# generated using pymatgen
data_CaMn7O12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.63604202
_cell_length_b   7.43215312
_cell_length_c   7.43609379
_cell_angle_alpha   90.17018372
_cell_angle_beta   90.08935948
_cell_angle_gamma   89.87507836
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaMn7O12
_chemical_formula_sum   'Ca2 Mn14 O24'
_cell_volume   422.01155770
_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  0.99978400  0.99869700  0.00298300  1.0
  Ca  Ca1  1  0.50070800  0.50160300  0.49638700  1.0
  Mn  Mn2  1  0.99859700  0.49937300  0.50600200  1.0
  Mn  Mn3  1  0.49798800  0.99899800  0.49634300  1.0
  Mn  Mn4  1  0.49912300  0.49876600  0.00155700  1.0
  Mn  Mn5  1  0.75068300  0.75016200  0.75008600  1.0
  Mn  Mn6  1  0.74988800  0.24945200  0.24956500  1.0
  Mn  Mn7  1  0.25041000  0.75025000  0.24982000  1.0
  Mn  Mn8  1  0.24935500  0.25019600  0.75013400  1.0
  Mn  Mn9  1  0.50118000  0.00054100  0.99079400  1.0
  Mn  Mn10  1  0.00170500  0.50112200  0.00429500  1.0
  Mn  Mn11  1  0.00122800  0.00177000  0.49910300  1.0
  Mn  Mn12  1  0.25084400  0.24957700  0.24988100  1.0
  Mn  Mn13  1  0.25016300  0.74979700  0.75005500  1.0
  Mn  Mn14  1  0.74969300  0.25005800  0.75012500  1.0
  Mn  Mn15  1  0.74960200  0.75073600  0.24993100  1.0
  O  O16  1  0.98394000  0.69053100  0.82508400  1.0
  O  O17  1  0.51707300  0.18222300  0.31486100  1.0
  O  O18  1  0.51509100  0.81088200  0.67626500  1.0
  O  O19  1  0.98234000  0.31678900  0.18476200  1.0
  O  O20  1  0.48367400  0.19342300  0.67033700  1.0
  O  O21  1  0.01697100  0.69267900  0.17839300  1.0
  O  O22  1  0.01701000  0.30656100  0.82991600  1.0
  O  O23  1  0.48362800  0.80692300  0.32289600  1.0
  O  O24  1  0.17587900  0.98603800  0.31158100  1.0
  O  O25  1  0.67690400  0.50202100  0.80842800  1.0
  O  O26  1  0.32442000  0.51359200  0.18845300  1.0
  O  O27  1  0.82328300  0.99833300  0.69241100  1.0
  O  O28  1  0.32305300  0.49897100  0.80619200  1.0
  O  O29  1  0.83120300  0.01511300  0.30659400  1.0
  O  O30  1  0.17694300  0.00079800  0.69484100  1.0
  O  O31  1  0.66904600  0.48503900  0.19317300  1.0
  O  O32  1  0.69490900  0.17710600  0.99966000  1.0
  O  O33  1  0.19158300  0.67532800  0.49835500  1.0
  O  O34  1  0.80559200  0.32287700  0.49981200  1.0
  O  O35  1  0.30762600  0.82438000  0.00198600  1.0
  O  O36  1  0.17959300  0.31782600  0.51484700  1.0
  O  O37  1  0.68523100  0.82130700  0.98556500  1.0
  O  O38  1  0.31870300  0.18117200  0.98443300  1.0
  O  O39  1  0.81535200  0.67899000  0.51409200  1.0