# generated using pymatgen
data_Ca3(InAs2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.33265079
_cell_length_b   6.66438523
_cell_length_c   16.18483173
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3(InAs2)2
_chemical_formula_sum   'Ca6 In4 As8'
_cell_volume   467.32817818
_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  0.00000000  0.27731632  0.80455458  1.0
  Ca  Ca1  1  0.50000000  0.77731632  0.69544542  1.0
  Ca  Ca2  1  -0.00000000  0.72268368  0.19544542  1.0
  Ca  Ca3  1  0.50000000  0.22268368  0.30455458  1.0
  Ca  Ca4  1  0.00000000  -0.00000000  -0.00000000  1.0
  Ca  Ca5  1  0.50000000  0.50000000  0.50000000  1.0
  In  In6  1  0.00000000  0.86084375  0.41183911  1.0
  In  In7  1  0.50000000  0.36084375  0.08816089  1.0
  In  In8  1  -0.00000000  0.13915625  0.58816089  1.0
  In  In9  1  0.50000000  0.63915625  0.91183911  1.0
  As  As10  1  0.50000000  0.24351039  0.92950754  1.0
  As  As11  1  0.50000000  0.75648961  0.07049246  1.0
  As  As12  1  -0.00000000  0.22998414  0.17231872  1.0
  As  As13  1  -0.00000000  0.25648961  0.42950754  1.0
  As  As14  1  0.50000000  0.72998414  0.32768128  1.0
  As  As15  1  0.00000000  0.77001586  0.82768128  1.0
  As  As16  1  -0.00000000  0.74351039  0.57049246  1.0
  As  As17  1  0.50000000  0.27001586  0.67231872  1.0