# generated using pymatgen
data_BaNaScSi2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.69153700
_cell_length_b   6.91413700
_cell_length_c   8.92983934
_cell_angle_alpha   70.55710866
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaNaScSi2O7
_chemical_formula_sum   'Ba2 Na2 Sc2 Si4 O14'
_cell_volume   331.36816907
_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
  Ba  Ba0  1  0.25000000  0.79431700  0.53377300  1.0
  Ba  Ba1  1  0.75000000  0.20568300  0.46622700  1.0
  Na  Na2  1  0.75000000  0.23060000  0.99838800  1.0
  Na  Na3  1  0.25000000  0.76940000  0.00161200  1.0
  Sc  Sc4  1  0.75000000  0.79844800  0.26524500  1.0
  Sc  Sc5  1  0.25000000  0.20155200  0.73475500  1.0
  Si  Si6  1  0.75000000  0.86017900  0.84326100  1.0
  Si  Si7  1  0.25000000  0.13982100  0.15673900  1.0
  Si  Si8  1  0.75000000  0.55274200  0.68066800  1.0
  Si  Si9  1  0.25000000  0.44725800  0.31933200  1.0
  O  O10  1  0.75000000  0.61500700  0.84745000  1.0
  O  O11  1  0.25000000  0.38499300  0.15255000  1.0
  O  O12  1  0.99110300  0.96572800  0.74889600  1.0
  O  O13  1  0.49110300  0.03427200  0.25110400  1.0
  O  O14  1  0.00889700  0.03427200  0.25110400  1.0
  O  O15  1  0.50889700  0.96572800  0.74889600  1.0
  O  O16  1  0.75000000  0.86349600  0.02425800  1.0
  O  O17  1  0.25000000  0.13650400  0.97574200  1.0
  O  O18  1  0.75000000  0.76177100  0.52373100  1.0
  O  O19  1  0.25000000  0.23822900  0.47626900  1.0
  O  O20  1  0.51328600  0.41887700  0.68676000  1.0
  O  O21  1  0.01328600  0.58112300  0.31324000  1.0
  O  O22  1  0.48671400  0.58112300  0.31324000  1.0
  O  O23  1  0.98671400  0.41887700  0.68676000  1.0