# generated using pymatgen
data_Mn2SiSe4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.24729522
_cell_length_b   7.80107733
_cell_length_c   13.35040831
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2SiSe4
_chemical_formula_sum   'Mn8 Si4 Se16'
_cell_volume   650.64060133
_cell_formula_units_Z   4
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
  Mn  Mn0  1  0.49385565  0.75000000  0.23269278  1.0
  Mn  Mn1  1  0.99385565  0.25000000  0.26730722  1.0
  Mn  Mn2  1  0.50614435  0.25000000  0.76730722  1.0
  Mn  Mn3  1  0.00614435  0.75000000  0.73269278  1.0
  Mn  Mn4  1  0.50000000  0.50000000  0.50000000  1.0
  Mn  Mn5  1  0.00000000  0.50000000  -0.00000000  1.0
  Mn  Mn6  1  0.50000000  -0.00000000  0.50000000  1.0
  Mn  Mn7  1  0.00000000  -0.00000000  -0.00000000  1.0
  Si  Si8  1  0.59441608  0.75000000  0.91118337  1.0
  Si  Si9  1  0.09441608  0.25000000  0.58881663  1.0
  Si  Si10  1  0.40558392  0.25000000  0.08881663  1.0
  Si  Si11  1  0.90558392  0.75000000  0.41118337  1.0
  Se  Se12  1  0.26671365  0.75000000  0.40773230  1.0
  Se  Se13  1  0.76671365  0.25000000  0.09226770  1.0
  Se  Se14  1  0.73328635  0.25000000  0.59226770  1.0
  Se  Se15  1  0.23328635  0.75000000  0.90773230  1.0
  Se  Se16  1  0.75782004  0.75000000  0.56848314  1.0
  Se  Se17  1  0.25782004  0.25000000  0.93151686  1.0
  Se  Se18  1  0.24217996  0.25000000  0.43151686  1.0
  Se  Se19  1  0.74217996  0.75000000  0.06848314  1.0
  Se  Se20  1  0.74944879  0.97979545  0.33240514  1.0
  Se  Se21  1  0.24944879  0.02020455  0.16759486  1.0
  Se  Se22  1  0.25055121  0.47979545  0.66759486  1.0
  Se  Se23  1  0.75055121  0.52020455  0.83240514  1.0
  Se  Se24  1  0.25055121  0.02020455  0.66759486  1.0
  Se  Se25  1  0.75055121  0.97979545  0.83240514  1.0
  Se  Se26  1  0.74944879  0.52020455  0.33240514  1.0
  Se  Se27  1  0.24944879  0.47979545  0.16759486  1.0