# generated using pymatgen
data_LiMgAl3(SO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.75061653
_cell_length_b   17.50176761
_cell_length_c   15.44425776
_cell_angle_alpha   27.96462556
_cell_angle_beta   50.62089192
_cell_angle_gamma   55.75395676
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMgAl3(SO4)6
_chemical_formula_sum   'Li2 Mg2 Al6 S12 O48'
_cell_volume   857.31947759
_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
  Li  Li0  1  0.27768300  0.39648400  0.67848100  1
  Li  Li1  1  0.72231700  0.60351600  0.32151900  1
  Mg  Mg2  1  0.35647300  0.49877900  0.35535800  1
  Mg  Mg3  1  0.64352700  0.50122100  0.64464200  1
  Al  Al4  1  0.14148200  0.99839800  0.15782100  1
  Al  Al5  1  0.35871300  0.99482300  0.35936200  1
  Al  Al6  1  0.15883100  0.50317600  0.14218200  1
  Al  Al7  1  0.64128700  0.00517700  0.64063800  1
  Al  Al8  1  0.84116900  0.49682400  0.85781800  1
  Al  Al9  1  0.85851800  0.00160200  0.84217900  1
  S  S10  1  0.03232700  0.14685100  0.45865000  1
  S  S11  1  0.74530400  0.20653200  0.04548800  1
  S  S12  1  0.53641700  0.35145500  0.25294400  1
  S  S13  1  0.04468200  0.64321300  0.46800600  1
  S  S14  1  0.45346500  0.13061000  0.76742000  1
  S  S15  1  0.76355400  0.71034400  0.03674600  1
  S  S16  1  0.23644600  0.28965600  0.96325400  1
  S  S17  1  0.54653500  0.86939000  0.23258000  1
  S  S18  1  0.95531800  0.35678700  0.53199400  1
  S  S19  1  0.46358300  0.64854500  0.74705600  1
  S  S20  1  0.25469600  0.79346800  0.95451200  1
  S  S21  1  0.96767300  0.85314900  0.54135000  1
  O  O22  1  0.29254800  0.18269800  0.12206000  1
  O  O23  1  0.03459300  0.31923100  0.31255200  1
  O  O24  1  0.01778100  0.03491000  0.65138300  1
  O  O25  1  0.21579600  0.10722100  0.38564100  1
  O  O26  1  0.58983900  0.08227600  0.23629700  1
  O  O27  1  0.34221000  0.35491100  0.27343700  1
  O  O28  1  0.10567300  0.38255300  0.51765300  1
  O  O29  1  0.73252700  0.31397900  0.01986500  1
  O  O30  1  0.94237100  0.12532000  0.05170300  1
  O  O31  1  0.28029300  0.70402600  0.11562000  1
  O  O32  1  0.60569700  0.17994500  0.39962600  1
  O  O33  1  0.67896600  0.45634900  0.05030800  1
  O  O34  1  0.03258200  0.81261000  0.33338100  1
  O  O35  1  0.51990000  0.41256300  0.28590700  1
  O  O36  1  0.02062200  0.52665200  0.66936500  1
  O  O37  1  0.24599800  0.60153700  0.40621400  1
  O  O38  1  0.46958800  0.08353500  0.71669500  1
  O  O39  1  0.31162900  0.02155400  0.97157700  1
  O  O40  1  0.38109500  0.30108400  0.63014700  1
  O  O41  1  0.62584400  0.57528500  0.23457200  1
  O  O42  1  0.03292300  0.35139600  0.98841800  1
  O  O43  1  0.24603600  0.19691700  0.96718300  1
  O  O44  1  0.85937700  0.12421300  0.48581000  1
  O  O45  1  0.34874200  0.87495700  0.25658100  1
  O  O46  1  0.65125800  0.12504300  0.74341900  1
  O  O47  1  0.14062300  0.87578700  0.51419000  1
  O  O48  1  0.75396400  0.80308300  0.03281700  1
  O  O49  1  0.96707700  0.64860400  0.01158200  1
  O  O50  1  0.37415600  0.42471500  0.76542800  1
  O  O51  1  0.61890500  0.69891600  0.36985300  1
  O  O52  1  0.68837100  0.97844600  0.02842300  1
  O  O53  1  0.53041200  0.91646500  0.28330500  1
  O  O54  1  0.75400200  0.39846300  0.59378600  1
  O  O55  1  0.97937800  0.47334800  0.33063400  1
  O  O56  1  0.48010000  0.58743700  0.71409300  1
  O  O57  1  0.96741800  0.18739000  0.66661900  1
  O  O58  1  0.32103400  0.54365100  0.94969200  1
  O  O59  1  0.39430300  0.82005500  0.60037400  1
  O  O60  1  0.71970700  0.29597400  0.88438000  1
  O  O61  1  0.05762900  0.87468000  0.94829700  1
  O  O62  1  0.26747300  0.68602100  0.98013500  1
  O  O63  1  0.89432700  0.61744700  0.48234700  1
  O  O64  1  0.65779000  0.64508900  0.72656300  1
  O  O65  1  0.41016100  0.91772400  0.76370300  1
  O  O66  1  0.78420400  0.89277900  0.61435900  1
  O  O67  1  0.98221900  0.96509000  0.34861700  1
  O  O68  1  0.96540700  0.68076900  0.68744800  1
  O  O69  1  0.70745200  0.81730200  0.87794000  1
