# generated using pymatgen
data_Ti2CoSe4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.58842200
_cell_length_b   6.14362452
_cell_length_c   6.84211396
_cell_angle_alpha   116.35456077
_cell_angle_beta   105.20245368
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2CoSe4
_chemical_formula_sum   'Ti2 Co1 Se4'
_cell_volume   129.24555767
_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
  Ti  Ti0  1  0.25218500  0.26472700  0.50437000  1.0
  Ti  Ti1  1  0.74781500  0.73527300  0.49563000  1.0
  Co  Co2  1  0.00000000  0.00000000  0.00000000  1.0
  Se  Se3  1  0.11393000  0.44950300  0.22786000  1.0
  Se  Se4  1  0.88607000  0.55049700  0.77214000  1.0
  Se  Se5  1  0.38061700  0.04532200  0.76123400  1.0
  Se  Se6  1  0.61938300  0.95467800  0.23876600  1.0