# generated using pymatgen
data_Ca3Mo2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.23751597
_cell_length_b   10.23751597
_cell_length_c   5.60198464
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   148.91987803
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3Mo2O7
_chemical_formula_sum   'Ca6 Mo4 O14'
_cell_volume   303.09556107
_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  0.24170463  0.24170463  0.29871632  1.0
  Ca  Ca1  1  0.75829537  0.75829537  0.79871632  1.0
  Ca  Ca2  1  0.04904542  0.42874967  0.20165120  1.0
  Ca  Ca3  1  0.95095458  0.57125033  0.70165120  1.0
  Ca  Ca4  1  0.42874967  0.04904542  0.20165120  1.0
  Ca  Ca5  1  0.57125033  0.95095458  0.70165120  1.0
  Mo  Mo6  1  0.84750103  0.64784060  0.24986862  1.0
  Mo  Mo7  1  0.15249897  0.35215940  0.74986862  1.0
  Mo  Mo8  1  0.35215940  0.15249897  0.74986862  1.0
  Mo  Mo9  1  0.64784060  0.84750103  0.24986862  1.0
  O  O10  1  0.62632384  0.02610196  0.27978854  1.0
  O  O11  1  0.37367616  0.97389804  0.77978854  1.0
  O  O12  1  0.97389804  0.37367616  0.77978854  1.0
  O  O13  1  0.02610196  0.62632384  0.27978854  1.0
  O  O14  1  0.42882261  0.66280628  0.95528423  1.0
  O  O15  1  0.57117739  0.33719372  0.45528423  1.0
  O  O16  1  0.33719372  0.57117739  0.45528423  1.0
  O  O17  1  0.66280628  0.42882261  0.95528423  1.0
  O  O18  1  0.96511729  0.12814884  0.04712190  1.0
  O  O19  1  0.03488271  0.87185116  0.54712190  1.0
  O  O20  1  0.65752667  0.65752667  0.21384970  1.0
  O  O21  1  0.34247333  0.34247333  0.71384970  1.0
  O  O22  1  0.12814884  0.96511729  0.04712190  1.0
  O  O23  1  0.87185116  0.03488271  0.54712190  1.0