[CIF]
data_Ba2Cu3P4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.38919694
_cell_length_b   8.38919694
_cell_length_c   8.38919694
_cell_angle_alpha   112.03962723
_cell_angle_beta   84.21192750
_cell_angle_gamma   136.51890179
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2Cu3P4
_chemical_formula_sum   'Ba4 Cu6 P8'
_cell_volume   362.73120546
_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
  Ba  Ba0  1  2.77860498  1.35914645  3.10739400  1
  Ba  Ba1  1  1.91016902  4.86484955  -0.00000000  1
  Ba  Ba2  1  -1.91016902  4.86484955  3.10739400  1
  Ba  Ba3  1  6.59894302  1.35914645  -0.00000000  1
  Cu  Cu4  1  0.00000000  0.00000000  1.55369700  1
  Cu  Cu5  1  0.00000000  0.00000000  4.66109100  1
  Cu  Cu6  1  -0.00000000  2.74892742  4.66109100  1
  Cu  Cu7  1  4.68877400  3.47506858  1.55369700  1
  Cu  Cu8  1  0.00000000  2.74892742  1.55369700  1
  Cu  Cu9  1  4.68877400  3.47506858  -1.55369700  1
  P  P10  1  1.24027450  -1.51276712  3.10739400  1
  P  P11  1  3.44849950  7.73676312  -0.00000000  1
  P  P12  1  1.24027450  1.51276712  0.00000000  1
  P  P13  1  3.44849950  4.71122888  3.10739400  1
  P  P14  1  3.44823693  1.98636343  0.00000000  1
  P  P15  1  1.24053707  4.23763257  3.10739400  1
  P  P16  1  1.24053707  8.21035943  0.00000000  1
  P  P17  1  3.44823693  -1.98636343  3.10739400  1
[/CIF]
