# CIF generated by HEAS from Alexandria entry agm008303003
data_agm008303003
_cell_length_a     6.96567
_cell_length_b     9.86162
_cell_length_c     13.98996
_cell_angle_alpha  90.00000
_cell_angle_beta   90.00000
_cell_angle_gamma  90.00000
_cell_volume       961.00873
_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
  Ti1 Ti 0.74380 0.25187 0.87279 1.00000
  Ti2 Ti 0.50000 0.99427 0.74364 1.00000
  Ti3 Ti 0.24380 0.75187 0.62721 1.00000
  Ti4 Ti 0.25620 0.25187 0.87279 1.00000
  Ti5 Ti 0.00000 0.49427 0.75636 1.00000
  Ti6 Ti 0.00000 0.50000 0.50000 1.00000
  Ti7 Ti 0.75620 0.24813 0.37279 1.00000
  Ti8 Ti 0.75620 0.75187 0.62721 1.00000
  Ti9 Ti 0.74380 0.74813 0.12721 1.00000
  Ti10 Ti 0.50000 0.00000 0.50000 1.00000
  Ti11 Ti 0.50000 0.00573 0.25636 1.00000
  Ti12 Ti 0.25620 0.74813 0.12721 1.00000
  Ti13 Ti 0.24380 0.24813 0.37279 1.00000
  Ti14 Ti 0.00000 0.50573 0.24364 1.00000
  Ti15 Ti 0.00000 0.50000 0.00000 1.00000
  Ti16 Ti 0.50000 0.00000 0.00000 1.00000
  Mn1 Mn 0.50000 0.50000 0.50000 1.00000
  Mn2 Mn 0.00000 0.00000 0.00000 1.00000
  S1 S 0.00000 0.25187 0.75312 1.00000
  S2 S 0.74659 0.00120 0.87449 1.00000
  S3 S 0.74492 0.99753 0.62420 1.00000
  S4 S 0.50000 0.24500 0.75190 1.00000
  S5 S 0.50000 0.75187 0.74688 1.00000
  S6 S 0.50000 0.75196 0.50259 1.00000
  S7 S 0.25508 0.99753 0.62420 1.00000
  S8 S 0.25341 0.00120 0.87449 1.00000
  S9 S 0.24659 0.50120 0.62551 1.00000
  S10 S 0.24659 0.49880 0.37449 1.00000
  S11 S 0.00000 0.74714 0.50349 1.00000
  S12 S 0.00000 0.74500 0.74810 1.00000
  S13 S 0.00000 0.25500 0.25190 1.00000
  S14 S 0.00000 0.25286 0.49651 1.00000
  S15 S 0.75341 0.49880 0.37449 1.00000
  S16 S 0.75341 0.50120 0.62551 1.00000
  S17 S 0.74492 0.00247 0.37580 1.00000
  S18 S 0.74659 0.99880 0.12551 1.00000
  S19 S 0.50000 0.24804 0.49741 1.00000
  S20 S 0.50000 0.24813 0.25312 1.00000
  S21 S 0.50000 0.75500 0.24810 1.00000
  S22 S 0.50000 0.75286 0.00349 1.00000
  S23 S 0.25341 0.99880 0.12551 1.00000
  S24 S 0.25508 0.00247 0.37580 1.00000
  S25 S 0.24492 0.50247 0.12420 1.00000
  S26 S 0.24492 0.49753 0.87580 1.00000
  S27 S 0.00000 0.74813 0.24688 1.00000
  S28 S 0.00000 0.74804 0.00259 1.00000
  S29 S 0.00000 0.25196 0.99741 1.00000
  S30 S 0.75508 0.50247 0.12420 1.00000
  S31 S 0.75508 0.49753 0.87580 1.00000
  S32 S 0.50000 0.24714 0.99651 1.00000