# generated using pymatgen
data_Nd2MgTi2S2O5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.85466389
_cell_length_b   3.85466424
_cell_length_c   14.38785308
_cell_angle_alpha   90.49361636
_cell_angle_beta   90.49362240
_cell_angle_gamma   89.99334848
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd2MgTi2S2O5
_chemical_formula_sum   'Nd2 Mg1 Ti2 S2 O5'
_cell_volume   213.76511323
_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
  Nd  Nd0  1  0.39984528  0.39984528  0.71776608  1.0
  Nd  Nd1  1  0.90811837  0.90811837  0.43583449  1.0
  Mg  Mg2  1  0.40228827  0.40228827  0.20339655  1.0
  Ti  Ti3  1  0.89998630  0.89998630  0.11301073  1.0
  Ti  Ti4  1  0.90473006  0.90473006  0.86053268  1.0
  S  S5  1  0.40621252  0.40621252  0.38132947  1.0
  S  S6  1  0.89579929  0.89579929  0.62491384  1.0
  O  O7  1  0.90380919  0.40328626  0.81473012  1.0
  O  O8  1  0.90140483  0.40203295  0.15951182  1.0
  O  O9  1  0.40328626  0.90380919  0.81472912  1.0
  O  O10  1  0.40203295  0.90140483  0.15951082  1.0
  O  O11  1  0.90581967  0.90581967  0.98695729  1.0