data_image0
_chemical_formula_structural       Mn2S2
_chemical_formula_sum              "Mn2 S2"
_cell_length_a       3.985965
_cell_length_b       3.985630513362346
_cell_length_c       6.471396
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    120.00276789406007

_space_group_name_H-M_alt    "P 1"
_space_group_IT_number       1

loop_
  _space_group_symop_operation_xyz
  '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
  Mn  Mn1       1.0  0.6666847814  0.3333709009  0.49910096679999993  1.0000
  Mn  Mn2       1.0  0.3333143211  0.6666288094  0.9991012757999999  1.0000
  S   S1        1.0  0.3333157697  0.6666317066  0.3758988013999999  1.0000
  S   S2        1.0  0.6666833327999999  0.3333680036  0.8758991105  1.0000