# generated using pymatgen
data_Tb3ScMnC6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.29764031
_cell_length_b   8.29747810
_cell_length_c   5.13166815
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99829643
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb3ScMnC6
_chemical_formula_sum   'Tb6 Sc2 Mn2 C12'
_cell_volume   305.98305108
_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
  Tb  Tb0  1  0.61604494  0.67521326  0.75000000  1.0
  Tb  Tb1  1  0.94083494  0.61604582  0.25000000  1.0
  Tb  Tb2  1  0.67521162  0.05917278  0.25000000  1.0
  Tb  Tb3  1  0.32478838  0.94082722  0.75000000  1.0
  Tb  Tb4  1  0.05916506  0.38395418  0.75000000  1.0
  Tb  Tb5  1  0.38395506  0.32478674  0.25000000  1.0
  Sc  Sc6  1  0.00000000  0.00000000  0.50000000  1.0
  Sc  Sc7  1  0.00000000  0.00000000  0.00000000  1.0
  Mn  Mn8  1  0.66665877  0.33331997  0.75000000  1.0
  Mn  Mn9  1  0.33334123  0.66668003  0.25000000  1.0
  C  C10  1  0.96697517  0.75215711  0.75000000  1.0
  C  C11  1  0.21480961  0.96695896  0.25000000  1.0
  C  C12  1  0.75217182  0.78520081  0.25000000  1.0
  C  C13  1  0.24782818  0.21479919  0.75000000  1.0
  C  C14  1  0.78519039  0.03304104  0.75000000  1.0
  C  C15  1  0.03302483  0.24784289  0.25000000  1.0
  C  C16  1  0.85936893  0.56448058  0.75000000  1.0
  C  C17  1  0.29488652  0.85937587  0.25000000  1.0
  C  C18  1  0.56447455  0.70511641  0.25000000  1.0
  C  C19  1  0.43552545  0.29488359  0.75000000  1.0
  C  C20  1  0.14063107  0.43551942  0.25000000  1.0
  C  C21  1  0.70511348  0.14062413  0.75000000  1.0