# generated using pymatgen
data_Ca15Ni(IrO6)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.38590600
_cell_length_b   6.57804000
_cell_length_c   9.22314894
_cell_angle_alpha   88.67344007
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca15Ni(IrO6)4
_chemical_formula_sum   'Ca15 Ni1 Ir4 O24'
_cell_volume   569.29257483
_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  0.68007000  0.63741700  0.32056900  1.0
  Ca  Ca1  1  0.17722000  0.64654200  0.82174200  1.0
  Ca  Ca2  1  0.17722000  0.35345800  0.17825800  1.0
  Ca  Ca3  1  0.68007000  0.36258300  0.67943100  1.0
  Ca  Ca4  1  0.13893000  0.00000000  0.50000000  1.0
  Ca  Ca5  1  0.64593600  0.00000000  0.00000000  1.0
  Ca  Ca6  1  0.82068300  0.13888700  0.31328800  1.0
  Ca  Ca7  1  0.31692500  0.13524800  0.82370500  1.0
  Ca  Ca8  1  0.86463700  0.50000000  0.00000000  1.0
  Ca  Ca9  1  0.35947300  0.50000000  0.50000000  1.0
  Ca  Ca10  1  0.31692500  0.86475200  0.17629500  1.0
  Ca  Ca11  1  0.82068300  0.86111300  0.68671200  1.0
  Ca  Ca12  1  0.50034800  0.00000000  0.50000000  1.0
  Ca  Ca13  1  0.99917700  0.50000000  0.50000000  1.0
  Ca  Ca14  1  0.49981500  0.50000000  0.00000000  1.0
  Ni  Ni15  1  0.99979700  0.00000000  0.00000000  1.0
  Ir  Ir16  1  0.00057700  0.75228500  0.24759700  1.0
  Ir  Ir17  1  0.49972200  0.74980600  0.75014300  1.0
  Ir  Ir18  1  0.00057700  0.24771500  0.75240300  1.0
  Ir  Ir19  1  0.49972200  0.25019400  0.24985700  1.0
  O  O20  1  0.10797400  0.71161000  0.05981700  1.0
  O  O21  1  0.61204500  0.69406900  0.56545400  1.0
  O  O22  1  0.05837700  0.04787700  0.22534100  1.0
  O  O23  1  0.56741200  0.04691700  0.74290700  1.0
  O  O24  1  0.83490400  0.83127900  0.11801600  1.0
  O  O25  1  0.32131700  0.82598800  0.63106000  1.0
  O  O26  1  0.88849800  0.19364300  0.56687500  1.0
  O  O27  1  0.38725300  0.19577100  0.06567600  1.0
  O  O28  1  0.67587100  0.32536100  0.13000000  1.0
  O  O29  1  0.17499300  0.31905900  0.62943800  1.0
  O  O30  1  0.43538400  0.54705600  0.24256400  1.0
  O  O31  1  0.93672100  0.54518000  0.74127500  1.0
  O  O32  1  0.88849800  0.80635700  0.43312500  1.0
  O  O33  1  0.38725300  0.80422900  0.93432400  1.0
  O  O34  1  0.93672100  0.45482000  0.25872500  1.0
  O  O35  1  0.43538400  0.45294400  0.75743600  1.0
  O  O36  1  0.17499300  0.68094100  0.37056200  1.0
  O  O37  1  0.67587100  0.67463900  0.87000000  1.0
  O  O38  1  0.10797400  0.28839000  0.94018300  1.0
  O  O39  1  0.61204500  0.30593100  0.43454600  1.0
  O  O40  1  0.32131700  0.17401200  0.36894000  1.0
  O  O41  1  0.83490400  0.16872100  0.88198400  1.0
  O  O42  1  0.56741200  0.95308300  0.25709300  1.0
  O  O43  1  0.05837700  0.95212300  0.77465900  1.0