# generated using pymatgen
data_Ca4TaV3O12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.38028923
_cell_length_b   5.46214119
_cell_length_c   7.63815606
_cell_angle_alpha   90.03070984
_cell_angle_beta   90.05063751
_cell_angle_gamma   89.88037101
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca4TaV3O12
_chemical_formula_sum   'Ca4 Ta1 V3 O12'
_cell_volume   224.46875316
_cell_formula_units_Z   1
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  0.99279883  0.03844069  0.73868680  1.0
  Ca  Ca1  1  0.49052868  0.45575447  0.26014316  1.0
  Ca  Ca2  1  0.50947132  0.54424553  0.73985684  1.0
  Ca  Ca3  1  0.00720117  0.96155931  0.26131320  1.0
  Ta  Ta4  1  0.00000000  0.50000000  0.00000000  1.0
  V  V5  1  0.50000000  0.00000000  0.50000000  1.0
  V  V6  1  0.00000000  0.50000000  0.50000000  1.0
  V  V7  1  0.50000000  0.00000000  0.00000000  1.0
  O  O8  1  0.92065435  0.52048012  0.25067335  1.0
  O  O9  1  0.43000571  0.98452362  0.75897221  1.0
  O  O10  1  0.56999429  0.01547638  0.24102779  1.0
  O  O11  1  0.07934565  0.47951988  0.74932665  1.0
  O  O12  1  0.70105812  0.29872761  0.95843262  1.0
  O  O13  1  0.19947356  0.20217773  0.04357201  1.0
  O  O14  1  0.78452155  0.78045229  0.53611474  1.0
  O  O15  1  0.28339778  0.71948792  0.46584303  1.0
  O  O16  1  0.71660222  0.28051208  0.53415697  1.0
  O  O17  1  0.21547845  0.21954771  0.46388526  1.0
  O  O18  1  0.29894188  0.70127239  0.04156738  1.0
  O  O19  1  0.80052644  0.79782227  0.95642799  1.0