# generated using pymatgen
data_Tm3Hf(Ni4As3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.85096856
_cell_length_b   11.03473848
_cell_length_c   12.68891585
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm3Hf(Ni4As3)2
_chemical_formula_sum   'Tm6 Hf2 Ni16 As12'
_cell_volume   539.20825893
_cell_formula_units_Z   2
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
  Tm  Tm0  1  0.00000000  0.50000000  0.52942048  1.0
  Tm  Tm1  1  0.50000000  0.00000000  0.47057952  1.0
  Tm  Tm2  1  0.50000000  0.82312804  0.20658171  1.0
  Tm  Tm3  1  0.50000000  0.17687196  0.20658171  1.0
  Tm  Tm4  1  0.00000000  0.67687196  0.79341829  1.0
  Tm  Tm5  1  0.00000000  0.32312804  0.79341829  1.0
  Hf  Hf6  1  0.50000000  0.50000000  0.15224640  1.0
  Hf  Hf7  1  0.00000000  0.00000000  0.84775360  1.0
  Ni  Ni8  1  0.50000000  0.50000000  0.69889383  1.0
  Ni  Ni9  1  0.00000000  0.00000000  0.30110617  1.0
  Ni  Ni10  1  0.00000000  0.50000000  0.98467296  1.0
  Ni  Ni11  1  0.50000000  0.00000000  0.01532704  1.0
  Ni  Ni12  1  0.50000000  0.33772106  0.99190869  1.0
  Ni  Ni13  1  0.50000000  0.66227894  0.99190869  1.0
  Ni  Ni14  1  0.00000000  0.16227894  0.00809131  1.0
  Ni  Ni15  1  0.00000000  0.83772106  0.00809131  1.0
  Ni  Ni16  1  0.50000000  0.30197471  0.42758385  1.0
  Ni  Ni17  1  0.50000000  0.69802529  0.42758385  1.0
  Ni  Ni18  1  0.00000000  0.19802529  0.57241615  1.0
  Ni  Ni19  1  0.00000000  0.80197471  0.57241615  1.0
  Ni  Ni20  1  0.50000000  0.87943033  0.70716272  1.0
  Ni  Ni21  1  0.50000000  0.12056967  0.70716272  1.0
  Ni  Ni22  1  0.00000000  0.62056967  0.29283728  1.0
  Ni  Ni23  1  0.00000000  0.37943033  0.29283728  1.0
  As  As24  1  0.50000000  0.50000000  0.87678506  1.0
  As  As25  1  0.00000000  0.00000000  0.12321494  1.0
  As  As26  1  0.50000000  0.50000000  0.36084368  1.0
  As  As27  1  0.00000000  0.00000000  0.63915632  1.0
  As  As28  1  0.50000000  0.31424992  0.61428437  1.0
  As  As29  1  0.50000000  0.68575008  0.61428437  1.0
  As  As30  1  0.00000000  0.18575008  0.38571563  1.0
  As  As31  1  0.00000000  0.81424992  0.38571563  1.0
  As  As32  1  0.50000000  0.83549746  0.89105539  1.0
  As  As33  1  0.50000000  0.16450254  0.89105539  1.0
  As  As34  1  0.00000000  0.66450254  0.10894461  1.0
  As  As35  1  0.00000000  0.33549746  0.10894461  1.0