# generated using pymatgen
data_CaV4O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.07854600
_cell_length_b   5.30709467
_cell_length_c   15.52465975
_cell_angle_alpha   89.32278337
_cell_angle_beta   90.00020641
_cell_angle_gamma   73.13797805
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaV4O6
_chemical_formula_sum   'Ca2 V8 O12'
_cell_volume   242.72031778
_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  0.34996200  0.29981800  0.74803400  1.0
  Ca  Ca1  1  0.64991000  0.70035700  0.25174900  1.0
  V  V2  1  0.86177200  0.27642700  0.54192300  1.0
  V  V3  1  0.40251200  0.19507500  0.36583700  1.0
  V  V4  1  0.40046400  0.19920600  0.13453300  1.0
  V  V5  1  0.59861100  0.80259700  0.86962500  1.0
  V  V6  1  0.13549200  0.72915200  0.04459400  1.0
  V  V7  1  0.86500000  0.26999400  0.95508000  1.0
  V  V8  1  0.13794400  0.72429600  0.45687900  1.0
  V  V9  1  0.60054400  0.79864300  0.63629200  1.0
  O  O10  1  0.49685100  0.00638800  0.49710500  1.0
  O  O11  1  0.49479800  0.01047600  0.00392700  1.0
  O  O12  1  0.68144600  0.63678700  0.74798900  1.0
  O  O13  1  0.32073200  0.35886900  0.24909100  1.0
  O  O14  1  0.96725200  0.06517900  0.84115800  1.0
  O  O15  1  0.02857700  0.94299400  0.15946900  1.0
  O  O16  1  0.02949700  0.94114800  0.34062600  1.0
  O  O17  1  0.97108500  0.05736600  0.65672700  1.0
  O  O18  1  0.22953300  0.54088600  0.91726900  1.0
  O  O19  1  0.77688100  0.44648100  0.08459400  1.0
  O  O20  1  0.77674100  0.44673800  0.41106500  1.0
  O  O21  1  0.22438800  0.55112200  0.58643700  1.0