# generated using pymatgen data_Ni15Cl16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.57062734 _cell_length_b 8.57062734 _cell_length_c 8.57062734 _cell_angle_alpha 109.47122063 _cell_angle_beta 109.47122063 _cell_angle_gamma 109.47122063 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ni15Cl16 _chemical_formula_sum 'Ni15 Cl16' _cell_volume 484.63630468 _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 Ni Ni0 1 0.24548000 0.75452000 0.00000000 1.0 Ni Ni1 1 0.50000000 0.50000000 0.00000000 1.0 Ni Ni2 1 0.49096100 0.24548000 0.24548000 1.0 Ni Ni3 1 0.75452000 0.00000000 0.24548000 1.0 Ni Ni4 1 0.00000000 0.75452000 0.24548000 1.0 Ni Ni5 1 0.00000000 0.50000000 0.50000000 1.0 Ni Ni6 1 0.24548000 0.49096100 0.24548000 1.0 Ni Ni7 1 0.24548000 0.24548000 0.49096100 1.0 Ni Ni8 1 0.50000000 0.00000000 0.50000000 1.0 Ni Ni9 1 0.50903900 0.75452000 0.75452000 1.0 Ni Ni10 1 0.75452000 0.75452000 0.50903900 1.0 Ni Ni11 1 0.75452000 0.50903900 0.75452000 1.0 Ni Ni12 1 0.00000000 0.24548000 0.75452000 1.0 Ni Ni13 1 0.24548000 0.00000000 0.75452000 1.0 Ni Ni14 1 0.75452000 0.24548000 0.00000000 1.0 Cl Cl15 1 0.73735000 0.73735000 0.00000000 1.0 Cl Cl16 1 0.00000000 0.50000000 0.00000000 1.0 Cl Cl17 1 0.00000000 0.26265000 0.26265000 1.0 Cl Cl18 1 0.26265000 0.26265000 0.00000000 1.0 Cl Cl19 1 0.26265000 0.00000000 0.26265000 1.0 Cl Cl20 1 0.50000000 0.75000000 0.25000000 1.0 Cl Cl21 1 0.50000000 0.50000000 0.50000000 1.0 Cl Cl22 1 0.75000000 0.50000000 0.25000000 1.0 Cl Cl23 1 0.75000000 0.25000000 0.50000000 1.0 Cl Cl24 1 0.00000000 0.00000000 0.50000000 1.0 Cl Cl25 1 0.00000000 0.73735000 0.73735000 1.0 Cl Cl26 1 0.25000000 0.75000000 0.50000000 1.0 Cl Cl27 1 0.25000000 0.50000000 0.75000000 1.0 Cl Cl28 1 0.50000000 0.25000000 0.75000000 1.0 Cl Cl29 1 0.50000000 0.00000000 0.00000000 1.0 Cl Cl30 1 0.73735000 0.00000000 0.73735000 1.0