# generated using pymatgen
data_CaVO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.10299105
_cell_length_b   8.38568222
_cell_length_c   8.41312266
_cell_angle_alpha   90.56133073
_cell_angle_beta   79.36852734
_cell_angle_gamma   100.65433530
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaVO2
_chemical_formula_sum   'Ca4 V4 O8'
_cell_volume   211.38123809
_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  0.37228400  0.02899600  0.30344800  1.0
  Ca  Ca1  1  0.62280600  0.95106900  0.72497400  1.0
  Ca  Ca2  1  0.33218300  0.70337300  0.05773200  1.0
  Ca  Ca3  1  0.66199600  0.27682000  0.97057100  1.0
  V  V4  1  0.35337600  0.30830100  0.62338000  1.0
  V  V5  1  0.03338300  0.37626400  0.33081500  1.0
  V  V6  1  0.96404500  0.60368400  0.69728500  1.0
  V  V7  1  0.64389700  0.67142000  0.40473400  1.0
  O  O8  1  0.14290500  0.79261200  0.52848700  1.0
  O  O9  1  0.34055700  0.47135900  0.81177300  1.0
  O  O10  1  0.65684500  0.50855500  0.21611100  1.0
  O  O11  1  0.85457500  0.18701700  0.49969600  1.0
  O  O12  1  0.17769000  0.13962000  0.80345700  1.0
  O  O13  1  0.02830300  0.20239400  0.16362200  1.0
  O  O14  1  0.81748100  0.84038400  0.22499400  1.0
  O  O15  1  0.96594900  0.77746600  0.86454500  1.0