# generated using pymatgen
data_LuHf3Si4Mo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.99233788
_cell_length_b   6.99233788
_cell_length_c   12.75385213
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LuHf3Si4Mo
_chemical_formula_sum   'Lu4 Hf12 Si16 Mo4'
_cell_volume   623.57140149
_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
  Lu  Lu0  1  0.49713659  0.15654177  0.53277729  1.0
  Lu  Lu1  1  0.50286341  0.84345823  0.03277729  1.0
  Lu  Lu2  1  0.65654177  0.00286341  0.28277729  1.0
  Lu  Lu3  1  0.34345823  0.99713659  0.78277729  1.0
  Hf  Hf4  1  0.84642372  0.49904534  0.96831749  1.0
  Hf  Hf5  1  0.15357628  0.50095466  0.46831749  1.0
  Hf  Hf6  1  0.99904534  0.65357628  0.71831749  1.0
  Hf  Hf7  1  0.00095466  0.34642372  0.21831749  1.0
  Hf  Hf8  1  0.49312489  0.35693105  0.12597623  1.0
  Hf  Hf9  1  0.50687511  0.64306895  0.62597623  1.0
  Hf  Hf10  1  0.85693105  0.00687511  0.87597623  1.0
  Hf  Hf11  1  0.14306895  0.99312489  0.37597623  1.0
  Hf  Hf12  1  0.64427383  0.50327518  0.37385656  1.0
  Hf  Hf13  1  0.35572617  0.49672482  0.87385656  1.0
  Hf  Hf14  1  0.00327518  0.85572617  0.12385656  1.0
  Hf  Hf15  1  0.99672482  0.14427383  0.62385656  1.0
  Si  Si16  1  0.79983367  0.15039569  0.07074735  1.0
  Si  Si17  1  0.20016633  0.84960431  0.57074735  1.0
  Si  Si18  1  0.65039569  0.70016633  0.82074735  1.0
  Si  Si19  1  0.34960431  0.29983367  0.32074735  1.0
  Si  Si20  1  0.86118187  0.21035168  0.42849711  1.0
  Si  Si21  1  0.13881813  0.78964832  0.92849711  1.0
  Si  Si22  1  0.71035168  0.63881813  0.17849711  1.0
  Si  Si23  1  0.28964832  0.36118187  0.67849711  1.0
  Si  Si24  1  0.55225565  0.20353657  0.93418065  1.0
  Si  Si25  1  0.44774435  0.79646343  0.43418065  1.0
  Si  Si26  1  0.70353657  0.94774435  0.68418065  1.0
  Si  Si27  1  0.29646343  0.05225565  0.18418065  1.0
  Si  Si28  1  0.80384318  0.45238799  0.56563520  1.0
  Si  Si29  1  0.19615682  0.54761201  0.06563520  1.0
  Si  Si30  1  0.95238799  0.69615682  0.31563520  1.0
  Si  Si31  1  0.04761201  0.30384318  0.81563520  1.0
  Mo  Mo32  1  0.67977778  0.32826453  0.75001112  1.0
  Mo  Mo33  1  0.32022222  0.67173547  0.25001112  1.0
  Mo  Mo34  1  0.82826453  0.82022222  0.50001112  1.0
  Mo  Mo35  1  0.17173547  0.17977778  0.00001112  1.0