# generated using pymatgen
data_Ca3Yb3(InAs2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.32098659
_cell_length_b   6.59107002
_cell_length_c   16.10062823
_cell_angle_alpha   90.10803281
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3Yb3(InAs2)4
_chemical_formula_sum   'Ca3 Yb3 In4 As8'
_cell_volume   458.54387178
_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  0.50000000  0.78106845  0.69559936  1.0
  Ca  Ca1  1  0.00000000  0.72042749  0.19461319  1.0
  Ca  Ca2  1  0.50000000  0.22086135  0.30500314  1.0
  Yb  Yb3  1  0.00000000  0.28469247  0.80489399  1.0
  Yb  Yb4  1  0.00000000  0.99939241  0.99884947  1.0
  Yb  Yb5  1  0.50000000  0.50014746  0.50058640  1.0
  In  In6  1  0.00000000  0.85808943  0.41216157  1.0
  In  In7  1  0.50000000  0.35705129  0.08706283  1.0
  In  In8  1  0.00000000  0.14309381  0.58942694  1.0
  In  In9  1  0.50000000  0.63991724  0.91121682  1.0
  As  As10  1  0.50000000  0.24049378  0.92779932  1.0
  As  As11  1  0.50000000  0.75760934  0.06985255  1.0
  As  As12  1  0.00000000  0.22508061  0.17163100  1.0
  As  As13  1  0.00000000  0.25807997  0.43016873  1.0
  As  As14  1  0.50000000  0.72490736  0.32801292  1.0
  As  As15  1  0.00000000  0.77325072  0.82762344  1.0
  As  As16  1  0.00000000  0.74218100  0.57087372  1.0
  As  As17  1  0.50000000  0.27365682  0.67462362  1.0