# generated using pymatgen
data_Li2Ni2(MoO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.14707900
_cell_length_b   10.57965700
_cell_length_c   17.87180700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Ni2(MoO4)3
_chemical_formula_sum   'Li8 Ni8 Mo12 O48'
_cell_volume   973.19728272
_cell_formula_units_Z   4
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
  Li  Li0  1  0.09649800  0.25000000  0.24967500  1
  Li  Li1  1  0.90350200  0.75000000  0.75032500  1
  Li  Li2  1  0.40350200  0.75000000  0.74967500  1
  Li  Li3  1  0.59649800  0.25000000  0.25032500  1
  Li  Li4  1  0.23533600  0.25000000  0.69001600  1
  Li  Li5  1  0.76466400  0.75000000  0.30998400  1
  Li  Li6  1  0.26466400  0.75000000  0.19001600  1
  Li  Li7  1  0.73533600  0.25000000  0.80998400  1
  Ni  Ni8  1  0.24691100  0.07220400  0.52718600  1
  Ni  Ni9  1  0.75308900  0.92779600  0.47281400  1
  Ni  Ni10  1  0.25308900  0.92779600  0.02718600  1
  Ni  Ni11  1  0.75308900  0.57220400  0.47281400  1
  Ni  Ni12  1  0.74691100  0.07220400  0.97281400  1
  Ni  Ni13  1  0.24691100  0.42779600  0.52718600  1
  Ni  Ni14  1  0.74691100  0.42779600  0.97281400  1
  Ni  Ni15  1  0.25308900  0.57220400  0.02718600  1
  Mo  Mo16  1  0.28117800  0.52627400  0.34457300  1
  Mo  Mo17  1  0.71882200  0.47372600  0.65542700  1
  Mo  Mo18  1  0.21882200  0.47372600  0.84457300  1
  Mo  Mo19  1  0.71882200  0.02627400  0.65542700  1
  Mo  Mo20  1  0.78117800  0.52627400  0.15542700  1
  Mo  Mo21  1  0.28117800  0.97372600  0.34457300  1
  Mo  Mo22  1  0.78117800  0.97372600  0.15542700  1
  Mo  Mo23  1  0.21882200  0.02627400  0.84457300  1
  Mo  Mo24  1  0.28184700  0.25000000  0.05545800  1
  Mo  Mo25  1  0.71815300  0.75000000  0.94454200  1
  Mo  Mo26  1  0.21815300  0.75000000  0.55545800  1
  Mo  Mo27  1  0.78184700  0.25000000  0.44454200  1
  O  O28  1  0.08234200  0.62334800  0.28812500  1
  O  O29  1  0.91765800  0.37665200  0.71187500  1
  O  O30  1  0.41765800  0.37665200  0.78812500  1
  O  O31  1  0.91765800  0.12334800  0.71187500  1
  O  O32  1  0.58234200  0.62334800  0.21187500  1
  O  O33  1  0.08234200  0.87665200  0.28812500  1
  O  O34  1  0.58234200  0.87665200  0.21187500  1
  O  O35  1  0.41765800  0.12334800  0.78812500  1
  O  O36  1  0.07903200  0.01152100  0.42803000  1
  O  O37  1  0.92096800  0.98847900  0.57197000  1
  O  O38  1  0.42096800  0.98847900  0.92803000  1
  O  O39  1  0.92096800  0.51152100  0.57197000  1
  O  O40  1  0.57903200  0.01152100  0.07197000  1
  O  O41  1  0.07903200  0.48847900  0.42803000  1
  O  O42  1  0.57903200  0.48847900  0.07197000  1
  O  O43  1  0.42096800  0.51152100  0.92803000  1
  O  O44  1  0.35207800  0.11578300  0.29644000  1
  O  O45  1  0.64792200  0.88421700  0.70356000  1
  O  O46  1  0.14792200  0.88421700  0.79644000  1
  O  O47  1  0.64792200  0.61578300  0.70356000  1
  O  O48  1  0.85207800  0.11578300  0.20356000  1
  O  O49  1  0.35207800  0.38421700  0.29644000  1
  O  O50  1  0.85207800  0.38421700  0.20356000  1
  O  O51  1  0.14792200  0.61578300  0.79644000  1
  O  O52  1  0.06829700  0.25000000  0.50696300  1
  O  O53  1  0.93170300  0.75000000  0.49303700  1
  O  O54  1  0.43170300  0.75000000  0.00696300  1
  O  O55  1  0.56829700  0.25000000  0.99303700  1
  O  O56  1  0.35683500  0.25000000  0.15073000  1
  O  O57  1  0.64316500  0.75000000  0.84927000  1
  O  O58  1  0.14316500  0.75000000  0.65073000  1
  O  O59  1  0.85683500  0.25000000  0.34927000  1
  O  O60  1  0.07970200  0.11302400  0.03497100  1
  O  O61  1  0.92029800  0.88697600  0.96502900  1
  O  O62  1  0.42029800  0.88697600  0.53497100  1
  O  O63  1  0.92029800  0.61302400  0.96502900  1
  O  O64  1  0.57970200  0.11302400  0.46502900  1
  O  O65  1  0.07970200  0.38697600  0.03497100  1
  O  O66  1  0.57970200  0.38697600  0.46502900  1
  O  O67  1  0.42029800  0.61302400  0.53497100  1
  O  O68  1  0.07003700  0.61205500  0.12477100  1
  O  O69  1  0.92996300  0.38794500  0.87522900  1
  O  O70  1  0.42996300  0.38794500  0.62477100  1
  O  O71  1  0.92996300  0.11205500  0.87522900  1
  O  O72  1  0.57003700  0.61205500  0.37522900  1
  O  O73  1  0.07003700  0.88794500  0.12477100  1
  O  O74  1  0.57003700  0.88794500  0.37522900  1
  O  O75  1  0.42996300  0.11205500  0.62477100  1
