# generated using pymatgen
data_YTi3O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.04713600
_cell_length_b   6.56491824
_cell_length_c   15.06759219
_cell_angle_alpha   97.17941648
_cell_angle_beta   92.66042966
_cell_angle_gamma   117.06258402
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YTi3O6
_chemical_formula_sum   'Y4 Ti12 O24'
_cell_volume   524.87499631
_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
  Y  Y0  1  0.97005200  0.50089800  0.12273000  1.0
  Y  Y1  1  0.33009900  0.17542600  0.46318300  1.0
  Y  Y2  1  0.02994800  0.49910200  0.87727000  1.0
  Y  Y3  1  0.66990100  0.82457400  0.53681700  1.0
  Ti  Ti4  1  0.00000000  0.00000000  0.00000000  1.0
  Ti  Ti5  1  0.23155400  0.66029500  0.34099800  1.0
  Ti  Ti6  1  0.76844600  0.33970500  0.65900200  1.0
  Ti  Ti7  1  0.50000000  0.00000000  0.00000000  1.0
  Ti  Ti8  1  0.79173100  0.65478500  0.32447600  1.0
  Ti  Ti9  1  0.20826900  0.34521500  0.67552400  1.0
  Ti  Ti10  1  0.41469900  0.17326900  0.83249500  1.0
  Ti  Ti11  1  0.58530100  0.82673100  0.16750500  1.0
  Ti  Ti12  1  0.00000000  0.50000000  0.50000000  1.0
  Ti  Ti13  1  0.50000000  0.50000000  0.00000000  1.0
  Ti  Ti14  1  0.79106000  0.15746100  0.34067000  1.0
  Ti  Ti15  1  0.20894000  0.84253900  0.65933000  1.0
  O  O16  1  0.54936000  0.29374600  0.06673000  1.0
  O  O17  1  0.88487500  0.94496300  0.39964800  1.0
  O  O18  1  0.13259900  0.59940300  0.73053000  1.0
  O  O19  1  0.20128700  0.94998600  0.91013400  1.0
  O  O20  1  0.32665000  0.60493200  0.22330300  1.0
  O  O21  1  0.72269200  0.20486000  0.52863600  1.0
  O  O22  1  0.45064000  0.70625400  0.93327000  1.0
  O  O23  1  0.86740100  0.40059700  0.26947000  1.0
  O  O24  1  0.11512500  0.05503700  0.60035200  1.0
  O  O25  1  0.79871300  0.05001400  0.08986600  1.0
  O  O26  1  0.27730800  0.79514000  0.47136400  1.0
  O  O27  1  0.67335000  0.39506800  0.77669700  1.0
  O  O28  1  0.86151400  0.66096600  0.99671300  1.0
  O  O29  1  0.14783700  0.37590700  0.39545600  1.0
  O  O30  1  0.55251200  0.98761600  0.65828000  1.0
  O  O31  1  0.31334300  0.83556900  0.09495600  1.0
  O  O32  1  0.68042500  0.51054400  0.42930800  1.0
  O  O33  1  0.17388300  0.26622400  0.79644700  1.0
  O  O34  1  0.68665700  0.16443100  0.90504400  1.0
  O  O35  1  0.82611700  0.73377600  0.20355300  1.0
  O  O36  1  0.31957500  0.48945600  0.57069200  1.0
  O  O37  1  0.13848600  0.33903400  0.00328700  1.0
  O  O38  1  0.44748800  0.01238400  0.34172000  1.0
  O  O39  1  0.85216300  0.62409300  0.60454400  1.0