# generated using pymatgen
data_CaYb7(Si4Mo3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.69739334
_cell_length_b   6.90229192
_cell_length_c   12.99824804
_cell_angle_alpha   90.00910350
_cell_angle_beta   89.98444102
_cell_angle_gamma   90.00600509
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaYb7(Si4Mo3)4
_chemical_formula_sum   'Ca1 Yb7 Si16 Mo12'
_cell_volume   600.87470880
_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  0.99889482  0.16643135  0.09130164  1.0
  Yb  Yb1  1  0.49891893  0.33404774  0.09142636  1.0
  Yb  Yb2  1  0.99902986  0.16635115  0.40874774  1.0
  Yb  Yb3  1  0.50091305  0.66633250  0.59127226  1.0
  Yb  Yb4  1  0.00091937  0.83294602  0.90783656  1.0
  Yb  Yb5  1  0.50125373  0.66610073  0.90837445  1.0
  Yb  Yb6  1  0.00103799  0.83362326  0.59134725  1.0
  Yb  Yb7  1  0.49917586  0.33371468  0.40894171  1.0
  Si  Si8  1  0.65728597  0.04348571  0.54498666  1.0
  Si  Si9  1  0.15727626  0.45703357  0.95447354  1.0
  Si  Si10  1  0.34359707  0.95552700  0.04481524  1.0
  Si  Si11  1  0.84287894  0.54346918  0.45507085  1.0
  Si  Si12  1  0.34288541  0.95653575  0.45515084  1.0
  Si  Si13  1  0.84267349  0.54478940  0.04476809  1.0
  Si  Si14  1  0.65675284  0.04347603  0.95451638  1.0
  Si  Si15  1  0.15721519  0.45642522  0.54498245  1.0
  Si  Si16  1  0.53600125  0.37522607  0.74981097  1.0
  Si  Si17  1  0.03611365  0.12485707  0.74988414  1.0
  Si  Si18  1  0.46401633  0.62455378  0.25037624  1.0
  Si  Si19  1  0.96374202  0.87466765  0.25054101  1.0
  Si  Si20  1  0.80065950  0.62810013  0.74964511  1.0
  Si  Si21  1  0.30098592  0.87176326  0.74983069  1.0
  Si  Si22  1  0.19971729  0.37248334  0.25068759  1.0
  Si  Si23  1  0.69842639  0.12805813  0.25051021  1.0
  Mo  Mo24  1  0.83710544  0.32943009  0.62810785  1.0
  Mo  Mo25  1  0.33723525  0.17038949  0.87150182  1.0
  Mo  Mo26  1  0.16305464  0.67051765  0.12843524  1.0
  Mo  Mo27  1  0.66302320  0.82953964  0.37208022  1.0
  Mo  Mo28  1  0.16313183  0.67060928  0.37214062  1.0
  Mo  Mo29  1  0.66208356  0.82900935  0.12849507  1.0
  Mo  Mo30  1  0.83676355  0.33005372  0.87132656  1.0
  Mo  Mo31  1  0.33712316  0.17047091  0.62815628  1.0
  Mo  Mo32  1  0.66164407  0.01079266  0.74984913  1.0
  Mo  Mo33  1  0.16166052  0.48921028  0.74978905  1.0
  Mo  Mo34  1  0.33853652  0.98880261  0.25035258  1.0
  Mo  Mo35  1  0.83826414  0.51117662  0.25047064  1.0