# generated using pymatgen
data_CaV4(CoO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.45709080
_cell_length_b   6.43308303
_cell_length_c   6.47381726
_cell_angle_alpha   70.50932687
_cell_angle_beta   70.24719178
_cell_angle_gamma   109.14413074
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaV4(CoO4)3
_chemical_formula_sum   'Ca1 V4 Co3 O12'
_cell_volume   207.07367559
_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  0.99999800  0.99999800  0.00000000  1.0
  V  V1  1  0.00000100  0.50000200  0.99999800  1.0
  V  V2  1  0.49999600  0.49999400  0.49999700  1.0
  V  V3  1  0.49999500  0.99999500  0.00000400  1.0
  V  V4  1  0.00000300  0.00000100  0.49999900  1.0
  Co  Co5  1  0.50000100  0.00000100  0.50000000  1.0
  Co  Co6  1  0.50000100  0.50000000  0.00000000  1.0
  Co  Co7  1  0.00000000  0.50000000  0.50000000  1.0
  O  O8  1  0.30343900  0.11314800  0.17967100  1.0
  O  O9  1  0.69656200  0.88685400  0.82032800  1.0
  O  O10  1  0.29605000  0.48459500  0.81906700  1.0
  O  O11  1  0.70395100  0.51540600  0.18093300  1.0
  O  O12  1  0.81602000  0.70607500  0.48314900  1.0
  O  O13  1  0.18398000  0.29392400  0.51685500  1.0
  O  O14  1  0.18341200  0.69818600  0.11953200  1.0
  O  O15  1  0.81658900  0.30181500  0.88046900  1.0
  O  O16  1  0.88457400  0.18130200  0.30049700  1.0
  O  O17  1  0.11542700  0.81870300  0.69949900  1.0
  O  O18  1  0.51530900  0.80923100  0.30485000  1.0
  O  O19  1  0.48469200  0.19077000  0.69515100  1.0