# generated using pymatgen data_Cs3MnH5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.61622807 _cell_length_b 8.61620837 _cell_length_c 8.61610567 _cell_angle_alpha 122.11045086 _cell_angle_beta 122.11048016 _cell_angle_gamma 86.38137067 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cs3MnH5 _chemical_formula_sum 'Cs6 Mn2 H10' _cell_volume 436.92782219 _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 Cs Cs0 1 0.24999940 0.25000086 0.00000039 1.0 Cs Cs1 1 0.75000025 0.75000004 0.00000026 1.0 Cs Cs2 1 0.18145057 0.68145094 0.86290392 1.0 Cs Cs3 1 0.81854949 0.31854967 0.13709700 1.0 Cs Cs4 1 0.68144603 0.81855429 0.50000017 1.0 Cs Cs5 1 0.31855407 0.18144680 0.50000003 1.0 Mn Mn6 1 0.25001064 0.75000377 0.50000559 1.0 Mn Mn7 1 0.74998867 0.24998872 0.49998737 1.0 H H8 1 0.45480188 0.95479968 0.74015892 1.0 H H9 1 0.21464340 0.71464122 0.25985260 1.0 H H10 1 0.95479349 0.21464459 0.50000025 1.0 H H11 1 0.71464411 0.45479897 0.50000000 1.0 H H12 1 0.54520804 0.04520479 0.25984889 1.0 H H13 1 0.78535925 0.28535677 0.74015503 1.0 H H14 1 0.04519688 0.78535277 0.49999421 1.0 H H15 1 0.28535218 0.54520607 0.49999443 1.0 H H16 1 0.49999954 0.49999996 -0.00000038 1.0 H H17 1 0.00000011 0.00000010 0.00000029 1.0