data_image0
_chemical_formula_structural       Mo2S4
_chemical_formula_sum              "Mo2 S4"
_cell_length_a       3.161
_cell_length_b       3.161
_cell_length_c       12.295
_cell_angle_alpha    90
_cell_angle_beta     90
_cell_angle_gamma    120

_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
  Mo  Mo1       1.0  0.33333  0.66667  0.25000  1.0000
  Mo  Mo2       1.0  0.66667  0.33334  0.75000  1.0000
  S   S1        1.0  0.33333  0.66667  0.62750  1.0000
  S   S2        1.0  0.66667  0.33334  0.12750  1.0000
  S   S3        1.0  0.33333  0.66666  0.87250  1.0000
  S   S4        1.0  0.66667  0.33333  0.37250  1.0000
