# generated using pymatgen data_Tm2Tc3Ni9P7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.04978015 _cell_length_b 9.04977988 _cell_length_c 3.66573026 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000454 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm2Tc3Ni9P7 _chemical_formula_sum 'Tm2 Tc3 Ni9 P7' _cell_volume 259.99629626 _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 Tm Tm0 1 0.00000000 0.00000000 0.00000000 1.0 Tm Tm1 1 0.66666700 0.33333300 0.50000000 1.0 Tc Tc2 1 0.44987835 0.56844999 0.50000000 1.0 Tc Tc3 1 0.43155001 0.88142936 0.50000000 1.0 Tc Tc4 1 0.11857064 0.55012165 0.50000000 1.0 Ni Ni5 1 0.70552983 0.60246952 0.00000000 1.0 Ni Ni6 1 0.39753048 0.10306031 0.00000000 1.0 Ni Ni7 1 0.89693969 0.29447017 0.00000000 1.0 Ni Ni8 1 0.20770924 0.38236103 0.00000000 1.0 Ni Ni9 1 0.61763897 0.82534720 0.00000000 1.0 Ni Ni10 1 0.17465280 0.79229076 0.00000000 1.0 Ni Ni11 1 0.27593068 0.22365799 0.50000000 1.0 Ni Ni12 1 0.77634201 0.05227169 0.50000000 1.0 Ni Ni13 1 0.94772831 0.72406932 0.50000000 1.0 P P14 1 0.44717492 0.37019450 0.00000000 1.0 P P15 1 0.62980550 0.07698142 0.00000000 1.0 P P16 1 0.92301858 0.55282508 0.00000000 1.0 P P17 1 0.04335800 0.26000575 0.50000000 1.0 P P18 1 0.73999425 0.78335325 0.50000000 1.0 P P19 1 0.21664675 0.95664200 0.50000000 1.0 P P20 1 0.33333300 0.66666700 0.00000000 1.0