# generated using pymatgen
data_Ca3Zr17O37
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.64856036
_cell_length_b   3.64848086
_cell_length_c   73.82089985
_cell_angle_alpha   60.37868298
_cell_angle_beta   60.37836996
_cell_angle_gamma   59.99788725
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3Zr17O37
_chemical_formula_sum   'Ca3 Zr17 O37'
_cell_volume   698.79882292
_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
  Ca  Ca0  1  0.00863000  0.00864500  0.04870700  1.0
  Ca  Ca1  1  0.01268500  0.01267900  0.09809900  1.0
  Ca  Ca2  1  0.02723400  0.02716800  0.94592100  1.0
  Zr  Zr3  1  0.00184100  0.00147200  0.99974800  1.0
  Zr  Zr4  1  0.97884300  0.97870200  0.15318400  1.0
  Zr  Zr5  1  0.98515600  0.98530800  0.20221600  1.0
  Zr  Zr6  1  0.98743500  0.98746600  0.25188200  1.0
  Zr  Zr7  1  0.98849500  0.98850400  0.30172400  1.0
  Zr  Zr8  1  0.98855000  0.98856400  0.35171600  1.0
  Zr  Zr9  1  0.98884500  0.98886100  0.40167200  1.0
  Zr  Zr10  1  0.98922200  0.98925400  0.45161300  1.0
  Zr  Zr11  1  0.98963500  0.98968200  0.50155000  1.0
  Zr  Zr12  1  0.98988800  0.98989800  0.55151500  1.0
  Zr  Zr13  1  0.99020000  0.99017900  0.60147100  1.0
  Zr  Zr14  1  0.99008800  0.99006600  0.65148900  1.0
  Zr  Zr15  1  0.99041800  0.99041500  0.70143700  1.0
  Zr  Zr16  1  0.99101800  0.99101800  0.75134700  1.0
  Zr  Zr17  1  0.99365300  0.99361700  0.80095400  1.0
  Zr  Zr18  1  0.99887400  0.99877400  0.85017700  1.0
  Zr  Zr19  1  0.00157600  0.00152100  0.89976800  1.0
  O  O20  1  0.74893400  0.74893500  0.03766400  1.0
  O  O21  1  0.75715000  0.75714900  0.08643000  1.0
  O  O22  1  0.25079300  0.25076100  0.16238300  1.0
  O  O23  1  0.25417300  0.25422100  0.21187000  1.0
  O  O24  1  0.76023700  0.76033700  0.13596000  1.0
  O  O25  1  0.25347200  0.25347900  0.26197800  1.0
  O  O26  1  0.75060400  0.75046200  0.18742100  1.0
  O  O27  1  0.75183700  0.75183800  0.23722500  1.0
  O  O28  1  0.25397400  0.25398200  0.31190300  1.0
  O  O29  1  0.25416200  0.25416700  0.36187500  1.0
  O  O30  1  0.75271700  0.75273100  0.28709100  1.0
  O  O31  1  0.75356200  0.75357200  0.33696500  1.0
  O  O32  1  0.25448900  0.25450200  0.41182500  1.0
  O  O33  1  0.75417500  0.75418500  0.38687300  1.0
  O  O34  1  0.25463400  0.25467800  0.46179900  1.0
  O  O35  1  0.25501300  0.25507300  0.51174100  1.0
  O  O36  1  0.75435400  0.75439100  0.43684300  1.0
  O  O37  1  0.75460300  0.75468100  0.48680200  1.0
  O  O38  1  0.25513300  0.25514600  0.56172700  1.0
  O  O39  1  0.75481300  0.75484300  0.53677400  1.0
  O  O40  1  0.25552000  0.25548900  0.61167300  1.0
  O  O41  1  0.75514800  0.75513800  0.58672800  1.0
  O  O42  1  0.25523900  0.25519900  0.66171600  1.0
  O  O43  1  0.75508600  0.75504300  0.63674000  1.0
  O  O44  1  0.25585300  0.25584000  0.71162200  1.0
  O  O45  1  0.25674000  0.25674300  0.76148800  1.0
  O  O46  1  0.75522800  0.75520600  0.68671700  1.0
  O  O47  1  0.75556800  0.75557800  0.73666400  1.0
  O  O48  1  0.26006200  0.26002100  0.81099300  1.0
  O  O49  1  0.75691200  0.75689900  0.78646400  1.0
  O  O50  1  0.26899400  0.26890700  0.85965700  1.0
  O  O51  1  0.28649400  0.28644000  0.90702900  1.0
  O  O52  1  0.76165100  0.76157200  0.83575900  1.0
  O  O53  1  0.20738400  0.20745700  0.96888700  1.0
  O  O54  1  0.76963200  0.76958200  0.88455700  1.0
  O  O55  1  0.77696300  0.77688800  0.93346400  1.0
  O  O56  1  0.64641000  0.64706900  0.00300200  1.0