# generated using pymatgen
data_LuZr3(Al3Rh)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.42733670
_cell_length_b   7.42499568
_cell_length_c   9.20938078
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.63441084
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LuZr3(Al3Rh)6
_chemical_formula_sum   'Lu1 Zr3 Al18 Rh6'
_cell_volume   441.44695515
_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
  Lu  Lu0  1  0.32779226  0.00762262  0.75000000  1.0
  Zr  Zr1  1  0.99366596  0.67278720  0.25000000  1.0
  Zr  Zr2  1  0.00806561  0.32895536  0.75000000  1.0
  Zr  Zr3  1  0.67065362  0.99229222  0.25000000  1.0
  Al  Al4  1  0.12209389  0.12321248  0.25000000  1.0
  Al  Al5  1  0.87278123  0.87548020  0.75000000  1.0
  Al  Al6  1  0.99728605  0.33459388  0.07662579  1.0
  Al  Al7  1  0.00094212  0.66331856  0.92493664  1.0
  Al  Al8  1  0.00094212  0.66331856  0.57506336  1.0
  Al  Al9  1  0.33514581  0.99829301  0.42149874  1.0
  Al  Al10  1  0.99728605  0.33459388  0.42337421  1.0
  Al  Al11  1  0.66675487  0.00220821  0.57530342  1.0
  Al  Al12  1  0.66675487  0.00220821  0.92469658  1.0
  Al  Al13  1  0.33514581  0.99829301  0.07850126  1.0
  Al  Al14  1  0.33166300  0.33334251  0.55297732  1.0
  Al  Al15  1  0.66860651  0.66837966  0.44439032  1.0
  Al  Al16  1  0.66860651  0.66837966  0.05560968  1.0
  Al  Al17  1  0.33166300  0.33334251  0.94702268  1.0
  Al  Al18  1  0.33860556  0.55346119  0.25000000  1.0
  Al  Al19  1  0.66451505  0.44918101  0.75000000  1.0
  Al  Al20  1  0.55589330  0.33969213  0.25000000  1.0
  Al  Al21  1  0.44471064  0.65701440  0.75000000  1.0
  Rh  Rh22  1  0.67287535  0.32734370  0.00053961  1.0
  Rh  Rh23  1  0.32770032  0.67345160  0.00135939  1.0
  Rh  Rh24  1  0.32770032  0.67345160  0.49864061  1.0
  Rh  Rh25  1  0.67287535  0.32734370  0.49946039  1.0
  Rh  Rh26  1  0.99963641  0.99921896  0.00058841  1.0
  Rh  Rh27  1  0.99963641  0.99921896  0.49941159  1.0