# generated using pymatgen
data_TmB2C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.74108796
_cell_length_b   6.74108796
_cell_length_c   7.26716005
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TmB2C
_chemical_formula_sum   'Tm8 B16 C8'
_cell_volume   330.23622648
_cell_formula_units_Z   8
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  0.30878379  0.80878379  0.75000000  1.0
  Tm  Tm1  1  0.19121621  0.30878379  0.25000000  1.0
  Tm  Tm2  1  0.80878379  0.69121621  0.25000000  1.0
  Tm  Tm3  1  0.69121621  0.19121621  0.75000000  1.0
  Tm  Tm4  1  0.69121621  0.19121621  0.25000000  1.0
  Tm  Tm5  1  0.80878379  0.69121621  0.75000000  1.0
  Tm  Tm6  1  0.19121621  0.30878379  0.75000000  1.0
  Tm  Tm7  1  0.30878379  0.80878379  0.25000000  1.0
  B  B8  1  0.15222562  0.03405023  0.00000000  1.0
  B  B9  1  0.53405023  0.65222562  0.50000000  1.0
  B  B10  1  0.84777438  0.96594977  -0.00000000  1.0
  B  B11  1  0.34777438  0.53405023  0.00000000  1.0
  B  B12  1  0.65222562  0.46594977  -0.00000000  1.0
  B  B13  1  0.03405023  0.84777438  0.50000000  1.0
  B  B14  1  0.96594977  0.15222562  0.50000000  1.0
  B  B15  1  0.46594977  0.34777438  0.50000000  1.0
  B  B16  1  0.09731344  0.59360814  -0.00000000  1.0
  B  B17  1  0.40639186  0.09731344  0.50000000  1.0
  B  B18  1  0.59360814  0.90268656  0.50000000  1.0
  B  B19  1  0.59731344  0.90639186  -0.00000000  1.0
  B  B20  1  0.40268656  0.09360814  0.00000000  1.0
  B  B21  1  0.90268656  0.40639186  0.00000000  1.0
  B  B22  1  0.09360814  0.59731344  0.50000000  1.0
  B  B23  1  0.90639186  0.40268656  0.50000000  1.0
  C  C24  1  0.17791001  0.04045833  0.50000000  1.0
  C  C25  1  0.67791001  0.45954167  0.50000000  1.0
  C  C26  1  0.32208999  0.54045833  0.50000000  1.0
  C  C27  1  0.95954167  0.17791001  0.00000000  1.0
  C  C28  1  0.04045833  0.82208999  -0.00000000  1.0
  C  C29  1  0.54045833  0.67791001  0.00000000  1.0
  C  C30  1  0.82208999  0.95954167  0.50000000  1.0
  C  C31  1  0.45954167  0.32208999  -0.00000000  1.0