data_[Ti2Zn2Si2O10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  Zn  1.6500  1.3500  0.8800
  Si  1.9000  1.1000  0.5400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.4484]
_cell_length_b [5.4477]
_cell_length_c [7.3856]
_cell_angle_alpha [106.7618]
_cell_angle_beta [107.0882]
_cell_angle_gamma [96.9868]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [TiZnSiO5]
_chemical_formula_sum '[Ti2 Zn2 Si2 O10]'
_cell_volume [195.4646]
_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
[
  Ti  Ti0  1  0.0091  0.4947  0.5090  1.0
  Ti  Ti1  1  0.9915  0.5087  0.0098  1.0
  Zn  Zn2  1  0.4169  0.3367  0.8627  1.0
  Zn  Zn3  1  0.8223  0.9151  0.3552  1.0
  Si  Si4  1  0.3237  0.1336  0.2321  1.0
  Si  Si5  1  0.6354  0.8279  0.7272  1.0
  O  O6  1  0.0758  0.4068  0.7354  1.0
  O  O7  1  0.1323  0.1865  0.3692  1.0
  O  O8  1  0.2432  0.8192  0.0982  1.0
  O  O9  1  0.2611  0.3039  0.0779  1.0
  O  O10  1  0.3251  0.7313  0.5829  1.0
  O  O11  1  0.6370  0.2027  0.3665  1.0
  O  O12  1  0.6920  0.6449  0.8718  1.0
  O  O13  1  0.6931  0.1416  0.8576  1.0
  O  O14  1  0.8173  0.7742  0.5823  1.0
  O  O15  1  0.8886  0.5712  0.2292  1.0
]