# generated using pymatgen
data_Mg3(Mo3Se4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.94977700
_cell_length_b   6.99164705
_cell_length_c   13.86824128
_cell_angle_alpha   94.30119122
_cell_angle_beta   95.24694428
_cell_angle_gamma   93.11872853
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg3(Mo3Se4)4
_chemical_formula_sum   'Mg3 Mo12 Se16'
_cell_volume   667.87496037
_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
  Mg  Mg0  1  0.95231400  0.04364000  0.68010200  1.0
  Mg  Mg1  1  0.04856400  0.95541000  0.32146000  1.0
  Mg  Mg2  1  0.40582300  0.97368900  0.01045300  1.0
  Mo  Mo3  1  0.58336900  0.45701000  0.87946600  1.0
  Mo  Mo4  1  0.23778700  0.41997600  0.76901600  1.0
  Mo  Mo5  1  0.45172300  0.75693100  0.79165000  1.0
  Mo  Mo6  1  0.54760100  0.24499900  0.70584300  1.0
  Mo  Mo7  1  0.75686400  0.58784200  0.72870100  1.0
  Mo  Mo8  1  0.41214300  0.54578500  0.61785700  1.0
  Mo  Mo9  1  0.58787000  0.45411000  0.38199300  1.0
  Mo  Mo10  1  0.24608700  0.41493400  0.27267500  1.0
  Mo  Mo11  1  0.45488300  0.75815800  0.29385200  1.0
  Mo  Mo12  1  0.54754500  0.23954100  0.20793900  1.0
  Mo  Mo13  1  0.75819900  0.57699900  0.22937600  1.0
  Mo  Mo14  1  0.41710400  0.54361600  0.12065200  1.0
  Se  Se15  1  0.27427200  0.62171400  0.93586900  1.0
  Se  Se16  1  0.37036200  0.13050700  0.85100000  1.0
  Se  Se17  1  0.78129000  0.78070100  0.89618400  1.0
  Se  Se18  1  0.88020200  0.28886700  0.82005900  1.0
  Se  Se19  1  0.12126000  0.71790100  0.68257900  1.0
  Se  Se20  1  0.22311100  0.21704400  0.59783200  1.0
  Se  Se21  1  0.60920200  0.87326100  0.63745100  1.0
  Se  Se22  1  0.72512200  0.37538200  0.56698600  1.0
  Se  Se23  1  0.27850400  0.62935200  0.43351700  1.0
  Se  Se24  1  0.39231600  0.12617800  0.36295200  1.0
  Se  Se25  1  0.77638600  0.78275800  0.40246100  1.0
  Se  Se26  1  0.87802200  0.28085400  0.31727000  1.0
  Se  Se27  1  0.12033000  0.71241200  0.18077200  1.0
  Se  Se28  1  0.20728900  0.22495500  0.10290200  1.0
  Se  Se29  1  0.63776100  0.87268200  0.14778300  1.0
  Se  Se30  1  0.71469500  0.36779400  0.06434600  1.0