# generated using pymatgen
data_Ti2VS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.44731583
_cell_length_b   6.06510813
_cell_length_c   6.69839510
_cell_angle_alpha   115.76847403
_cell_angle_beta   104.91133771
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2VS4
_chemical_formula_sum   'Ti2 V1 S4'
_cell_volume   120.86681736
_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  0.25699132  0.28661951  0.51398463  1.0
  Ti  Ti1  1  0.74301241  0.71339227  0.48602283  1.0
  V  V2  1  0.00001674  0.00002324  0.00003448  1.0
  S  S3  1  0.11697074  0.44807253  0.23393948  1.0
  S  S4  1  0.88302209  0.55192574  0.76604717  1.0
  S  S5  1  0.36609035  0.02383927  0.73218070  1.0
  S  S6  1  0.63389636  0.97612743  0.26779071  1.0