# generated using pymatgen
data_Mn3AlO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.99795722
_cell_length_b   5.99795722
_cell_length_c   14.78064290
_cell_angle_alpha   88.44642136
_cell_angle_beta   88.44642136
_cell_angle_gamma   59.12791656
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn3AlO6
_chemical_formula_sum   'Mn12 Al4 O24'
_cell_volume   456.17942170
_cell_formula_units_Z   4
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
  Mn  Mn0  1  0.84046600  0.32834200  0.66454000  1.0
  Mn  Mn1  1  0.15953400  0.67165800  0.33546000  1.0
  Mn  Mn2  1  0.50000000  0.00000000  0.00000000  1.0
  Mn  Mn3  1  0.33091300  0.33091300  0.66736800  1.0
  Mn  Mn4  1  0.66908700  0.66908700  0.33263200  1.0
  Mn  Mn5  1  0.00000000  0.00000000  0.00000000  1.0
  Mn  Mn6  1  0.50000000  0.50000000  0.50000000  1.0
  Mn  Mn7  1  0.83589000  0.83589000  0.17296100  1.0
  Mn  Mn8  1  0.16411000  0.16411000  0.82703900  1.0
  Mn  Mn9  1  0.32834200  0.84046600  0.66454000  1.0
  Mn  Mn10  1  0.67165800  0.15953400  0.33546000  1.0
  Mn  Mn11  1  0.00000000  0.50000000  0.00000000  1.0
  Al  Al12  1  0.16568600  0.16568600  0.44576900  1.0
  Al  Al13  1  0.49814000  0.49814000  0.13070200  1.0
  Al  Al14  1  0.83431400  0.83431400  0.55423100  1.0
  Al  Al15  1  0.50186000  0.50186000  0.86929800  1.0
  O  O16  1  0.16582100  0.16582100  0.56670900  1.0
  O  O17  1  0.50092600  0.50092600  0.25103800  1.0
  O  O18  1  0.83747100  0.83747100  0.94415200  1.0
  O  O19  1  0.66356100  0.17164100  0.59241100  1.0
  O  O20  1  0.98054600  0.54787200  0.26052000  1.0
  O  O21  1  0.32919300  0.83965200  0.90874000  1.0
  O  O22  1  0.17164100  0.66356100  0.59241100  1.0
  O  O23  1  0.54787200  0.98054600  0.26052000  1.0
  O  O24  1  0.83965200  0.32919300  0.90874000  1.0
  O  O25  1  0.66531300  0.66531300  0.59305600  1.0
  O  O26  1  0.98333800  0.98333800  0.26720400  1.0
  O  O27  1  0.33670800  0.33670800  0.91809000  1.0
  O  O28  1  0.33643900  0.82835900  0.40758900  1.0
  O  O29  1  0.67080700  0.16034800  0.09126000  1.0
  O  O30  1  0.01945400  0.45212800  0.73948000  1.0
  O  O31  1  0.83417900  0.83417900  0.43329100  1.0
  O  O32  1  0.16252900  0.16252900  0.05584800  1.0
  O  O33  1  0.49907400  0.49907400  0.74896200  1.0
  O  O34  1  0.82835900  0.33643900  0.40758900  1.0
  O  O35  1  0.16034800  0.67080700  0.09126000  1.0
  O  O36  1  0.45212800  0.01945400  0.73948000  1.0
  O  O37  1  0.33468700  0.33468700  0.40694400  1.0
  O  O38  1  0.66329200  0.66329200  0.08191000  1.0
  O  O39  1  0.01666200  0.01666200  0.73279600  1.0