# generated using pymatgen
data_CaV2O2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.33327838
_cell_length_b   8.33327838
_cell_length_c   8.33327838
_cell_angle_alpha   117.93507556
_cell_angle_beta   117.93507556
_cell_angle_gamma   93.61538422
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaV2O2
_chemical_formula_sum   'Ca4 V8 O8'
_cell_volume   421.06202290
_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
  Ca  Ca0  1  0.87500000  0.12500000  0.25000000  1.0
  Ca  Ca1  1  0.87500000  0.62500000  0.75000000  1.0
  Ca  Ca2  1  0.37500000  0.12500000  0.25000000  1.0
  Ca  Ca3  1  0.87500000  0.12500000  0.75000000  1.0
  V  V4  1  0.55645100  0.36957500  0.81312500  1.0
  V  V5  1  0.55645100  0.74332600  0.18687500  1.0
  V  V6  1  0.49332600  0.80645100  0.68687500  1.0
  V  V7  1  0.19354900  0.50667400  0.31312500  1.0
  V  V8  1  0.19354900  0.88042500  0.68687500  1.0
  V  V9  1  0.11957500  0.80645100  0.31312500  1.0
  V  V10  1  0.25667400  0.44354900  0.81312500  1.0
  V  V11  1  0.63042500  0.44354900  0.18687500  1.0
  O  O12  1  0.66989400  0.34304700  0.67315400  1.0
  O  O13  1  0.66989400  0.99674000  0.32684600  1.0
  O  O14  1  0.74674000  0.91989400  0.82684600  1.0
  O  O15  1  0.08010600  0.25326000  0.17315400  1.0
  O  O16  1  0.08010600  0.90695300  0.82684600  1.0
  O  O17  1  0.09304700  0.91989400  0.17315400  1.0
  O  O18  1  0.00326000  0.33010600  0.67315400  1.0
  O  O19  1  0.65695300  0.33010600  0.32684600  1.0