# generated using pymatgen data_Cr(PO3)5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.72838700 _cell_length_b 5.21512400 _cell_length_c 13.11563781 _cell_angle_alpha 70.09582278 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cr(PO3)5 _chemical_formula_sum 'Cr2 P10 O30' _cell_volume 625.66863190 _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 Cr Cr0 1 0.99725600 0.00946600 0.99580900 1.0 Cr Cr1 1 0.00274400 0.00946600 0.49580900 1.0 P P2 1 0.52989600 0.47239300 0.14267300 1.0 P P3 1 0.82291200 0.43024600 0.08044400 1.0 P P4 1 0.53229100 0.52205100 0.36029600 1.0 P P5 1 0.98323600 0.01060400 0.24613200 1.0 P P6 1 0.01676400 0.01060400 0.74613200 1.0 P P7 1 0.17386300 0.58756200 0.91358500 1.0 P P8 1 0.17708800 0.43024600 0.58044400 1.0 P P9 1 0.82613700 0.58756200 0.41358500 1.0 P P10 1 0.46770900 0.52205100 0.86029600 1.0 P P11 1 0.47010400 0.47239300 0.64267300 1.0 O O12 1 0.15505200 0.73078900 0.55489400 1.0 O O13 1 0.48629200 0.24735900 0.43605100 1.0 O O14 1 0.93925000 0.04577700 0.83985400 1.0 O O15 1 0.47913600 0.74575700 0.06909000 1.0 O O16 1 0.87723400 0.75738500 0.29263900 1.0 O O17 1 0.66350200 0.64167200 0.40106200 1.0 O O18 1 0.58944300 0.27853000 0.66087300 1.0 O O19 1 0.66168800 0.36270100 0.09860500 1.0 O O20 1 0.86857800 0.30121600 0.99962200 1.0 O O21 1 0.87382000 0.71496100 0.49442400 1.0 O O22 1 0.33831200 0.36270100 0.59860500 1.0 O O23 1 0.94258800 0.97026200 0.65202800 1.0 O O24 1 0.40423800 0.49620000 0.75129800 1.0 O O25 1 0.41055700 0.27853000 0.16087300 1.0 O O26 1 0.13142200 0.30121600 0.49962200 1.0 O O27 1 0.84494800 0.73078900 0.05489400 1.0 O O28 1 0.85242000 0.28937400 0.43626600 1.0 O O29 1 0.33649800 0.64167200 0.90106200 1.0 O O30 1 0.58924400 0.71029700 0.84336200 1.0 O O31 1 0.14758000 0.28937400 0.93626600 1.0 O O32 1 0.12618000 0.71496100 0.99442400 1.0 O O33 1 0.05741200 0.97026200 0.15202800 1.0 O O34 1 0.41075600 0.71029700 0.34336200 1.0 O O35 1 0.51370800 0.24735900 0.93605100 1.0 O O36 1 0.12276600 0.75738500 0.79263900 1.0 O O37 1 0.06075000 0.04577700 0.33985400 1.0 O O38 1 0.52086400 0.74575700 0.56909000 1.0 O O39 1 0.59576200 0.49620000 0.25129800 1.0 O O40 1 0.11832700 0.27082300 0.70023600 1.0 O O41 1 0.88167300 0.27082300 0.20023600 1.0