# generated using pymatgen
data_MgCo2S5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.60824600
_cell_length_b   6.37390400
_cell_length_c   13.25670000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgCo2S5
_chemical_formula_sum   'Mg2 Co4 S10'
_cell_volume   304.88572108
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  '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
  Mg  Mg0  1  0.50000000  0.11373400  0.00000000  1.0
  Mg  Mg1  1  0.00000000  0.88626600  0.50000000  1.0
  Co  Co2  1  0.00000000  0.54447400  0.85134700  1.0
  Co  Co3  1  0.50000000  0.45552600  0.64865300  1.0
  Co  Co4  1  0.50000000  0.45552600  0.35134700  1.0
  Co  Co5  1  0.00000000  0.54447400  0.14865300  1.0
  S  S6  1  0.50000000  0.61858100  0.50000000  1.0
  S  S7  1  0.00000000  0.38141900  0.00000000  1.0
  S  S8  1  0.50000000  0.36053800  0.80777100  1.0
  S  S9  1  0.00000000  0.63946200  0.69222900  1.0
  S  S10  1  0.50000000  0.36053800  0.19222900  1.0
  S  S11  1  0.00000000  0.63946200  0.30777100  1.0
  S  S12  1  0.00000000  0.85230700  0.08098200  1.0
  S  S13  1  0.50000000  0.14769300  0.41901800  1.0
  S  S14  1  0.50000000  0.14769300  0.58098200  1.0
  S  S15  1  0.00000000  0.85230700  0.91901800  1.0