# generated using pymatgen
data_Ca5(SiO3)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.72030700
_cell_length_b   6.72159401
_cell_length_c   9.61895075
_cell_angle_alpha   92.97453217
_cell_angle_beta   98.50274368
_cell_angle_gamma   113.30042434
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca5(SiO3)6
_chemical_formula_sum   'Ca5 Si6 O18'
_cell_volume   391.75218735
_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
  Ca  Ca0  1  0.53126400  0.27542000  0.11022200  1.0
  Ca  Ca1  1  0.46934400  0.72505300  0.89090200  1.0
  Ca  Ca2  1  0.04521300  0.04428100  0.49908500  1.0
  Ca  Ca3  1  0.03695000  0.76616600  0.11472600  1.0
  Ca  Ca4  1  0.96257800  0.23374700  0.88396200  1.0
  Si  Si5  1  0.69992200  0.34122000  0.56485100  1.0
  Si  Si6  1  0.30031700  0.65903800  0.43536900  1.0
  Si  Si7  1  0.96833200  0.74548900  0.78327400  1.0
  Si  Si8  1  0.02975600  0.25533300  0.21460500  1.0
  Si  Si9  1  0.39829700  0.17059900  0.77859900  1.0
  Si  Si10  1  0.60354300  0.82845600  0.22345000  1.0
  O  O11  1  0.85402800  0.21267000  0.61049600  1.0
  O  O12  1  0.14719100  0.78831100  0.38896300  1.0
  O  O13  1  0.57450200  0.10460700  0.87337000  1.0
  O  O14  1  0.42866500  0.89696500  0.12758100  1.0
  O  O15  1  0.34764800  0.34942600  0.86900700  1.0
  O  O16  1  0.65280800  0.65046300  0.13094700  1.0
  O  O17  1  0.83959700  0.84374100  0.87707900  1.0
  O  O18  1  0.16137600  0.15764400  0.12337900  1.0
  O  O19  1  0.35293400  0.67421200  0.60867100  1.0
  O  O20  1  0.64555700  0.32365200  0.39059100  1.0
  O  O21  1  0.45772000  0.23778000  0.62068600  1.0
  O  O22  1  0.53635600  0.75706500  0.37729400  1.0
  O  O23  1  0.81487300  0.59939000  0.63333800  1.0
  O  O24  1  0.17990800  0.39456100  0.36917800  1.0
  O  O25  1  0.15335600  0.95909600  0.72297700  1.0
  O  O26  1  0.84771200  0.04191800  0.27660600  1.0
  O  O27  1  0.08619800  0.61946600  0.88016000  1.0
  O  O28  1  0.91505300  0.38323200  0.11862900  1.0