# generated using pymatgen data_Hf12Ga3Cu9N4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.29924235 _cell_length_b 8.29924226 _cell_length_c 8.33625194 _cell_angle_alpha 60.14675398 _cell_angle_beta 60.14675964 _cell_angle_gamma 59.99999933 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf12Ga3Cu9N4 _chemical_formula_sum 'Hf12 Ga3 Cu9 N4' _cell_volume 406.90453615 _cell_formula_units_Z 1 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 Hf Hf0 1 0.80844155 0.19414956 0.18896733 1.0 Hf Hf1 1 0.19414956 0.80844155 0.18896733 1.0 Hf Hf2 1 0.80844155 0.80844155 0.18896733 1.0 Hf Hf3 1 0.19091502 0.80839932 0.80976963 1.0 Hf Hf4 1 0.80839932 0.19091502 0.80976963 1.0 Hf Hf5 1 0.19091502 0.19091502 0.80976963 1.0 Hf Hf6 1 0.44155845 0.05585044 0.06103267 1.0 Hf Hf7 1 0.05585044 0.44155845 0.06103267 1.0 Hf Hf8 1 0.44155845 0.44155845 0.06103267 1.0 Hf Hf9 1 0.05908498 0.44160068 0.44023037 1.0 Hf Hf10 1 0.44160068 0.05908498 0.44023037 1.0 Hf Hf11 1 0.05908498 0.05908498 0.44023037 1.0 Ga Ga12 1 0.62500000 0.62500000 0.62500000 1.0 Ga Ga13 1 0.12500000 0.62500000 0.62500000 1.0 Ga Ga14 1 0.62500000 0.12500000 0.62500000 1.0 Cu Cu15 1 0.41697166 0.41697166 0.74908201 1.0 Cu Cu16 1 0.41932590 0.41932590 0.41428566 1.0 Cu Cu17 1 0.74706054 0.41932590 0.41428566 1.0 Cu Cu18 1 0.41932590 0.74706054 0.41428566 1.0 Cu Cu19 1 0.83302834 0.83302834 0.50091799 1.0 Cu Cu20 1 0.83067410 0.83067410 0.83571434 1.0 Cu Cu21 1 0.50293946 0.83067410 0.83571434 1.0 Cu Cu22 1 0.83067410 0.50293946 0.83571434 1.0 Cu Cu23 1 0.62500000 0.62500000 0.12500000 1.0 N N24 1 0.12500000 0.12500000 0.62500000 1.0 N N25 1 0.12500000 0.12500000 0.12500000 1.0 N N26 1 0.62500000 0.12500000 0.12500000 1.0 N N27 1 0.12500000 0.62500000 0.12500000 1.0