# generated using pymatgen
data_Sr2TcNiN4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.76258431
_cell_length_b   6.21615996
_cell_length_c   7.28901231
_cell_angle_alpha   68.68826740
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2TcNiN4
_chemical_formula_sum   'Sr4 Tc2 Ni2 N8'
_cell_volume   243.24587290
_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
  Sr  Sr0  1  0.25000000  0.26659194  0.05653819  1.0
  Sr  Sr1  1  0.75000000  0.73340806  0.94346181  1.0
  Sr  Sr2  1  0.75000000  0.82756647  0.41389145  1.0
  Sr  Sr3  1  0.25000000  0.17243353  0.58610855  1.0
  Tc  Tc4  1  0.25000000  0.70584216  0.20895024  1.0
  Tc  Tc5  1  0.75000000  0.29415784  0.79104976  1.0
  Ni  Ni6  1  0.75000000  0.34707595  0.38428765  1.0
  Ni  Ni7  1  0.25000000  0.65292405  0.61571235  1.0
  N  N8  1  0.50144558  0.48536183  0.74375708  1.0
  N  N9  1  0.00144558  0.51463817  0.25624292  1.0
  N  N10  1  0.49855442  0.51463817  0.25624292  1.0
  N  N11  1  0.99855442  0.48536183  0.74375708  1.0
  N  N12  1  0.75000000  0.11256614  0.62836237  1.0
  N  N13  1  0.25000000  0.88743386  0.37163763  1.0
  N  N14  1  0.75000000  0.10510804  0.04157545  1.0
  N  N15  1  0.25000000  0.89489196  0.95842455  1.0