# generated using pymatgen
data_Ca2Yb3P8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.83421737
_cell_length_b   6.83421747
_cell_length_c   7.41467409
_cell_angle_alpha   80.98798149
_cell_angle_beta   80.98797978
_cell_angle_gamma   119.67190174
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2Yb3P8
_chemical_formula_sum   'Ca2 Yb3 P8'
_cell_volume   285.90845358
_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  0.33468782  0.66531218  0.00000000  1.0
  Ca  Ca1  1  0.66531218  0.33468782  0.00000000  1.0
  Yb  Yb2  1  0.50000000  0.50000000  0.50000000  1.0
  Yb  Yb3  1  0.82437019  0.17562981  0.50000000  1.0
  Yb  Yb4  1  0.17562981  0.82437019  0.50000000  1.0
  P  P5  1  0.77923040  0.77923040  0.75301297  1.0
  P  P6  1  0.22076960  0.22076960  0.24698703  1.0
  P  P7  1  0.08015758  0.38596819  0.75647003  1.0
  P  P8  1  0.61403181  0.91984242  0.24352997  1.0
  P  P9  1  0.91984242  0.61403181  0.24352997  1.0
  P  P10  1  0.38596819  0.08015758  0.75647003  1.0
  P  P11  1  0.05351306  0.05351306  0.83403702  1.0
  P  P12  1  0.94648694  0.94648694  0.16596298  1.0