# generated using pymatgen
data_Tm2CuO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.83429200
_cell_length_b   4.67142000
_cell_length_c   6.04076337
_cell_angle_alpha   76.99414072
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm2CuO4
_chemical_formula_sum   'Tm4 Cu2 O8'
_cell_volume   160.41411429
_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  0.96258200  0.33844300  0.30486600  1.0
  Tm  Tm1  1  0.46258200  0.66155700  0.19513400  1.0
  Tm  Tm2  1  0.53741800  0.33844300  0.80486600  1.0
  Tm  Tm3  1  0.03741800  0.66155700  0.69513400  1.0
  Cu  Cu4  1  0.00000000  0.00000000  0.00000000  1.0
  Cu  Cu5  1  0.50000000  0.00000000  0.50000000  1.0
  O  O6  1  0.89244300  0.16330700  0.69445100  1.0
  O  O7  1  0.69612900  0.64095600  0.49919000  1.0
  O  O8  1  0.60755700  0.16330700  0.19445100  1.0
  O  O9  1  0.80387100  0.64095600  0.99919000  1.0
  O  O10  1  0.19612900  0.35904400  0.00081000  1.0
  O  O11  1  0.39244300  0.83669300  0.80554900  1.0
  O  O12  1  0.30387100  0.35904400  0.50081000  1.0
  O  O13  1  0.10755700  0.83669300  0.30554900  1.0