data_[Sr2Zr1U1P4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Zr  1.3300  1.5500  0.8600
  U  1.3800  1.7500  0.9913
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [6.9325]
_cell_length_b [4.0260]
_cell_length_c [7.2793]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.4234]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Sr2ZrUP4]
_chemical_formula_sum '[Sr2 Zr1 U1 P4]'
_cell_volume [192.7535]
_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
[
  Sr  Sr0  1  0.0000  0.5000  0.5000  1
  Sr  Sr1  1  0.5000  0.0000  0.5000  1
  Zr  Zr2  1  0.0000  0.0000  0.0000  1
  U  U3  1  0.5000  0.5000  0.0000  1
  P  P4  2  0.2346  0.5000  0.2106  1
  P  P5  2  0.2580  0.0000  0.7889  1
]