# generated using pymatgen
data_MgVO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.78558040
_cell_length_b   5.78558040
_cell_length_c   5.31109900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   125.07268635
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgVO3
_chemical_formula_sum   'Mg2 V2 O6'
_cell_volume   145.49781778
_cell_formula_units_Z   2
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
  Mg  Mg0  1  0.42503100  0.57496900  0.50838700  1.0
  Mg  Mg1  1  0.57496900  0.42503100  0.00838700  1.0
  V  V2  1  0.06977500  0.93022500  0.51287600  1.0
  V  V3  1  0.93022500  0.06977500  0.01287600  1.0
  O  O4  1  0.23677100  0.24097500  0.76091500  1.0
  O  O5  1  0.75902500  0.76322900  0.76091500  1.0
  O  O6  1  0.76322900  0.75902500  0.26091500  1.0
  O  O7  1  0.24097500  0.23677100  0.26091500  1.0
  O  O8  1  0.23434100  0.76565900  0.52090600  1.0
  O  O9  1  0.76565900  0.23434100  0.02090600  1.0