# generated using pymatgen data_TmPaB6Mo _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.74764861 _cell_length_b 9.12086762 _cell_length_c 11.47902181 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TmPaB6Mo _chemical_formula_sum 'Tm4 Pa4 B24 Mo4' _cell_volume 392.37370660 _cell_formula_units_Z 4 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 0.94498318 0.37325216 1.0 Tm Tm1 1 0.00000000 0.05501682 0.62674784 1.0 Tm Tm2 1 0.00000000 0.44498318 0.12674784 1.0 Tm Tm3 1 0.00000000 0.55501682 0.87325216 1.0 Pa Pa4 1 0.00000000 0.32208909 0.41382027 1.0 Pa Pa5 1 0.00000000 0.67791091 0.58617973 1.0 Pa Pa6 1 0.00000000 0.82208909 0.08617973 1.0 Pa Pa7 1 0.00000000 0.17791091 0.91382027 1.0 B B8 1 0.50000000 0.55343975 0.43306088 1.0 B B9 1 0.50000000 0.44656025 0.56693912 1.0 B B10 1 0.50000000 0.05343975 0.06693912 1.0 B B11 1 0.50000000 0.94656025 0.93306088 1.0 B B12 1 0.50000000 0.74994326 0.41985611 1.0 B B13 1 0.50000000 0.25005674 0.58014389 1.0 B B14 1 0.50000000 0.24994326 0.08014389 1.0 B B15 1 0.50000000 0.75005674 0.91985611 1.0 B B16 1 0.50000000 0.79333724 0.26483121 1.0 B B17 1 0.50000000 0.20666276 0.73516879 1.0 B B18 1 0.50000000 0.29333724 0.23516879 1.0 B B19 1 0.50000000 0.70666276 0.76483121 1.0 B B20 1 0.50000000 0.63158326 0.18489245 1.0 B B21 1 0.50000000 0.36841674 0.81510755 1.0 B B22 1 0.50000000 0.13158326 0.31510755 1.0 B B23 1 0.50000000 0.86841674 0.68489245 1.0 B B24 1 0.50000000 0.98188049 0.21292653 1.0 B B25 1 0.50000000 0.01811951 0.78707347 1.0 B B26 1 0.50000000 0.48188049 0.28707347 1.0 B B27 1 0.50000000 0.51811951 0.71292653 1.0 B B28 1 0.50000000 0.60785043 0.02997767 1.0 B B29 1 0.50000000 0.39214957 0.97002233 1.0 B B30 1 0.50000000 0.10785043 0.47002233 1.0 B B31 1 0.50000000 0.89214957 0.52997767 1.0 Mo Mo32 1 0.00000000 0.63870021 0.32142277 1.0 Mo Mo33 1 0.00000000 0.36129979 0.67857723 1.0 Mo Mo34 1 0.00000000 0.13870021 0.17857723 1.0 Mo Mo35 1 0.00000000 0.86129979 0.82142277 1.0