# generated using pymatgen
data_Ca(La2Se3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.10352610
_cell_length_b   9.10352610
_cell_length_c   15.05580557
_cell_angle_alpha   72.45851482
_cell_angle_beta   72.45851482
_cell_angle_gamma   89.98746770
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca(La2Se3)4
_chemical_formula_sum   'Ca2 La16 Se24'
_cell_volume   1128.74425155
_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
  Ca  Ca0  1  0.04381800  0.91951500  0.16636700  1.0
  Ca  Ca1  1  0.91951500  0.04381800  0.66636700  1.0
  La  La2  1  0.74989700  0.12187300  0.00139700  1.0
  La  La3  1  0.45526300  0.70949900  0.08326300  1.0
  La  La4  1  0.08132100  0.45509300  0.33427100  1.0
  La  La5  1  0.37534700  0.12205700  0.25116900  1.0
  La  La6  1  0.79041200  0.41566000  0.16610600  1.0
  La  La7  1  0.58418500  0.70636400  0.33366200  1.0
  La  La8  1  0.79324500  0.03896700  0.41546600  1.0
  La  La9  1  0.37185000  0.24835800  0.50007000  1.0
  La  La10  1  0.41566000  0.79041200  0.66610600  1.0
  La  La11  1  0.70949900  0.45526300  0.58326300  1.0
  La  La12  1  0.12187300  0.74989700  0.50139700  1.0
  La  La13  1  0.12205700  0.37534700  0.75116900  1.0
  La  La14  1  0.70636400  0.58418500  0.83366200  1.0
  La  La15  1  0.03896700  0.79324500  0.91546600  1.0
  La  La16  1  0.24835800  0.37185000  0.00007000  1.0
  La  La17  1  0.45509300  0.08132100  0.83427100  1.0
  Se  Se18  1  0.54589100  0.39916200  0.05121700  1.0
  Se  Se19  1  0.76194700  0.76456900  0.11848500  1.0
  Se  Se20  1  0.40257000  0.05067900  0.05060900  1.0
  Se  Se21  1  0.28413200  0.78079700  0.28472700  1.0
  Se  Se22  1  0.43229400  0.43251400  0.28241200  1.0
  Se  Se23  1  0.11315400  0.61890600  0.11847300  1.0
  Se  Se24  1  0.71798700  0.06695100  0.21676600  1.0
  Se  Se25  1  0.88649700  0.73294000  0.38152100  1.0
  Se  Se26  1  0.06755600  0.21484500  0.21744300  1.0
  Se  Se27  1  0.09847500  0.09914000  0.45256200  1.0
  Se  Se28  1  0.73230600  0.37994500  0.38383400  1.0
  Se  Se29  1  0.61890600  0.11315400  0.61847300  1.0
  Se  Se30  1  0.76456900  0.76194700  0.61848500  1.0
  Se  Se31  1  0.45120000  0.94898900  0.44936500  1.0
  Se  Se32  1  0.05067900  0.40257000  0.55060900  1.0
  Se  Se33  1  0.21484500  0.06755600  0.71744300  1.0
  Se  Se34  1  0.39916200  0.54589100  0.55121700  1.0
  Se  Se35  1  0.43251400  0.43229400  0.78241200  1.0
  Se  Se36  1  0.06695100  0.71798700  0.71676600  1.0
  Se  Se37  1  0.94898900  0.45120000  0.94936500  1.0
  Se  Se38  1  0.09914000  0.09847500  0.95256200  1.0
  Se  Se39  1  0.78079700  0.28413200  0.78472700  1.0
  Se  Se40  1  0.37994500  0.73230600  0.88383400  1.0
  Se  Se41  1  0.73294000  0.88649700  0.88152100  1.0