 0.26852200 0.53704200 0.92092500 1.0 Ni Ni6 1 0.46739600 0.93479100 0.15397700 1.0 Ni Ni7 1 0.53260400 0.06520800 0.84602400 1.0 Ni Ni8 1 0.53260400 0.06520800 0.65397600 1.0 Ni Ni9 1 0.46739600 0.93479100 0.34602400 1.0 O O10 1 0.63890800 0.27781700 0.96542300 1.0 O O11 1 0.36109300 0.72218400 0.03457700 1.0 O O12 1 0.36109300 0.72218400 0.46542300 1.0 O O13 1 0.63890800 0.27781700 0.53457700 1.0 O O14 1 0.15501400 0.31003000 0.82558000 1.0 O O15 1 0.84498600 0.68997000 0.17442000 1.0 O O16 1 0.84498600 0.68997000 0.32558100 1.0 O O17 1 0.15501400 0.31003000 0.67442000 1.0 O O18 1 0.91219600 0.82438900 0.89380000 1.0 O O19 1 0.08780400 0.17561100 0.10620000 1.0 O O20 1 0.08780400 0.17561100 0.39380000 1.0 O O21 1 0.91219600 0.82438900 0.60620000 1.0 O O22 1 0.43996900 0.87993800 0.75000000 1.0 O O23 1 0.56003200 0.12006400 0.25000000 1.0