# generated using pymatgen
data_Ca8Mn3N8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.25076180
_cell_length_b   5.00098366
_cell_length_c   7.14986721
_cell_angle_alpha   90.00000675
_cell_angle_beta   74.63756717
_cell_angle_gamma   74.31780162
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca8Mn3N8
_chemical_formula_sum   'Ca8 Mn3 N8'
_cell_volume   306.16715336
_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  0.05574500  0.97212800  0.74004900  1.0
  Ca  Ca1  1  0.94425500  0.02787200  0.25995100  1.0
  Ca  Ca2  1  0.66567500  0.66716200  0.47286000  1.0
  Ca  Ca3  1  0.33432500  0.33283800  0.52714000  1.0
  Ca  Ca4  1  0.80428500  0.59785800  0.95762100  1.0
  Ca  Ca5  1  0.19571500  0.40214200  0.04237900  1.0
  Ca  Ca6  1  0.39774800  0.80112600  0.19515900  1.0
  Ca  Ca7  1  0.60225200  0.19887400  0.80484100  1.0
  Mn  Mn8  1  0.00000000  0.50000000  0.50000000  1.0
  Mn  Mn9  1  0.37346700  0.81326600  0.79461200  1.0
  Mn  Mn10  1  0.62653300  0.18673400  0.20538800  1.0
  N  N11  1  0.20422500  0.89788700  0.99716500  1.0
  N  N12  1  0.79577500  0.10211300  0.00283500  1.0
  N  N13  1  0.35239400  0.82380300  0.56091600  1.0
  N  N14  1  0.64760600  0.17619700  0.43908400  1.0
  N  N15  1  0.56109000  0.71945500  0.82885800  1.0
  N  N16  1  0.43891000  0.28054500  0.17114200  1.0
  N  N17  1  0.94716100  0.52641900  0.28407800  1.0
  N  N18  1  0.05283900  0.47358100  0.71592200  1.0