# generated using pymatgen data_LaCoH4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.34133073 _cell_length_b 6.34133086 _cell_length_c 5.02737396 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 145.10685469 _symmetry_Int_Tables_number 1 _chemical_formula_structural LaCoH4 _chemical_formula_sum 'La2 Co2 H8' _cell_volume 115.64697836 _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 La La0 1 0.86754886 0.13245114 0.75000000 1.0 La La1 1 0.13246163 0.86753837 0.25000000 1.0 Co Co2 1 0.59291808 0.40708192 0.75000000 1.0 Co Co3 1 0.40707424 0.59292576 0.25000000 1.0 H H4 1 0.08780439 0.91219561 0.75000000 1.0 H H5 1 0.91232131 0.08767869 0.25000000 1.0 H H6 1 0.68942206 0.31057794 0.51461177 1.0 H H7 1 0.31054223 0.68945777 0.48532915 1.0 H H8 1 0.68942206 0.31057794 0.98538823 1.0 H H9 1 0.31054223 0.68945777 0.01467085 1.0 H H10 1 0.49997095 0.50002905 0.99993848 1.0 H H11 1 0.49997095 0.50002905 0.50006152 1.0