# generated using pymatgen
data_Sr4LiMn2Cu3(SO)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.82734479
_cell_length_b   5.82750459
_cell_length_c   9.31388159
_cell_angle_alpha   89.99600576
_cell_angle_beta   71.77371048
_cell_angle_gamma   89.99135131
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr4LiMn2Cu3(SO)4
_chemical_formula_sum   'Sr4 Li1 Mn2 Cu3 S4 O4'
_cell_volume   300.42032172
_cell_formula_units_Z   1
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
  Sr  Sr0  1  0.40887100  0.00198200  0.18623800  1
  Sr  Sr1  1  0.90487200  0.49803800  0.18624400  1
  Sr  Sr2  1  0.09512700  0.49804500  0.81375700  1
  Sr  Sr3  1  0.59112900  0.00198500  0.81376100  1
  Li  Li4  1  0.00000000  0.75001300  0.49999900  1
  Mn  Mn5  1  0.50000400  0.50057100  0.99999300  1
  Mn  Mn6  1  0.00000000  0.99944600  0.99999800  1
  Cu  Cu7  1  0.50000300  0.25000000  0.49999800  1
  Cu  Cu8  1  0.50000400  0.75000900  0.49999600  1
  Cu  Cu9  1  0.99999900  0.25000300  0.49999600  1
  S  S10  1  0.17612800  0.00125600  0.65079400  1
  S  S11  1  0.67312700  0.49867900  0.65078400  1
  S  S12  1  0.32686100  0.49867700  0.34924000  1
  S  S13  1  0.82386900  0.00124800  0.34922100  1
  O  O14  1  0.24877900  0.25001300  0.00242300  1
  O  O15  1  0.75007900  0.75001100  0.99984300  1
  O  O16  1  0.75122200  0.25001200  0.99757000  1
  O  O17  1  0.24992400  0.75001100  0.00014700  1
