# generated using pymatgen
data_ZnCu3P3O13
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.12522900
_cell_length_b   7.59059500
_cell_length_c   10.07667161
_cell_angle_alpha   79.28685554
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnCu3P3O13
_chemical_formula_sum   'Zn2 Cu6 P6 O26'
_cell_volume   460.34012737
_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
  Zn  Zn0  1  0.75000000  0.35987200  0.17554600  1.0
  Zn  Zn1  1  0.25000000  0.64012800  0.82445400  1.0
  Cu  Cu2  1  0.25000000  0.64992000  0.20249300  1.0
  Cu  Cu3  1  0.75000000  0.35008000  0.79750700  1.0
  Cu  Cu4  1  0.25000000  0.23572800  0.43188300  1.0
  Cu  Cu5  1  0.50000000  0.00000000  0.00000000  1.0
  Cu  Cu6  1  0.75000000  0.76427200  0.56811700  1.0
  Cu  Cu7  1  0.00000000  0.00000000  0.00000000  1.0
  P  P8  1  0.25000000  0.79047400  0.48865600  1.0
  P  P9  1  0.75000000  0.20952600  0.51134400  1.0
  P  P10  1  0.25000000  0.26269600  0.75956400  1.0
  P  P11  1  0.75000000  0.73730400  0.24043600  1.0
  P  P12  1  0.75000000  0.67909200  0.88562300  1.0
  P  P13  1  0.25000000  0.32090800  0.11437700  1.0
  O  O14  1  0.75000000  0.62048500  0.74416100  1.0
  O  O15  1  0.56114300  0.24968400  0.40459100  1.0
  O  O16  1  0.25000000  0.20227500  0.62558900  1.0
  O  O17  1  0.53472400  0.78412600  0.89374600  1.0
  O  O18  1  0.75000000  0.35312800  0.60122800  1.0
  O  O19  1  0.75000000  0.11812500  0.90625000  1.0
  O  O20  1  0.25000000  0.64687200  0.39877200  1.0
  O  O21  1  0.03472400  0.21587400  0.10625400  1.0
  O  O22  1  0.25000000  0.97575500  0.40063200  1.0
  O  O23  1  0.75000000  0.02424500  0.59936800  1.0
  O  O24  1  0.06179500  0.38826200  0.78878700  1.0
  O  O25  1  0.25000000  0.88187500  0.09375000  1.0
  O  O26  1  0.56179500  0.61173800  0.21121300  1.0
  O  O27  1  0.75000000  0.49186600  0.97709200  1.0
  O  O28  1  0.75000000  0.79772500  0.37441100  1.0
  O  O29  1  0.46527600  0.21587400  0.10625400  1.0
  O  O30  1  0.93885700  0.24968400  0.40459100  1.0
  O  O31  1  0.43885700  0.75031600  0.59540900  1.0
  O  O32  1  0.43820500  0.38826200  0.78878700  1.0
  O  O33  1  0.25000000  0.37951500  0.25583900  1.0
  O  O34  1  0.75000000  0.91049300  0.12783300  1.0
  O  O35  1  0.25000000  0.08950700  0.87216700  1.0
  O  O36  1  0.93820500  0.61173800  0.21121300  1.0
  O  O37  1  0.96527600  0.78412600  0.89374600  1.0
  O  O38  1  0.06114300  0.75031600  0.59540900  1.0
  O  O39  1  0.25000000  0.50813400  0.02290800  1.0