# generated using pymatgen
data_Si2NiO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.05349977
_cell_length_b   11.30804481
_cell_length_c   18.40151374
_cell_angle_alpha   89.91893167
_cell_angle_beta   90.03721922
_cell_angle_gamma   89.94603923
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Si2NiO6
_chemical_formula_sum   'Si16 Ni8 O48'
_cell_volume   1051.55647351
_cell_formula_units_Z   8
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
  Si  Si0  1  0.64421800  0.66869800  0.23149700  1.0
  Si  Si1  1  0.76045700  0.83068100  0.51771300  1.0
  Si  Si2  1  0.74077300  0.82862600  0.01642300  1.0
  Si  Si3  1  0.85586300  0.16907300  0.76855400  1.0
  Si  Si4  1  0.14586000  0.33065600  0.26867000  1.0
  Si  Si5  1  0.35335300  0.83091800  0.73100900  1.0
  Si  Si6  1  0.25901900  0.67113800  0.51714400  1.0
  Si  Si7  1  0.75380700  0.32891600  0.98383200  1.0
  Si  Si8  1  0.74439300  0.32917900  0.48402400  1.0
  Si  Si9  1  0.85341800  0.66910500  0.73159500  1.0
  Si  Si10  1  0.35569500  0.33004700  0.76923600  1.0
  Si  Si11  1  0.64594200  0.16926200  0.26769700  1.0
  Si  Si12  1  0.24496100  0.16959900  0.48282900  1.0
  Si  Si13  1  0.14366800  0.83002200  0.23023700  1.0
  Si  Si14  1  0.24057400  0.67035600  0.01614000  1.0
  Si  Si15  1  0.25427200  0.17111400  0.98386300  1.0
  Ni  Ni16  1  0.45803700  0.02544500  0.12517100  1.0
  Ni  Ni17  1  0.54126500  0.97621900  0.87486200  1.0
  Ni  Ni18  1  0.96267600  0.97591000  0.37347300  1.0
  Ni  Ni19  1  0.03923100  0.02797300  0.62528400  1.0
  Ni  Ni20  1  0.45993200  0.52506400  0.37505900  1.0
  Ni  Ni21  1  0.54315000  0.47373700  0.62582600  1.0
  Ni  Ni22  1  0.95720900  0.47488500  0.12529000  1.0
  Ni  Ni23  1  0.04067900  0.52440400  0.87493800  1.0
  O  O24  1  0.79214600  0.55978400  0.67690100  1.0
  O  O25  1  0.31180400  0.06277000  0.92782600  1.0
  O  O26  1  0.21088100  0.43942300  0.32373600  1.0
  O  O27  1  0.77515200  0.37259100  0.06789500  1.0
  O  O28  1  0.27479600  0.12742000  0.06786300  1.0
  O  O29  1  0.95179100  0.21676800  0.96871000  1.0
  O  O30  1  0.82188800  0.60965800  0.81208000  1.0
  O  O31  1  0.17535100  0.88937300  0.31077700  1.0
  O  O32  1  0.78632200  0.87824400  0.43450600  1.0
  O  O33  1  0.82524600  0.11335800  0.68750200  1.0
  O  O34  1  0.29039400  0.44007800  0.82329900  1.0
  O  O35  1  0.72481100  0.37267000  0.56798100  1.0
  O  O36  1  0.68615400  0.93704800  0.07225000  1.0
  O  O37  1  0.32491000  0.89123100  0.81152200  1.0
  O  O38  1  0.71132000  0.05987200  0.32258600  1.0
  O  O39  1  0.31684600  0.56536900  0.57485800  1.0
  O  O40  1  0.28665700  0.94021100  0.67709600  1.0
  O  O41  1  0.15374300  0.71884100  0.72068000  1.0
  O  O42  1  0.34381700  0.71792200  0.21936200  1.0
  O  O43  1  0.54197000  0.71692600  0.03072200  1.0
  O  O44  1  0.72127700  0.87325200  0.93236300  1.0
  O  O45  1  0.67498900  0.61250300  0.31303800  1.0
  O  O46  1  0.81189000  0.43706800  0.92770800  1.0
  O  O47  1  0.15557700  0.21848800  0.78184500  1.0
  O  O48  1  0.23535000  0.11908300  0.56539800  1.0
  O  O49  1  0.67529800  0.11215300  0.18663600  1.0
  O  O50  1  0.68926000  0.43746300  0.42766200  1.0
  O  O51  1  0.27494600  0.62436500  0.43367900  1.0
  O  O52  1  0.18669100  0.56177900  0.07228500  1.0
  O  O53  1  0.65329700  0.78069800  0.71966000  1.0
  O  O54  1  0.20669900  0.93857900  0.17489800  1.0
  O  O55  1  0.84366300  0.78034100  0.21855800  1.0
  O  O56  1  0.84555300  0.28102300  0.28021500  1.0
  O  O57  1  0.80854800  0.93732400  0.57462200  1.0
  O  O58  1  0.21875300  0.62855400  0.93175400  1.0
  O  O59  1  0.19460100  0.06525500  0.42336000  1.0
  O  O60  1  0.34521800  0.21843400  0.27988200  1.0
  O  O61  1  0.04129900  0.78147100  0.03191900  1.0
  O  O62  1  0.45833400  0.78317200  0.52947700  1.0
  O  O63  1  0.65589900  0.28092100  0.78177800  1.0
  O  O64  1  0.45172800  0.28327800  0.96867000  1.0
  O  O65  1  0.54398200  0.21881800  0.46814200  1.0
  O  O66  1  0.04384500  0.28080500  0.46917100  1.0
  O  O67  1  0.32501700  0.38691000  0.68775100  1.0
  O  O68  1  0.70807600  0.55924000  0.17696100  1.0
  O  O69  1  0.95840900  0.71843100  0.53220300  1.0
  O  O70  1  0.17682600  0.39007500  0.18806800  1.0
  O  O71  1  0.79052500  0.05992900  0.82377900  1.0