# generated using pymatgen data_Li2Ni9Mo3As7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.39234357 _cell_length_b 9.39234298 _cell_length_c 3.72542246 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000554 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2Ni9Mo3As7 _chemical_formula_sum 'Li2 Ni9 Mo3 As7' _cell_volume 284.61255242 _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 Li Li0 1 0.33333300 0.66666700 0.00000000 1.0 Li Li1 1 0.00000000 0.00000000 0.50000000 1.0 Ni Ni2 1 0.28070022 0.38505332 0.50000000 1.0 Ni Ni3 1 0.61494668 0.89564590 0.50000000 1.0 Ni Ni4 1 0.10435410 0.71929978 0.50000000 1.0 Ni Ni5 1 0.50283185 0.45562821 0.00000000 1.0 Ni Ni6 1 0.54437179 0.04720364 0.00000000 1.0 Ni Ni7 1 0.95279636 0.49716815 0.00000000 1.0 Ni Ni8 1 0.72334477 0.76100227 0.00000000 1.0 Ni Ni9 1 0.23899773 0.96234251 0.00000000 1.0 Ni Ni10 1 0.03765749 0.27665523 0.00000000 1.0 Mo Mo11 1 0.76545550 0.55395146 0.50000000 1.0 Mo Mo12 1 0.44604854 0.21150404 0.50000000 1.0 Mo Mo13 1 0.78849596 0.23454450 0.50000000 1.0 As As14 1 0.96560131 0.75531443 0.00000000 1.0 As As15 1 0.24468557 0.21028589 0.00000000 1.0 As As16 1 0.78971411 0.03439869 0.00000000 1.0 As As17 1 0.66666700 0.33333300 0.00000000 1.0 As As18 1 0.53888262 0.62405499 0.50000000 1.0 As As19 1 0.37594501 0.91482863 0.50000000 1.0 As As20 1 0.08517137 0.46111738 0.50000000 1.0