# generated using pymatgen
data_Sc2MoC2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.52322651
_cell_length_b   5.52322651
_cell_length_c   9.24125965
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2MoC2
_chemical_formula_sum   'Sc8 Mo4 C8'
_cell_volume   281.91415422
_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
  Sc  Sc0  1  0.20323537  0.79676463  0.15690225  1.0
  Sc  Sc1  1  0.79676463  0.20323537  0.84309775  1.0
  Sc  Sc2  1  0.20323537  0.79676463  0.84309775  1.0
  Sc  Sc3  1  0.29676463  0.29676463  0.34309775  1.0
  Sc  Sc4  1  0.70323537  0.70323537  0.34309775  1.0
  Sc  Sc5  1  0.29676463  0.29676463  0.65690225  1.0
  Sc  Sc6  1  0.79676463  0.20323537  0.15690225  1.0
  Sc  Sc7  1  0.70323537  0.70323537  0.65690225  1.0
  Mo  Mo8  1  0.32312205  0.32312205  0.00000000  1.0
  Mo  Mo9  1  0.17687795  0.82312205  0.50000000  1.0
  Mo  Mo10  1  0.67687795  0.67687795  0.00000000  1.0
  Mo  Mo11  1  0.82312205  0.17687795  0.50000000  1.0
  C  C12  1  0.00000000  0.50000000  0.50000000  1.0
  C  C13  1  0.00000000  0.00000000  0.33083061  1.0
  C  C14  1  0.50000000  0.00000000  0.00000000  1.0
  C  C15  1  0.00000000  0.00000000  0.66916939  1.0
  C  C16  1  0.50000000  0.50000000  0.83083061  1.0
  C  C17  1  0.50000000  0.50000000  0.16916939  1.0
  C  C18  1  0.50000000  0.00000000  0.50000000  1.0
  C  C19  1  0.00000000  0.50000000  0.00000000  1.0