# generated using pymatgen
data_Sc2MnRu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.11019664
_cell_length_b   5.06064036
_cell_length_c   8.63364744
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.67971866
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2MnRu3
_chemical_formula_sum   'Sc4 Mn2 Ru6'
_cell_volume   193.98164053
_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
  Sc  Sc0  1  0.33170956  0.66447948  0.06417015  1.0
  Sc  Sc1  1  0.66829044  0.33276892  0.56417015  1.0
  Sc  Sc2  1  0.66829044  0.33276892  0.93582985  1.0
  Sc  Sc3  1  0.33170956  0.66447948  0.43582985  1.0
  Mn  Mn4  1  0.83288314  0.17168837  0.25000000  1.0
  Mn  Mn5  1  0.16711686  0.33880523  0.75000000  1.0
  Ru  Ru6  1  1.00000000  0.99386011  0.00000000  1.0
  Ru  Ru7  1  1.00000000  0.99386011  0.50000000  1.0
  Ru  Ru8  1  0.82825427  0.66324720  0.25000000  1.0
  Ru  Ru9  1  0.17174573  0.83499393  0.75000000  1.0
  Ru  Ru10  1  0.65092171  0.82998449  0.75000000  1.0
  Ru  Ru11  1  0.34907829  0.17906277  0.25000000  1.0