# generated using pymatgen
data_CaV2O5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.57288674
_cell_length_b   4.95768677
_cell_length_c   11.33323041
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaV2O5
_chemical_formula_sum   'Ca2 V4 O10'
_cell_volume   200.74838120
_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
  Ca  Ca0  1  0.75000000  0.85022625  0.25000000  1.0
  Ca  Ca1  1  0.24999900  0.14977275  0.75000000  1.0
  V  V2  1  0.24999900  0.38756188  0.09654284  1.0
  V  V3  1  0.75000000  0.61243712  0.90345716  1.0
  V  V4  1  0.75000000  0.61243712  0.59654284  1.0
  V  V5  1  0.24999900  0.38756188  0.40345716  1.0
  O  O6  1  0.75000000  0.45144397  0.75000000  1.0
  O  O7  1  0.24999900  0.54855503  0.25000000  1.0
  O  O8  1  0.75000000  0.53318238  0.07433286  1.0
  O  O9  1  0.24999900  0.46681862  0.92566614  1.0
  O  O10  1  0.75000000  0.53318238  0.42566614  1.0
  O  O11  1  0.24999900  0.46681862  0.57433386  1.0
  O  O12  1  0.24999900  0.05771589  0.37616561  1.0
  O  O13  1  0.75000000  0.94228511  0.62383439  1.0
  O  O14  1  0.75000000  0.94228511  0.87616461  1.0
  O  O15  1  0.24999900  0.05771589  0.12383539  1.0