# generated using pymatgen
data_AlPO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.39426430
_cell_length_b   5.39426430
_cell_length_c   10.87933500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000362
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlPO4
_chemical_formula_sum   'Al3 P3 O12'
_cell_volume   274.15578101
_cell_formula_units_Z   3
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
  Al  Al0  1  0.00000000  0.50000000  0.83333300  1.0
  Al  Al1  1  0.50000000  0.00000000  0.50000000  1.0
  Al  Al2  1  0.50000000  0.50000000  0.16666700  1.0
  P  P3  1  0.50000000  0.50000000  0.66666700  1.0
  P  P4  1  0.00000000  0.50000000  0.33333300  1.0
  P  P5  1  0.50000000  0.00000000  0.00000000  1.0
  O  O6  1  0.56274100  0.26524500  0.26686000  1.0
  O  O7  1  0.73475500  0.29749600  0.60019400  1.0
  O  O8  1  0.26524500  0.70250400  0.60019400  1.0
  O  O9  1  0.26524500  0.56274100  0.06647300  1.0
  O  O10  1  0.56274100  0.29749600  0.39980600  1.0
  O  O11  1  0.29749600  0.56274100  0.93352700  1.0
  O  O12  1  0.43725900  0.73475500  0.26686000  1.0
  O  O13  1  0.73475500  0.43725900  0.06647300  1.0
  O  O14  1  0.43725900  0.70250400  0.39980600  1.0
  O  O15  1  0.70250400  0.43725900  0.93352700  1.0
  O  O16  1  0.70250400  0.26524500  0.73314000  1.0
  O  O17  1  0.29749600  0.73475500  0.73314000  1.0