# generated using pymatgen
data_TiVO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.15066700
_cell_length_b   5.55205471
_cell_length_c   7.62171065
_cell_angle_alpha   83.97212827
_cell_angle_beta   89.78397071
_cell_angle_gamma   89.88745281
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiVO3
_chemical_formula_sum   'Ti4 V4 O12'
_cell_volume   216.74951415
_cell_formula_units_Z   4
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  0.50105300  0.79742400  0.14539000  1.0
  Ti  Ti1  1  0.49591300  0.18868200  0.34947400  1.0
  Ti  Ti2  1  0.99928800  0.30385000  0.64661200  1.0
  Ti  Ti3  1  0.50329200  0.20495000  0.85651600  1.0
  V  V4  1  0.00060900  0.30269900  0.15508700  1.0
  V  V5  1  0.99970800  0.69494100  0.34958900  1.0
  V  V6  1  0.49886600  0.80814200  0.64765200  1.0
  V  V7  1  0.99984400  0.69811500  0.84783300  1.0
  O  O8  1  0.32190100  0.49876600  0.24875900  1.0
  O  O9  1  0.83256300  0.66090200  0.10352300  1.0
  O  O10  1  0.65633200  0.85317800  0.39425700  1.0
  O  O11  1  0.20171300  0.99285000  0.25619600  1.0
  O  O12  1  0.63678400  0.15785900  0.09293900  1.0
  O  O13  1  0.14712400  0.64150800  0.59220200  1.0
  O  O14  1  0.83721700  0.33937000  0.41305200  1.0
  O  O15  1  0.36316100  0.84946700  0.91239500  1.0
  O  O16  1  0.33515200  0.16042000  0.59198300  1.0
  O  O17  1  0.17044000  0.33981300  0.89667400  1.0
  O  O18  1  0.69154000  0.48372700  0.75290600  1.0
  O  O19  1  0.80749900  0.02333800  0.74696100  1.0