# generated using pymatgen
data_Ca2SmUO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.81104584
_cell_length_b   6.80449307
_cell_length_c   6.78357843
_cell_angle_alpha   91.66238614
_cell_angle_beta   91.41280416
_cell_angle_gamma   91.23282636
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2SmUO6
_chemical_formula_sum   'Ca4 Sm2 U2 O12'
_cell_volume   314.08418352
_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  0.55234950  0.25089549  0.05921765  1.0
  Ca  Ca1  1  0.25298454  0.05941328  0.55802366  1.0
  Ca  Ca2  1  0.06410176  0.55645261  0.24986844  1.0
  Ca  Ca3  1  0.44470189  0.74999880  0.94105551  1.0
  Sm  Sm4  1  0.93840517  0.44283893  0.74937541  1.0
  Sm  Sm5  1  0.74817122  0.93888229  0.44091821  1.0
  U  U6  1  0.00208536  0.99921047  0.00137724  1.0
  U  U7  1  0.49535072  0.49884909  0.49847609  1.0
  O  O8  1  0.29330662  0.06384576  0.92264228  1.0
  O  O9  1  0.06265968  0.92000282  0.30187849  1.0
  O  O10  1  0.92301229  0.29956405  0.06178901  1.0
  O  O11  1  0.70522307  0.93545034  0.08665890  1.0
  O  O12  1  0.92969039  0.08610802  0.69582379  1.0
  O  O13  1  0.07713351  0.69691669  0.92995000  1.0
  O  O14  1  0.19482529  0.40721298  0.54006014  1.0
  O  O15  1  0.41136681  0.54104297  0.20294021  1.0
  O  O16  1  0.46743527  0.80226364  0.58985704  1.0
  O  O17  1  0.59445443  0.45871099  0.79602976  1.0
  O  O18  1  0.80226538  0.59457013  0.46525201  1.0
  O  O19  1  0.54047511  0.19777264  0.40880317  1.0