# generated using pymatgen data_Pa2Si4Mo3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.92808638 _cell_length_b 6.77686479 _cell_length_c 6.92091214 _cell_angle_alpha 70.08400364 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pa2Si4Mo3 _chemical_formula_sum 'Pa4 Si8 Mo6' _cell_volume 305.50793281 _cell_formula_units_Z 2 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 Pa Pa0 1 0.33325464 0.55890119 0.80833483 1.0 Pa Pa1 1 0.83325464 0.94109881 0.19166517 1.0 Pa Pa2 1 0.66674536 0.44109881 0.19166517 1.0 Pa Pa3 1 0.16674536 0.05890119 0.80833483 1.0 Si Si4 1 0.54622168 0.87177498 0.90839078 1.0 Si Si5 1 0.04622168 0.62822502 0.09160922 1.0 Si Si6 1 0.45377832 0.12822502 0.09160922 1.0 Si Si7 1 0.95377832 0.37177498 0.90839078 1.0 Si Si8 1 0.13320924 0.86789473 0.49194638 1.0 Si Si9 1 0.63320924 0.63210527 0.50805362 1.0 Si Si10 1 0.86679076 0.13210527 0.50805362 1.0 Si Si11 1 0.36679076 0.36789473 0.49194638 1.0 Mo Mo12 1 0.50000000 0.00000000 0.50000000 1.0 Mo Mo13 1 0.00000000 0.50000000 0.50000000 1.0 Mo Mo14 1 0.83815286 0.75521394 0.75926991 1.0 Mo Mo15 1 0.33815286 0.74478606 0.24073009 1.0 Mo Mo16 1 0.16184714 0.24478606 0.24073009 1.0 Mo Mo17 1 0.66184714 0.25521394 0.75926991 1.0