# generated using pymatgen
data_CaMoN3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.70404950
_cell_length_b   6.37960039
_cell_length_c   6.40404755
_cell_angle_alpha   104.09362332
_cell_angle_beta   106.80982293
_cell_angle_gamma   90.00000429
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaMoN3
_chemical_formula_sum   'Ca2 Mo2 N6'
_cell_volume   140.09832930
_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  0.62316312  0.33104291  0.24632524  1.0
  Ca  Ca1  1  0.37683688  0.66895709  0.75367476  1.0
  Mo  Mo2  1  0.84918986  0.14134761  0.69837872  1.0
  Mo  Mo3  1  0.15081014  0.85865239  0.30162128  1.0
  N  N4  1  0.32180256  0.01503854  0.64360513  1.0
  N  N5  1  0.15624540  0.58596364  0.31249281  1.0
  N  N6  1  0.99698041  0.89086545  0.99396181  1.0
  N  N7  1  0.00301959  0.10913455  0.00603819  1.0
  N  N8  1  0.67819744  0.98496146  0.35639487  1.0
  N  N9  1  0.84375460  0.41403636  0.68750719  1.0