# CIF generated by HEAS from Alexandria entry agm006500540
data_agm006500540
_cell_length_a     6.20856
_cell_length_b     6.20856
_cell_length_c     6.20856
_cell_angle_alpha  151.74091
_cell_angle_beta   118.67074
_cell_angle_gamma  68.86350
_cell_volume       98.30078
_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 0.50000 0.50000 0.00000 1.00000
  Ti1 Ti 0.84507 0.84507 0.00000 1.00000
  Ti2 Ti 0.15493 0.15493 0.00000 1.00000
  H1 H 0.03886 0.35944 0.67943 1.00000
  H2 H 0.31999 0.64056 0.67943 1.00000
  H3 H 0.28639 0.78639 0.50000 1.00000
  H4 H 0.83962 0.00000 0.83962 1.00000
  H5 H 0.71361 0.21361 0.50000 1.00000
  H6 H 0.68001 0.35944 0.32057 1.00000
  H7 H 0.96114 0.64056 0.32057 1.00000
  H8 H 0.16038 0.00000 0.16038 1.00000