# generated using pymatgen
data_Sr2LiCBr3N2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.43850971
_cell_length_b   10.43850971
_cell_length_c   10.43850971
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2LiCBr3N2
_chemical_formula_sum   'Sr8 Li4 C4 Br12 N8'
_cell_volume   804.26746493
_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
  Sr  Sr0  1  0.78915900  0.40361400  0.40361400  1
  Sr  Sr1  1  0.46084100  0.84638600  0.84638600  1
  Sr  Sr2  1  0.84638600  0.84638600  0.84638600  1
  Sr  Sr3  1  0.40361400  0.40361400  0.78915900  1
  Sr  Sr4  1  0.84638600  0.84638600  0.46084100  1
  Sr  Sr5  1  0.84638600  0.46084100  0.84638600  1
  Sr  Sr6  1  0.40361400  0.40361400  0.40361400  1
  Sr  Sr7  1  0.40361400  0.78915900  0.40361400  1
  Li  Li8  1  0.12500000  0.12500000  0.12500000  1
  Li  Li9  1  0.12500000  0.12500000  0.62500000  1
  Li  Li10  1  0.62500000  0.12500000  0.12500000  1
  Li  Li11  1  0.12500000  0.62500000  0.12500000  1
  C  C12  1  0.12500000  0.62500000  0.62500000  1
  C  C13  1  0.62500000  0.12500000  0.62500000  1
  C  C14  1  0.62500000  0.62500000  0.12500000  1
  C  C15  1  0.62500000  0.62500000  0.62500000  1
  Br  Br16  1  0.05405500  0.44594500  0.44594500  1
  Br  Br17  1  0.80405500  0.19594500  0.19594500  1
  Br  Br18  1  0.44594500  0.05405500  0.05405500  1
  Br  Br19  1  0.80405500  0.80405500  0.19594500  1
  Br  Br20  1  0.05405500  0.44594500  0.05405500  1
  Br  Br21  1  0.44594500  0.05405500  0.44594500  1
  Br  Br22  1  0.19594500  0.80405500  0.80405500  1
  Br  Br23  1  0.19594500  0.19594500  0.80405500  1
  Br  Br24  1  0.80405500  0.19594500  0.80405500  1
  Br  Br25  1  0.44594500  0.44594500  0.05405500  1
  Br  Br26  1  0.19594500  0.80405500  0.19594500  1
  Br  Br27  1  0.05405500  0.05405500  0.44594500  1
  N  N28  1  0.26984000  0.57672000  0.57672000  1
  N  N29  1  0.67328000  0.67328000  0.98016000  1
  N  N30  1  0.67328000  0.98016000  0.67328000  1
  N  N31  1  0.57672000  0.57672000  0.57672000  1
  N  N32  1  0.57672000  0.26984000  0.57672000  1
  N  N33  1  0.98016000  0.67328000  0.67328000  1
  N  N34  1  0.57672000  0.57672000  0.26984000  1
  N  N35  1  0.67328000  0.67328000  0.67328000  1
