# generated using pymatgen data_Hf3(Mn2Si3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 16.95296300 _cell_length_b 16.95296300 _cell_length_c 5.03105200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf3(Mn2Si3)2 _chemical_formula_sum 'Hf24 Mn32 Si48' _cell_volume 1445.93920894 _cell_formula_units_Z 8 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 0.20995800 0.47249300 0.00000000 1.0 Hf Hf1 1 0.79004200 0.52750700 0.00000000 1.0 Hf Hf2 1 0.47249300 0.79004200 0.50000000 1.0 Hf Hf3 1 0.70995800 0.02750700 0.00000000 1.0 Hf Hf4 1 0.52750700 0.20995800 0.50000000 1.0 Hf Hf5 1 0.29004200 0.97249300 0.00000000 1.0 Hf Hf6 1 0.97249300 0.70995800 0.50000000 1.0 Hf Hf7 1 0.02750700 0.29004200 0.50000000 1.0 Hf Hf8 1 0.29823600 0.28321300 0.00000000 1.0 Hf Hf9 1 0.70176400 0.71678700 0.00000000 1.0 Hf Hf10 1 0.28321300 0.70176400 0.50000000 1.0 Hf Hf11 1 0.79823600 0.21678700 0.00000000 1.0 Hf Hf12 1 0.71678700 0.29823600 0.50000000 1.0 Hf Hf13 1 0.20176400 0.78321300 0.00000000 1.0 Hf Hf14 1 0.78321300 0.79823600 0.50000000 1.0 Hf Hf15 1 0.21678700 0.20176400 0.50000000 1.0 Hf Hf16 1 0.10143100 0.20332600 0.00000000 1.0 Hf Hf17 1 0.89856900 0.79667400 0.00000000 1.0 Hf Hf18 1 0.20332600 0.89856900 0.50000000 1.0 Hf Hf19 1 0.60143100 0.29667400 0.00000000 1.0 Hf Hf20 1 0.79667400 0.10143100 0.50000000 1.0 Hf Hf21 1 0.39856900 0.70332600 0.00000000 1.0 Hf Hf22 1 0.70332600 0.60143100 0.50000000 1.0 Hf Hf23 1 0.29667400 0.39856900 0.50000000 1.0 Mn Mn24 1 0.12490300 0.62490300 0.25000000 1.0 Mn Mn25 1 0.87509700 0.37509700 0.75000000 1.0 Mn Mn26 1 0.87509700 0.37509700 0.25000000 1.0 Mn Mn27 1 0.62490300 0.87509700 0.75000000 1.0 Mn Mn28 1 0.12490300 0.62490300 0.75000000 1.0 Mn Mn29 1 0.37509700 0.12490300 0.25000000 1.0 Mn Mn30 1 0.37509700 0.12490300 0.75000000 1.0 Mn Mn31 1 0.62490300 0.87509700 0.25000000 1.0 Mn Mn32 1 0.15496100 0.05178000 0.24995000 1.0 Mn Mn33 1 0.84503900 0.94822000 0.75005000 1.0 Mn Mn34 1 0.84503900 0.94822000 0.24995000 1.0 Mn Mn35 1 0.05178000 0.84503900 0.74995000 1.0 Mn Mn36 1 0.65496100 0.44822000 0.75005000 1.0 Mn Mn37 1 0.15496100 0.05178000 0.75005000 1.0 Mn Mn38 1 0.94822000 0.15496100 0.25005000 1.0 Mn Mn39 1 0.34503900 0.55178000 0.24995000 1.0 Mn Mn40 1 0.94822000 0.15496100 0.74995000 1.0 Mn Mn41 1 0.34503900 0.55178000 0.75005000 1.0 Mn Mn42 1 0.05178000 0.84503900 0.25005000 1.0 Mn Mn43 1 0.65496100 0.44822000 0.24995000 1.0 Mn Mn44 1 0.55178000 0.65496100 0.25005000 1.0 Mn Mn45 1 0.44822000 0.34503900 0.74995000 1.0 Mn Mn46 1 0.44822000 0.34503900 0.25005000 1.0 Mn Mn47 1 0.55178000 0.65496100 0.74995000 1.0 Mn Mn48 1 