# generated using pymatgen
data_ScTaP7Ru12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.28996297
_cell_length_b   9.28996229
_cell_length_c   3.85873742
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999801
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScTaP7Ru12
_chemical_formula_sum   'Sc1 Ta1 P7 Ru12'
_cell_volume   288.40567425
_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
  Sc  Sc0  1  0.33333300  0.66666700  0.00000000  1.0
  Ta  Ta1  1  0.66666700  0.33333300  0.50000000  1.0
  P  P2  1  0.59467643  0.71931503  0.50000000  1.0
  P  P3  1  0.00000000  0.00000000  0.00000000  1.0
  P  P4  1  0.28068497  0.87536240  0.50000000  1.0
  P  P5  1  0.12463760  0.40532357  0.50000000  1.0
  P  P6  1  0.88638459  0.57424627  0.00000000  1.0
  P  P7  1  0.42575373  0.31213932  0.00000000  1.0
  P  P8  1  0.68786068  0.11361541  0.00000000  1.0
  Ru  Ru9  1  0.55487534  0.95283194  0.50000000  1.0
  Ru  Ru10  1  0.39795760  0.44512466  0.50000000  1.0
  Ru  Ru11  1  0.91367295  0.12472758  0.50000000  1.0
  Ru  Ru12  1  0.21105463  0.08632705  0.50000000  1.0
  Ru  Ru13  1  0.87527242  0.78894537  0.50000000  1.0
  Ru  Ru14  1  0.72426132  0.88721903  0.00000000  1.0
  Ru  Ru15  1  0.11278097  0.83704230  0.00000000  1.0
  Ru  Ru16  1  0.16295770  0.27573868  0.00000000  1.0
  Ru  Ru17  1  0.43270290  0.07945688  0.00000000  1.0
  Ru  Ru18  1  0.92054312  0.35324702  0.00000000  1.0
  Ru  Ru19  1  0.64675298  0.56729710  0.00000000  1.0
  Ru  Ru20  1  0.04716806  0.60204240  0.50000000  1.0