# generated using pymatgen
data_Ca3W3N5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.72493500
_cell_length_b   8.21147366
_cell_length_c   8.29533901
_cell_angle_alpha   109.80888292
_cell_angle_beta   102.77606134
_cell_angle_gamma   103.55682145
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3W3N5
_chemical_formula_sum   'Ca6 W6 N10'
_cell_volume   336.85693452
_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  0.79462600  0.44461900  0.62108700  1.0
  Ca  Ca1  1  0.20537400  0.55538100  0.37891300  1.0
  Ca  Ca2  1  0.65081500  0.87473900  0.88956800  1.0
  Ca  Ca3  1  0.34918500  0.12526100  0.11043200  1.0
  Ca  Ca4  1  0.67009500  0.67769600  0.21103700  1.0
  Ca  Ca5  1  0.32990500  0.32230400  0.78896300  1.0
  W  W6  1  0.89149800  0.30730800  0.96266700  1.0
  W  W7  1  0.10850200  0.69269200  0.03733300  1.0
  W  W8  1  0.74017300  0.05499800  0.62804300  1.0
  W  W9  1  0.25982700  0.94500200  0.37195700  1.0
  W  W10  1  0.05663100  0.86422900  0.65128100  1.0
  W  W11  1  0.94336900  0.13577100  0.34871900  1.0
  N  N12  1  0.03675800  0.08770700  0.84797100  1.0
  N  N13  1  0.96324200  0.91229300  0.15202900  1.0
  N  N14  1  0.81524000  0.64070200  0.48323500  1.0
  N  N15  1  0.18476000  0.35929800  0.51676500  1.0
  N  N16  1  0.74892100  0.50610500  0.93251000  1.0
  N  N17  1  0.25107900  0.49389500  0.06749000  1.0
  N  N18  1  0.39577800  0.89586300  0.60025500  1.0
  N  N19  1  0.60422100  0.10413700  0.39974500  1.0
  N  N20  1  0.18753800  0.78180300  0.86316200  1.0
  N  N21  1  0.81246200  0.21819700  0.13683800  1.0