# generated using pymatgen
data_TmMnB4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.34595892
_cell_length_b   5.89707774
_cell_length_c   11.41431293
_cell_angle_alpha   90.00160790
_cell_angle_beta   89.99999888
_cell_angle_gamma   89.99999508
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TmMnB4
_chemical_formula_sum   'Tm4 Mn4 B16'
_cell_volume   225.22014429
_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
  Tm  Tm0  1  0.50000015  0.37220462  0.15012249  1.0
  Tm  Tm1  1  0.50000010  0.62778434  0.84985798  1.0
  Tm  Tm2  1  0.50000006  0.12780046  0.65017308  1.0
  Tm  Tm3  1  0.49999984  0.87219921  0.34985426  1.0
  Mn  Mn4  1  0.49999969  0.36772270  0.41340941  1.0
  Mn  Mn5  1  0.49999947  0.63227715  0.58660554  1.0
  Mn  Mn6  1  0.50000025  0.13228616  0.91340437  1.0
  Mn  Mn7  1  0.49999996  0.86773349  0.08657733  1.0
  B  B8  1  0.00000035  0.11328318  0.04695320  1.0
  B  B9  1  0.00000031  0.88672236  0.95302841  1.0
  B  B10  1  0.00000004  0.38671043  0.54696818  1.0
  B  B11  1  0.00000014  0.61327873  0.45304790  1.0
  B  B12  1  -0.00000024  0.13675798  0.46799378  1.0
  B  B13  1  -0.00000014  0.86323990  0.53201895  1.0
  B  B14  1  0.00000050  0.36323940  0.96798063  1.0
  B  B15  1  0.00000026  0.63675964  0.03200341  1.0
  B  B16  1  0.00000005  0.02341818  0.19169730  1.0
  B  B17  1  0.00000026  0.97657182  0.80829245  1.0
  B  B18  1  -0.00000003  0.47654806  0.69172596  1.0
  B  B19  1  0.00000007  0.52343316  0.30828380  1.0
  B  B20  1  -0.00000032  0.21496772  0.31463135  1.0
  B  B21  1  -0.00000037  0.78504288  0.68537856  1.0
  B  B22  1  -0.00000015  0.28501562  0.81464845  1.0
  B  B23  1  -0.00000025  0.71500382  0.18534223  1.0