# generated using pymatgen
data_Cr2Cu5(P2O9)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.37540213
_cell_length_b   7.37540213
_cell_length_c   8.38478994
_cell_angle_alpha   70.04862393
_cell_angle_beta   70.04862393
_cell_angle_gamma   51.91084477
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2Cu5(P2O9)2
_chemical_formula_sum   'Cr2 Cu5 P4 O18'
_cell_volume   332.12262955
_cell_formula_units_Z   1
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  0.39057100  0.39057100  0.97050500  1.0
  Cr  Cr1  1  0.60942900  0.60942900  0.02949500  1.0
  Cu  Cu2  1  0.11978300  0.63252000  0.26911500  1.0
  Cu  Cu3  1  0.63252000  0.11978300  0.26911500  1.0
  Cu  Cu4  1  0.88021700  0.36748000  0.73088500  1.0
  Cu  Cu5  1  0.36748000  0.88021700  0.73088500  1.0
  Cu  Cu6  1  0.00000000  0.00000000  0.50000000  1.0
  P  P7  1  0.34153500  0.34153500  0.59480600  1.0
  P  P8  1  0.65846500  0.65846500  0.40519400  1.0
  P  P9  1  0.12601500  0.12601500  0.08970300  1.0
  P  P10  1  0.87398500  0.87398500  0.91029700  1.0
  O  O11  1  0.02435900  0.02435900  0.26095200  1.0
  O  O12  1  0.97564100  0.97564100  0.73904800  1.0
  O  O13  1  0.23049500  0.23049500  0.12576800  1.0
  O  O14  1  0.76950500  0.76950500  0.87423200  1.0
  O  O15  1  0.18356600  0.58825200  0.49132900  1.0
  O  O16  1  0.58825200  0.18356600  0.49132900  1.0
  O  O17  1  0.81643400  0.41174800  0.50867100  1.0
  O  O18  1  0.41174800  0.81643400  0.50867100  1.0
  O  O19  1  0.07607800  0.69163500  0.01824800  1.0
  O  O20  1  0.69163500  0.07607800  0.01824800  1.0
  O  O21  1  0.92392200  0.30836500  0.98175200  1.0
  O  O22  1  0.30836500  0.92392200  0.98175200  1.0
  O  O23  1  0.36494600  0.36494600  0.75743300  1.0
  O  O24  1  0.63505400  0.63505400  0.24256700  1.0
  O  O25  1  0.78638400  0.78638400  0.35983900  1.0
  O  O26  1  0.21361600  0.21361600  0.64016100  1.0
  O  O27  1  0.44294800  0.44294800  0.16498800  1.0
  O  O28  1  0.55705200  0.55705200  0.83501200  1.0