# AFLOW.org Repositories
# NO_RECURSION  [ORCC,ORCC,oS12] (STD_PRIM doi:10.1016/j.commatsci.2010.05.010)
data_NO_RECURSION
_pd_phase_name NO_RECURSION
_cell_length_a  6.1169321554
_cell_length_b  6.1169321554
_cell_length_c  3.8603536011
_cell_angle_alpha  90.0000000000
_cell_angle_beta  90.0000000000
_cell_angle_gamma  143.1335439332
_symmetry_space_group_name_H-M  'P1'
_symmetry_Int_Tables_Number  1
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
  1  x,y,z
loop_
 _atom_site_label
 _atom_site_occupancy
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_thermal_displace_type
 _atom_site_B_iso_or_equiv
 _atom_site_type_symbol
potpaw_PBE/Ir1 1.0000000000 0.5801710649 0.4198289351 0.7500000000  Biso 1.0 potpaw_PBE/Ir
potpaw_PBE/Ir2 1.0000000000 0.4198289351 0.5801710649 0.2500000000  Biso 1.0 potpaw_PBE/Ir
potpaw_PBE/Ir3 1.0000000000 0.2529653328 0.7470346672 0.7500000000  Biso 1.0 potpaw_PBE/Ir
potpaw_PBE/Ir4 1.0000000000 0.7470346672 0.2529653328 0.2500000000  Biso 1.0 potpaw_PBE/Ir
potpaw_PBE/Os_pv5 1.0000000000 0.9178295683 0.0821704317 0.7500000000  Biso 1.0 potpaw_PBE/Os_pv
potpaw_PBE/Os_pv6 1.0000000000 0.0821704317 0.9178295683 0.2500000000  Biso 1.0 potpaw_PBE/Os_pv
