# generated using pymatgen
data_CaZr7(Si4Mo3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.60876395
_cell_length_b   6.77606635
_cell_length_c   12.65710055
_cell_angle_alpha   90.11682259
_cell_angle_beta   90.00730330
_cell_angle_gamma   90.05915378
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaZr7(Si4Mo3)4
_chemical_formula_sum   'Ca1 Zr7 Si16 Mo12'
_cell_volume   566.80148956
_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  0.99733154  0.16472806  0.08930812  1.0
  Zr  Zr1  1  0.50116345  0.33059751  0.09411613  1.0
  Zr  Zr2  1  0.99606628  0.16996362  0.40732132  1.0
  Zr  Zr3  1  0.50434924  0.67063751  0.59421911  1.0
  Zr  Zr4  1  0.00439288  0.82613996  0.90110225  1.0
  Zr  Zr5  1  0.50494239  0.66911198  0.90424445  1.0
  Zr  Zr6  1  0.00436794  0.83150877  0.59502054  1.0
  Zr  Zr7  1  0.49488523  0.33127281  0.40806753  1.0
  Si  Si8  1  0.66456731  0.04178885  0.54341942  1.0
  Si  Si9  1  0.16555321  0.46185792  0.95468944  1.0
  Si  Si10  1  0.34072827  0.95735574  0.04220428  1.0
  Si  Si11  1  0.83507559  0.54180262  0.45835203  1.0
  Si  Si12  1  0.33399726  0.95859989  0.45802210  1.0
  Si  Si13  1  0.83677627  0.54306839  0.04279419  1.0
  Si  Si14  1  0.66248580  0.03931271  0.95454172  1.0
  Si  Si15  1  0.16459976  0.45869432  0.54412278  1.0
  Si  Si16  1  0.53259848  0.37567232  0.74910408  1.0
  Si  Si17  1  0.03351880  0.12703128  0.75146182  1.0
  Si  Si18  1  0.46513677  0.62592236  0.25097621  1.0
  Si  Si19  1  0.96522511  0.87114266  0.25205784  1.0
  Si  Si20  1  0.79627722  0.63351783  0.74860374  1.0
  Si  Si21  1  0.29858201  0.86753901  0.74902156  1.0
  Si  Si22  1  0.20084097  0.36425526  0.25020656  1.0
  Si  Si23  1  0.69985449  0.13488825  0.25061936  1.0
  Mo  Mo24  1  0.83153769  0.33396298  0.62323082  1.0
  Mo  Mo25  1  0.33373484  0.16568154  0.87522080  1.0
  Mo  Mo26  1  0.16941529  0.66767690  0.12387402  1.0
  Mo  Mo27  1  0.66689469  0.83457825  0.37780171  1.0
  Mo  Mo28  1  0.16997560  0.66304879  0.37808994  1.0
  Mo  Mo29  1  0.66498651  0.82940496  0.12408376  1.0
  Mo  Mo30  1  0.82728432  0.33842756  0.87461374  1.0
  Mo  Mo31  1  0.33071257  0.16659394  0.62313234  1.0
  Mo  Mo32  1  0.66707424  0.98817488  0.74930446  1.0
  Mo  Mo33  1  0.16569000  0.51488767  0.75077104  1.0
  Mo  Mo34  1  0.33579035  0.00770889  0.25293827  1.0
  Mo  Mo35  1  0.83358962  0.49344201  0.25334251  1.0