# CIF generated by HEAS from Alexandria entry agm095980434
data_agm095980434
_cell_length_a     5.38506
_cell_length_b     3.29254
_cell_length_c     6.38403
_cell_angle_alpha  90.00000
_cell_angle_beta   90.72093
_cell_angle_gamma  90.00000
_cell_volume       113.18313
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
  'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
  Ba1 Ba 0.00000 0.00000 0.00000 1.00000
  Sc1 Sc 0.00000 0.00000 0.50000 1.00000
  Sc2 Sc 0.50000 0.50000 0.50000 1.00000
  O1 O 0.15799 0.50000 0.68274 1.00000
  O2 O 0.67324 0.00000 0.66639 1.00000
  O3 O 0.32676 0.00000 0.33361 1.00000
  O4 O 0.84201 0.50000 0.31726 1.00000