data_image0
_chemical_formula_structural       Mn2S2
_chemical_formula_sum              "Mn2 S2"
_cell_length_a       3.5976990171077103
_cell_length_b       3.597699017107668
_cell_length_c       18.679524340406086
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    120.00000000000037

_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  0.6666666673903595  0.3333333339767915  0.44713441829635076  1.0000
  Mn  Mn2       1.0  0.6666666673903595  0.3333333339767915  0.5530215867250197  1.0000
  S   S1        1.0  0.33333333397679155  0.6666666679535831  0.4070642668106985  1.0000
  S   S2        1.0  0.33333333397679155  0.6666666679535831  0.5932108365324202  1.0000