data_[Mg1Sb2P2O10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Sb  2.0500  1.4500  0.8300
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.4945]
_cell_length_b [5.5210]
_cell_length_c [7.8881]
_cell_angle_alpha [106.4903]
_cell_angle_beta [107.9782]
_cell_angle_gamma [94.1603]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [MgSb2(PO5)2]
_chemical_formula_sum '[Mg1 Sb2 P2 O10]'
_cell_volume [214.8473]
_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
[
  Mg  Mg0  1  0.7462  0.3960  0.7060  1.0
  Sb  Sb1  1  0.0093  0.9893  0.4985  1.0
  Sb  Sb2  1  0.0233  0.0365  0.0426  1.0
  P  P3  1  0.3142  0.6059  0.7257  1.0
  P  P4  1  0.6656  0.3933  0.2679  1.0
  O  O5  1  0.0824  0.9218  0.2694  1.0
  O  O6  1  0.1092  0.6181  0.8195  1.0
  O  O7  1  0.2649  0.7675  0.5874  1.0
  O  O8  1  0.3154  0.3158  0.6097  1.0
  O  O9  1  0.3746  0.3025  0.1582  1.0
  O  O10  1  0.6013  0.6837  0.8548  1.0
  O  O11  1  0.7060  0.6863  0.3686  1.0
  O  O12  1  0.7576  0.2658  0.4279  1.0
  O  O13  1  0.8234  0.3294  0.1337  1.0
  O  O14  1  0.9064  0.0880  0.7153  1.0
]