# generated using pymatgen
data_BaMo2(PO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.53146750
_cell_length_b   9.53146750
_cell_length_c   9.53146750
_cell_angle_alpha   54.72538538
_cell_angle_beta   54.72538538
_cell_angle_gamma   54.72538081
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaMo2(PO4)3
_chemical_formula_sum   'Ba2 Mo4 P6 O24'
_cell_volume   537.07257561
_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  0.50000000  0.50000000  0.50000000  1.0
  Ba  Ba1  1  0.00000000  0.00000000  0.00000000  1.0
  Mo  Mo2  1  0.65075100  0.65075100  0.65075100  1.0
  Mo  Mo3  1  0.84924900  0.84924900  0.84924900  1.0
  Mo  Mo4  1  0.34924900  0.34924900  0.34924900  1.0
  Mo  Mo5  1  0.15075100  0.15075100  0.15075100  1.0
  P  P6  1  0.46247900  0.03752100  0.75000000  1.0
  P  P7  1  0.03752100  0.75000000  0.46247900  1.0
  P  P8  1  0.75000000  0.46247900  0.03752100  1.0
  P  P9  1  0.53752100  0.96247900  0.25000000  1.0
  P  P10  1  0.96247900  0.25000000  0.53752100  1.0
  P  P11  1  0.25000000  0.53752100  0.96247900  1.0
  O  O12  1  0.86943100  0.74405900  0.48082500  1.0
  O  O13  1  0.74405900  0.48082500  0.86943100  1.0
  O  O14  1  0.48082500  0.86943100  0.74405900  1.0
  O  O15  1  0.75594100  0.63056900  0.01917500  1.0
  O  O16  1  0.63056900  0.01917500  0.75594100  1.0
  O  O17  1  0.01917500  0.75594100  0.63056900  1.0
  O  O18  1  0.13056900  0.25594100  0.51917500  1.0
  O  O19  1  0.25594100  0.51917500  0.13056900  1.0
  O  O20  1  0.51917500  0.13056900  0.25594100  1.0
  O  O21  1  0.24405900  0.36943100  0.98082500  1.0
  O  O22  1  0.36943100  0.98082500  0.24405900  1.0
  O  O23  1  0.98082500  0.24405900  0.36943100  1.0
  O  O24  1  0.56956400  0.78886700  0.42338300  1.0
  O  O25  1  0.78886700  0.42338300  0.56956400  1.0
  O  O26  1  0.42338300  0.56956400  0.78886700  1.0
  O  O27  1  0.71113300  0.93043600  0.07661700  1.0
  O  O28  1  0.93043600  0.07661700  0.71113300  1.0
  O  O29  1  0.07661700  0.71113300  0.93043600  1.0
  O  O30  1  0.43043600  0.21113300  0.57661700  1.0
  O  O31  1  0.21113300  0.57661700  0.43043600  1.0
  O  O32  1  0.57661700  0.43043600  0.21113300  1.0
  O  O33  1  0.28886700  0.06956400  0.92338300  1.0
  O  O34  1  0.06956400  0.92338300  0.28886700  1.0
  O  O35  1  0.92338300  0.28886700  0.06956400  1.0