# generated using pymatgen
data_CaBe2(PO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.87417500
_cell_length_b   7.87145200
_cell_length_c   8.42389127
_cell_angle_alpha   89.54960146
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaBe2(PO4)2
_chemical_formula_sum   'Ca4 Be8 P8 O32'
_cell_volume   588.41288523
_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
  Ca  Ca0  1  0.58510400  0.24403200  0.11277200  1.0
  Ca  Ca1  1  0.08510400  0.75596800  0.38722800  1.0
  Ca  Ca2  1  0.41489600  0.75596800  0.88722800  1.0
  Ca  Ca3  1  0.91489600  0.24403200  0.61277200  1.0
  Be  Be4  1  0.80531100  0.57036800  0.94326000  1.0
  Be  Be5  1  0.92076000  0.06945200  0.23053900  1.0
  Be  Be6  1  0.42076000  0.93054800  0.26946100  1.0
  Be  Be7  1  0.07924000  0.93054800  0.76946100  1.0
  Be  Be8  1  0.57924000  0.06945200  0.73053900  1.0
  Be  Be9  1  0.30531100  0.42963200  0.55674000  1.0
  Be  Be10  1  0.19468900  0.42963200  0.05674000  1.0
  Be  Be11  1  0.69468900  0.57036800  0.44326000  1.0
  P  P12  1  0.69787700  0.93893000  0.43978700  1.0
  P  P13  1  0.19787700  0.06107000  0.06021300  1.0
  P  P14  1  0.30212300  0.06107000  0.56021300  1.0
  P  P15  1  0.80212300  0.93893000  0.93978700  1.0
  P  P16  1  0.91708100  0.43918400  0.23615100  1.0
  P  P17  1  0.41708100  0.56081600  0.26384900  1.0
  P  P18  1  0.08291900  0.56081600  0.76384900  1.0
  P  P19  1  0.58291900  0.43918400  0.73615100  1.0
  O  O20  1  0.92018500  0.25834900  0.31276200  1.0
  O  O21  1  0.57981500  0.25834900  0.81276200  1.0
  O  O22  1  0.07981500  0.74165100  0.68723800  1.0
  O  O23  1  0.42018500  0.74165100  0.18723800  1.0
  O  O24  1  0.65625100  0.76034600  0.49570800  1.0
  O  O25  1  0.15625100  0.23965400  0.00429200  1.0
  O  O26  1  0.34374900  0.23965400  0.50429200  1.0
  O  O27  1  0.84374900  0.76034600  0.99570800  1.0
  O  O28  1  0.80747000  0.06688000  0.07923000  1.0
  O  O29  1  0.30747000  0.93312000  0.42077000  1.0
  O  O30  1  0.19253000  0.93312000  0.92077000  1.0
  O  O31  1  0.69253000  0.06688000  0.57923000  1.0
  O  O32  1  0.92627100  0.49463500  0.81312000  1.0
  O  O33  1  0.42627100  0.50536500  0.68688000  1.0
  O  O34  1  0.07372900  0.50536500  0.18688000  1.0
  O  O35  1  0.57372900  0.49463500  0.31312000  1.0
  O  O36  1  0.91273900  0.00416800  0.80914400  1.0
  O  O37  1  0.41273900  0.99583200  0.69085600  1.0
  O  O38  1  0.08726100  0.99583200  0.19085600  1.0
  O  O39  1  0.58726100  0.00416800  0.30914400  1.0
  O  O40  1  0.63333200  0.56204600  0.87007800  1.0
  O  O41  1  0.13333200  0.43795400  0.62992200  1.0
  O  O42  1  0.36666800  0.43795400  0.12992200  1.0
  O  O43  1  0.86666800  0.56204600  0.37007800  1.0
  O  O44  1  0.63719200  0.94404500  0.87498400  1.0
  O  O45  1  0.13719200  0.05595500  0.62501600  1.0
  O  O46  1  0.36280800  0.05595500  0.12501600  1.0
  O  O47  1  0.86280800  0.94404500  0.37498400  1.0
  O  O48  1  0.69402800  0.43696900  0.59523900  1.0
  O  O49  1  0.19402800  0.56303100  0.90476100  1.0
  O  O50  1  0.30597200  0.56303100  0.40476100  1.0
  O  O51  1  0.80597200  0.43696900  0.09523900  1.0