# generated using pymatgen data_Nd5GaSi2H _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.91586829 _cell_length_b 8.91586864 _cell_length_c 8.91586720 _cell_angle_alpha 127.28341803 _cell_angle_beta 127.28341306 _cell_angle_gamma 77.78877460 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd5GaSi2H _chemical_formula_sum 'Nd10 Ga2 Si4 H2' _cell_volume 434.94393364 _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 Nd Nd0 1 0.50000000 0.50000000 0.00000000 1.0 Nd Nd1 1 0.00000000 0.00000000 0.00000000 1.0 Nd Nd2 1 0.52596776 0.02596776 0.84419988 1.0 Nd Nd3 1 0.18177088 0.68177088 0.15580012 1.0 Nd Nd4 1 0.02596776 0.18177088 0.50000000 1.0 Nd Nd5 1 0.68177088 0.52596776 0.50000000 1.0 Nd Nd6 1 0.47403224 0.97403224 0.15580012 1.0 Nd Nd7 1 0.81822912 0.31822912 0.84419988 1.0 Nd Nd8 1 0.97403224 0.81822912 0.50000000 1.0 Nd Nd9 1 0.31822912 0.47403224 0.50000000 1.0 Ga Ga10 1 0.25000000 0.25000000 0.00000000 1.0 Ga Ga11 1 0.75000000 0.75000000 0.00000000 1.0 Si Si12 1 0.88488639 0.38488639 0.26977278 1.0 Si Si13 1 0.11511361 0.61511361 0.73022722 1.0 Si Si14 1 0.38488639 0.11511361 0.50000000 1.0 Si Si15 1 0.61511361 0.88488639 0.50000000 1.0 H H16 1 0.25000000 0.75000000 0.50000000 1.0 H H17 1 0.75000000 0.25000000 0.50000000 1.0