# generated using pymatgen data_Li2Ni9Mo3P7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.05964219 _cell_length_b 9.05964218 _cell_length_c 3.59287434 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000724 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2Ni9Mo3P7 _chemical_formula_sum 'Li2 Ni9 Mo3 P7' _cell_volume 255.38460834 _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 0.66666700 0.33333300 0.50000000 1.0 Ni Ni2 1 0.71013439 0.87466446 0.00000000 1.0 Ni Ni3 1 0.16453006 0.28986561 0.00000000 1.0 Ni Ni4 1 0.12533554 0.83546994 0.00000000 1.0 Ni Ni5 1 0.62833128 0.56508214 0.00000000 1.0 Ni Ni6 1 0.93675186 0.37166872 0.00000000 1.0 Ni Ni7 1 0.43491786 0.06324814 0.00000000 1.0 Ni Ni8 1 0.55495426 0.94423768 0.50000000 1.0 Ni Ni9 1 0.38928342 0.44504574 0.50000000 1.0 Ni Ni10 1 0.05576232 0.61071658 0.50000000 1.0 Mo Mo11 1 0.87701695 0.77763668 0.50000000 1.0 Mo Mo12 1 0.90061873 0.12298305 0.50000000 1.0 Mo Mo13 1 0.22236332 0.09938127 0.50000000 1.0 P P14 1 0.58507626 0.71072458 0.50000000 1.0 P P15 1 0.12564832 0.41492374 0.50000000 1.0 P P16 1 0.28927542 0.87435168 0.50000000 1.0 P P17 1 0.00000000 0.00000000 0.00000000 1.0 P P18 1 0.88098298 0.58154124 0.00000000 1.0 P P19 1 0.70055827 0.11901702 0.00000000 1.0 P P20 1 0.41845876 0.29944173 0.00000000 1.0