# generated using pymatgen
data_Sc3TiCo4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.60002633
_cell_length_b   7.60002520
_cell_length_c   7.60002593
_cell_angle_alpha   131.82883581
_cell_angle_beta   131.82882910
_cell_angle_gamma   70.49949586
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc3TiCo4
_chemical_formula_sum   'Sc6 Ti2 Co8'
_cell_volume   238.82118337
_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
  Sc  Sc0  1  0.25000000  0.25000000  0.00000000  1.0
  Sc  Sc1  1  0.50000100  0.00000000  0.50000100  1.0
  Sc  Sc2  1  0.00171027  0.00171027  0.00000000  1.0
  Sc  Sc3  1  0.49828873  0.49828873  1.00000000  1.0
  Sc  Sc4  1  0.74829073  0.24828973  0.50000100  1.0
  Sc  Sc5  1  0.25171027  0.75171127  0.50000100  1.0
  Ti  Ti6  1  0.75000000  0.75000000  0.00000000  1.0
  Ti  Ti7  1  0.00000000  0.50000100  0.50000100  1.0
  Co  Co8  1  0.63986764  0.12500100  0.01486764  1.0
  Co  Co9  1  0.87499900  0.38986764  0.01486764  1.0
  Co  Co10  1  0.11013236  0.12500000  0.48513136  1.0
  Co  Co11  1  0.87499900  0.86013236  0.48513136  1.0
  Co  Co12  1  0.37499900  0.38986664  0.51486664  1.0
  Co  Co13  1  0.63986764  0.62500000  0.51486664  1.0
  Co  Co14  1  0.11013236  0.62499900  0.98513036  1.0
  Co  Co15  1  0.37500100  0.86013336  0.98513436  1.0