# generated using pymatgen
data_AlPO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.95155234
_cell_length_b   4.95157900
_cell_length_c   10.94448261
_cell_angle_alpha   89.99919369
_cell_angle_beta   90.00095509
_cell_angle_gamma   120.00122658
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlPO4
_chemical_formula_sum   'Al3 P3 O12'
_cell_volume   232.38365916
_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  0.46612710  -0.00000968  0.66667093  1.0
  Al  Al1  1  0.00000160  0.46613680  0.33333088  1.0
  Al  Al2  1  0.53387152  0.53387354  -0.00000122  1.0
  P  P3  1  0.46579313  0.00000072  0.16666757  1.0
  P  P4  1  -0.00000395  0.46579134  0.83333146  1.0
  P  P5  1  0.53420865  0.53420533  0.50000095  1.0
  O  O6  1  0.15685379  0.74262941  0.21710004  1.0
  O  O7  1  0.25738290  0.41421808  0.88377405  1.0
  O  O8  1  0.58576939  0.84314618  0.55044730  1.0
  O  O9  1  0.41421814  0.25738517  0.11622140  1.0
  O  O10  1  0.84314692  0.58576395  0.44955635  1.0
  O  O11  1  0.74262221  0.15684755  0.78290178  1.0
  O  O12  1  0.70693746  0.12421834  0.26910151  1.0
  O  O13  1  0.87579618  0.58274685  0.93578081  1.0
  O  O14  1  0.41726567  0.29304529  0.60244145  1.0
  O  O15  1  0.58274779  0.87579729  0.06421737  1.0
  O  O16  1  0.29305142  0.41726997  0.39756148  1.0
  O  O17  1  0.12420909  0.70693187  0.73089590  1.0