# generated using pymatgen
data_Tm3Pa(B4Mo)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.61666830
_cell_length_b   5.98846091
_cell_length_c   11.57665625
_cell_angle_alpha   90.13627601
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm3Pa(B4Mo)4
_chemical_formula_sum   'Tm3 Pa1 B16 Mo4'
_cell_volume   250.72971572
_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
  Tm  Tm0  1  0.00000000  0.62696586  0.35032313  1.0
  Tm  Tm1  1  0.00000000  0.37349252  0.64828625  1.0
  Tm  Tm2  1  0.00000000  0.12740462  0.15114634  1.0
  Pa  Pa3  1  0.00000000  0.87409371  0.84918569  1.0
  B  B4  1  0.50000000  0.78656971  0.18761432  1.0
  B  B5  1  0.50000000  0.21009015  0.81396272  1.0
  B  B6  1  0.50000000  0.28883628  0.31405280  1.0
  B  B7  1  0.50000000  0.71114532  0.68522648  1.0
  B  B8  1  0.50000000  0.86599859  0.03249417  1.0
  B  B9  1  0.50000000  0.13283395  0.96832826  1.0
  B  B10  1  0.50000000  0.36753607  0.46774251  1.0
  B  B11  1  0.50000000  0.63339402  0.53125986  1.0
  B  B12  1  0.50000000  0.88467777  0.45184010  1.0
  B  B13  1  0.50000000  0.11587695  0.54678697  1.0
  B  B14  1  0.50000000  0.38332729  0.04867208  1.0
  B  B15  1  0.50000000  0.61333387  0.95308010  1.0
  B  B16  1  0.50000000  0.97683038  0.30609893  1.0
  B  B17  1  0.50000000  0.02341421  0.69276713  1.0
  B  B18  1  0.50000000  0.47638932  0.19449505  1.0
  B  B19  1  0.50000000  0.52654653  0.80658435  1.0
  Mo  Mo20  1  0.00000000  0.63033769  0.08479314  1.0
  Mo  Mo21  1  0.00000000  0.36861647  0.91453871  1.0
  Mo  Mo22  1  0.00000000  0.13015146  0.41614099  1.0
  Mo  Mo23  1  0.00000000  0.87213625  0.58457895  1.0