# generated using pymatgen data_Nd3CdHg4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.48752502 _cell_length_b 6.48754421 _cell_length_c 10.53632539 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 107.11418536 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd3CdHg4 _chemical_formula_sum 'Nd6 Cd2 Hg8' _cell_volume 423.81791447 _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 0.58334281 0.58334329 0.25000000 1.0 Nd Nd1 1 0.41667339 0.41667088 0.75000000 1.0 Nd Nd2 1 0.20901048 0.79100343 0.50003323 1.0 Nd Nd3 1 0.20901048 0.79100343 0.99996677 1.0 Nd Nd4 1 0.79100410 0.20901020 0.50003354 1.0 Nd Nd5 1 0.79100410 0.20901020 0.99996646 1.0 Cd Cd6 1 0.00835848 0.00836497 0.25000000 1.0 Cd Cd7 1 0.99162335 0.99162416 0.75000000 1.0 Hg Hg8 1 0.29598184 0.29597961 0.03250819 1.0 Hg Hg9 1 0.70400078 0.70400203 0.96749970 1.0 Hg Hg10 1 0.29598184 0.29597961 0.46749181 1.0 Hg Hg11 1 0.70400078 0.70400203 0.53250030 1.0 Hg Hg12 1 0.48375944 0.04373999 0.25000000 1.0 Hg Hg13 1 0.95625683 0.51625672 0.75000000 1.0 Hg Hg14 1 0.51625363 0.95625054 0.75000000 1.0 Hg Hg15 1 0.04373868 0.48375790 0.25000000 1.0