data_[Sr2Ca2In2P4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Ca  1.0000  1.8000  1.1400
  In  1.7800  1.5500  0.9400
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [P2/c]
_cell_length_a [6.9745]
_cell_length_b [5.3563]
_cell_length_c [7.8142]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.4734]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [13]
_chemical_formula_structural [SrCaInP2]
_chemical_formula_sum '[Sr2 Ca2 In2 P4]'
_cell_volume [286.0860]
_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
[
  Sr  Sr0  2  0.5000  0.1628  0.2500  1
  Ca  Ca1  2  0.0000  0.4892  0.7500  1
  In  In2  2  0.0000  0.0000  0.0000  1
  P  P3  4  0.2754  0.2970  0.5452  1
]