0.03971700 0.38502500 0.00000000 1.0 Mn Mn49 1 0.96028300 0.61497500 0.00000000 1.0 Mn Mn50 1 0.38502500 0.96028300 0.50000000 1.0 Mn Mn51 1 0.53971700 0.11497500 0.00000000 1.0 Mn Mn52 1 0.61497500 0.03971700 0.50000000 1.0 Mn Mn53 1 0.46028300 0.88502500 0.00000000 1.0 Mn Mn54 1 0.88502500 0.53971700 0.50000000 1.0 Mn Mn55 1 0.11497500 0.46028300 0.50000000 1.0 Si Si56 1 0.43536900 0.02165700 0.00000000 1.0 Si Si57 1 0.56463100 0.97834300 0.00000000 1.0 Si Si58 1 0.02165700 0.56463100 0.50000000 1.0 Si Si59 1 0.93536900 0.47834300 0.00000000 1.0 Si Si60 1 0.97834300 0.43536900 0.50000000 1.0 Si Si61 1 0.06463100 0.52165700 0.00000000 1.0 Si Si62 1 0.52165700 0.93536900 0.50000000 1.0 Si Si63 1 0.47834300 0.06463100 0.50000000 1.0 Si Si64 1 0.03078600 0.06214600 0.00000000 1.0 Si Si65 1 0.96921400 0.93785400 0.00000000 1.0 Si Si66 1 0.06214600 0.96921400 0.50000000 1.0 Si Si67 1 0.53078600 0.43785400 0.00000000 1.0 Si Si68 1 0.93785400 0.03078600 0.50000000 1.0 Si Si69 1 0.46921400 0.56214600 0.00000000 1.0 Si Si70 1 0.56214600 0.53078600 0.50000000 1.0 Si Si71 1 0.43785400 0.46921400 0.50000000 1.0 Si Si72 1 0.36284700 0.43086700 0.00000000 1.0 Si Si73 1 0.63715300 0.56913300 0.00000000 1.0 Si Si74 1 0.43086700 0.63715300 0.50000000 1.0 Si Si75 1 0.86284700 0.06913300 0.00000000 1.0 Si Si76 1 0.56913300 0.36284700 0.50000000 1.0 Si Si77 1 0.13715300 0.93086700 0.00000000 1.0 Si Si78 1 0.93086700 0.86284700 0.50000000 1.0 Si Si79 1 0.06913300 0.13715300 0.50000000 1.0 Si Si80 1 0.45163500 0.22423200 0.00000000 1.0 Si Si81 1 0.54836500 0.77576800 0.00000000 1.0 Si Si82 1 0.22423200 0.54836500 0.50000000 1.0 Si Si83 1 0.95163500 0.27576800 0.00000000 1.0 Si Si84 1 0.77576800 0.45163500 0.50000000 1.0 Si Si85 1 0.04836500 0.72423200 0.00000000 1.0 Si Si86 1 0.72423200 0.95163500 0.50000000 1.0 Si Si87 1 0.27576800 0.04836500 0.50000000 1.0 Si Si88 1 0.66055800 0.16055800 0.25000000 1.0 Si Si89 1 0.33944200 0.83944200 0.75000000 1.0 Si Si90 1 0.33944200 0.83944200 0.25000000 1.0 Si Si91 1 0.16055800 0.33944200 0.75000000 1.0 Si Si92 1 0.66055800 0.16055800 0.75000000 1.0 Si Si93 1 0.83944200 0.66055800 0.25000000 1.0 Si Si94 1 0.83944200 0.66055800 0.75000000 1.0 Si Si95 1 0.16055800 0.33944200 0.25000000 1.0 Si Si96 1 0.24893600 0.13049400 0.00000000 1.0 Si Si97 1 0.75106400 0.86950600 0.00000000 1.0 Si Si98 1 0.13049400 0.75106400 0.50000000 1.0 Si Si99 1 0.74893600 0.36950600 0.00000000 1.0 Si Si100 1 0.86950600 0.24893600 0.50000000 1.0 Si Si101 1 0.25106400 0.63049400 0.00000000 1.0 Si Si102 1 0.63049400 0.74893600 0.50000000 1.0 Si Si103 1 0.36950600 0.25106400 0.50000000 1.0