# generated using pymatgen data_Pr6Si4Ni7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.95179000 _cell_length_b 7.43818800 _cell_length_c 29.78581100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr6Si4Ni7 _chemical_formula_sum 'Pr24 Si16 Ni28' _cell_volume 1318.63372751 _cell_formula_units_Z 4 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 Pr Pr0 1 0.87308100 0.52103600 0.25000000 1.0 Pr Pr1 1 0.88630100 0.61703600 0.92072400 1.0 Pr Pr2 1 0.62358400 0.25000000 0.50000000 1.0 Pr Pr3 1 0.60608400 0.61224100 0.81805900 1.0 Pr Pr4 1 0.39391600 0.38775900 0.31805900 1.0 Pr Pr5 1 0.39391600 0.11224100 0.81805900 1.0 Pr Pr6 1 0.12691900 0.47896400 0.75000000 1.0 Pr Pr7 1 0.37641600 0.75000000 0.00000000 1.0 Pr Pr8 1 0.11369900 0.38296400 0.42072400 1.0 Pr Pr9 1 0.60608400 0.88775900 0.18194100 1.0 Pr Pr10 1 0.11369900 0.11703600 0.92072400 1.0 Pr Pr11 1 0.88630100 0.88296400 0.42072400 1.0 Pr Pr12 1 0.37641600 0.75000000 0.50000000 1.0 Pr Pr13 1 0.12691900 0.02103600 0.25000000 1.0 Pr Pr14 1 0.11369900 0.38296400 0.07927600 1.0 Pr Pr15 1 0.60608400 0.61224100 0.68194100 1.0 Pr Pr16 1 0.87308100 0.97896400 0.75000000 1.0 Pr Pr17 1 0.11369900 0.11703600 0.57927600 1.0 Pr Pr18 1 0.60608400 0.88775900 0.31805900 1.0 Pr Pr19 1 0.39391600 0.11224100 0.68194100 1.0 Pr Pr20 1 0.88630100 0.61703600 0.57927600 1.0 Pr Pr21 1 0.88630100 0.88296400 0.07927600 1.0 Pr Pr22 1 0.62358400 0.25000000 0.00000000 1.0 Pr Pr23 1 0.39391600 0.38775900 0.18194100 1.0 Si Si24 1 0.11196900 0.76923400 0.67233800 1.0 Si Si25 1 0.39102000 0.46547700 0.58306000 1.0 Si Si26 1 0.60898000 0.53452300 0.41694000 1.0 Si Si27 1 0.60898000 0.53452300 0.08306000 1.0 Si Si28 1 0.39102000 0.03452300 0.08306000 1.0 Si Si29 1 0.88803100 0.26923400 0.82766200 1.0 Si Si30 1 0.88803100 0.23076600 0.32766200 1.0 Si Si31 1 0.39102000 0.46547700 0.91694000 1.0 Si Si32 1 0.88803100 0.26923400 0.67233800 1.0 Si Si33 1 0.11196900 0.73076600 0.32766200 1.0 Si Si34 1 0.60898000 0.96547700 0.91694000 1.0 Si Si35 1 0.11196900 0.73076600 0.17233800 1.0 Si Si36 1 0.60898000 0.96547700 0.58306000 1.0 Si Si37 1 0.39102000 0.03452300 0.41694000 1.0 Si Si38 1 0.11196900 0.76923400 0.82766200 1.0 Si Si39 1 0.88803100 0.23076600 0.17233800 1.0 Ni Ni40 1 0.64580900 0.25747400 0.89029600 1.0 Ni Ni41 1 0.15018900 0.09448600 0.01826900 1.0 Ni Ni42 1 0.84106000 0.97160000 0.85197400 1.0 Ni Ni43 1 0.31209000 0.82472100 0.75000000 1.0 Ni Ni44 1 0.35419100 0.75747400 0.89029600 1.0 Ni Ni45 1 0.15018900 0.40551400 0.51826900 1.0 Ni Ni46 1 0.84106000 0.52840000 0.14802600 1.0 Ni Ni47 1 0.84981100 0.90551400 0.51826900 1.0 Ni Ni48 1 0.15018900 0.09448600 0.48173100 1.0 Ni Ni49 1 0.35419100 0.75747400 0.60970400 1.0 Ni Ni50 1 0.84106000 0.52840000 0.35197400 1.0 Ni Ni51 1 0.15894000 0.02840000 0.35197400 1.0 Ni Ni52 1 0.15894000 0.47160000 0.85197400 1.0 Ni Ni53 1 0.84981100 0.59448600 0.48173100 1.0 Ni Ni54 1 0.15894000 0.47160000 0.64802600 1.0 Ni Ni55 1 0.68791000 0.17527900 0.25000000 1.0 Ni Ni56 1 0.64580900 0.24252600 0.39029600 1.0 Ni Ni57 1 0.64580900 0.24252600 0.10970400 1.0 Ni Ni58 1 0.84981100 0.90551400 0.98173100 1.0 Ni Ni59 1 0.15018900 0.40551400 0.98173100 1.0 Ni Ni60 1 0.68791000 0.32472100 0.75000000 1.0 Ni Ni61 1 0.15894000 0.02840000 0.14802600 1.0 Ni Ni62 1 0.84106000 0.97160000 0.64802600 1.0 Ni Ni63 1 0.84981100 0.59448600 0.01826900 1.0 Ni Ni64 1 0.31209000 0.67527900 0.25000000 1.0 Ni Ni65 1 0.35419100 0.74252600 0.10970400 1.0 Ni Ni66 1 0.64580900 0.25747400 0.60970400 1.0 Ni Ni67 1 0.35419100 0.74252600 0.39029600 1.0