# generated using pymatgen
data_Ca(MoO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.44982455
_cell_length_b   5.52035559
_cell_length_c   7.78738108
_cell_angle_alpha   89.99298782
_cell_angle_beta   90.00336550
_cell_angle_gamma   89.94789126
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca(MoO3)2
_chemical_formula_sum   'Ca2 Mo4 O12'
_cell_volume   234.28302237
_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
  Ca  Ca0  1  0.50698800  0.54286000  0.24976700  1.0
  Ca  Ca1  1  0.00838400  0.95638000  0.75019400  1.0
  Mo  Mo2  1  0.50071200  0.00423300  0.00015800  1.0
  Mo  Mo3  1  0.00044300  0.49582700  0.99985600  1.0
  Mo  Mo4  1  0.00101200  0.49582300  0.50011500  1.0
  Mo  Mo5  1  0.50131700  0.00425400  0.49984300  1.0
  O  O6  1  0.71381100  0.28697000  0.46841800  1.0
  O  O7  1  0.21404400  0.21334000  0.53164900  1.0
  O  O8  1  0.77876400  0.77801300  0.02428700  1.0
  O  O9  1  0.27859900  0.72202500  0.97593600  1.0
  O  O10  1  0.27930600  0.72192300  0.52404300  1.0
  O  O11  1  0.77941900  0.77818700  0.47570500  1.0
  O  O12  1  0.21355600  0.21333700  0.96875400  1.0
  O  O13  1  0.71337200  0.28700700  0.03117400  1.0
  O  O14  1  0.06284800  0.49038400  0.25000200  1.0
  O  O15  1  0.56323000  0.00901400  0.74995400  1.0
  O  O16  1  0.45325000  0.99278000  0.25010900  1.0
  O  O17  1  0.95312500  0.50770300  0.74992800  1.0