# generated using pymatgen
data_YMoO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.29054768
_cell_length_b   6.29054768
_cell_length_c   12.51747400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999661
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YMoO3
_chemical_formula_sum   'Y6 Mo6 O18'
_cell_volume   428.96737296
_cell_formula_units_Z   6
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  0.66666700  0.33333300  0.23529300  1.0
  Y  Y1  1  0.33333300  0.66666700  0.73529300  1.0
  Y  Y2  1  0.66666700  0.33333300  0.73529300  1.0
  Y  Y3  1  0.33333300  0.66666700  0.23529300  1.0
  Y  Y4  1  0.00000000  0.00000000  0.77011100  1.0
  Y  Y5  1  0.00000000  0.00000000  0.27011100  1.0
  Mo  Mo6  1  0.66759500  0.00000000  0.50050100  1.0
  Mo  Mo7  1  0.66759500  0.66759500  0.00050100  1.0
  Mo  Mo8  1  0.00000000  0.33240500  0.00050100  1.0
  Mo  Mo9  1  0.00000000  0.66759500  0.50050100  1.0
  Mo  Mo10  1  0.33240500  0.33240500  0.50050100  1.0
  Mo  Mo11  1  0.33240500  0.00000000  0.00050100  1.0
  O  O12  1  0.66666700  0.33333300  0.03039900  1.0
  O  O13  1  0.33333300  0.66666700  0.53039900  1.0
  O  O14  1  0.66666700  0.33333300  0.53039900  1.0
  O  O15  1  0.33333300  0.66666700  0.03039900  1.0
  O  O16  1  0.00000000  0.00000000  0.96422100  1.0
  O  O17  1  0.00000000  0.00000000  0.46422100  1.0
  O  O18  1  0.35949900  0.00000000  0.83180400  1.0
  O  O19  1  0.35949900  0.35949900  0.33180400  1.0
  O  O20  1  0.00000000  0.64050100  0.33180400  1.0
  O  O21  1  0.00000000  0.35949900  0.83180400  1.0
  O  O22  1  0.64050100  0.64050100  0.83180400  1.0
  O  O23  1  0.64050100  0.00000000  0.33180400  1.0
  O  O24  1  0.30725100  0.00000000  0.17078900  1.0
  O  O25  1  0.30725100  0.30725100  0.67078900  1.0
  O  O26  1  0.00000000  0.69274900  0.67078900  1.0
  O  O27  1  0.00000000  0.30725100  0.17078900  1.0
  O  O28  1  0.69274900  0.69274900  0.17078900  1.0
  O  O29  1  0.69274900  0.00000000  0.67078900  1.0