# generated using pymatgen
data_CaMgSiO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.86888300
_cell_length_b   6.43127100
_cell_length_c   11.22358900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaMgSiO4
_chemical_formula_sum   'Ca4 Mg4 Si4 O16'
_cell_volume   351.44543251
_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
  Ca  Ca0  1  0.02084300  0.75000000  0.27706800  1.0
  Ca  Ca1  1  0.97915700  0.25000000  0.72293200  1.0
  Ca  Ca2  1  0.47915700  0.75000000  0.77706800  1.0
  Ca  Ca3  1  0.52084300  0.25000000  0.22293200  1.0
  Mg  Mg4  1  0.00000000  0.00000000  0.00000000  1.0
  Mg  Mg5  1  0.00000000  0.50000000  0.00000000  1.0
  Mg  Mg6  1  0.50000000  0.00000000  0.50000000  1.0
  Mg  Mg7  1  0.50000000  0.50000000  0.50000000  1.0
  Si  Si8  1  0.08932100  0.25000000  0.41878900  1.0
  Si  Si9  1  0.41067900  0.25000000  0.91878900  1.0
  Si  Si10  1  0.91067900  0.75000000  0.58121100  1.0
  Si  Si11  1  0.58932100  0.75000000  0.08121100  1.0
  O  O12  1  0.22796900  0.45530700  0.35264800  1.0
  O  O13  1  0.72796900  0.54469300  0.14735200  1.0
  O  O14  1  0.77203100  0.95530700  0.64735200  1.0
  O  O15  1  0.27203100  0.04469300  0.85264800  1.0
  O  O16  1  0.77203100  0.54469300  0.64735200  1.0
  O  O17  1  0.27203100  0.45530700  0.85264800  1.0
  O  O18  1  0.22796900  0.04469300  0.35264800  1.0
  O  O19  1  0.72796900  0.95530700  0.14735200  1.0
  O  O20  1  0.74765800  0.75000000  0.94876000  1.0
  O  O21  1  0.24765800  0.25000000  0.55124000  1.0
  O  O22  1  0.25234200  0.25000000  0.05124000  1.0
  O  O23  1  0.75234200  0.75000000  0.44876000  1.0
  O  O24  1  0.25370500  0.75000000  0.07762600  1.0
  O  O25  1  0.75370500  0.25000000  0.42237400  1.0
  O  O26  1  0.74629500  0.25000000  0.92237400  1.0
  O  O27  1  0.24629500  0.75000000  0.57762600  1.0