# AFLOW.org Repositories
# NO_RECURSION  [ORC,ORC,oP12] (STD_CONV doi:10.1016/j.commatsci.2010.05.010) with_corners
data_NO_RECURSION
_pd_phase_name NO_RECURSION
_cell_length_a  3.8683390090
_cell_length_b  11.6061789271
_cell_length_c  3.8603536011
_cell_angle_alpha  90.0000000000
_cell_angle_beta  90.0000000000
_cell_angle_gamma  90.0000000000
_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 0.0000000000 0.4198289351 0.7500000000  Biso 1.0 potpaw_PBE/Ir
potpaw_PBE/Ir2 1.0000000000 0.9900000000 0.4198289351 0.7500000000  Biso 1.0 potpaw_PBE/Ir
potpaw_PBE/Ir3 1.0000000000 0.5000000000 0.9198289351 0.7500000000  Biso 1.0 potpaw_PBE/Ir
potpaw_PBE/Ir4 1.0000000000 0.0000000000 0.5801710649 0.2500000000  Biso 1.0 potpaw_PBE/Ir
potpaw_PBE/Ir5 1.0000000000 0.9900000000 0.5801710649 0.2500000000  Biso 1.0 potpaw_PBE/Ir
potpaw_PBE/Ir6 1.0000000000 0.5000000000 0.0801710649 0.2500000000  Biso 1.0 potpaw_PBE/Ir
potpaw_PBE/Ir7 1.0000000000 0.0000000000 0.7470346672 0.7500000000  Biso 1.0 potpaw_PBE/Ir
potpaw_PBE/Ir8 1.0000000000 0.9900000000 0.7470346672 0.7500000000  Biso 1.0 potpaw_PBE/Ir
potpaw_PBE/Ir9 1.0000000000 0.5000000000 0.2470346672 0.7500000000  Biso 1.0 potpaw_PBE/Ir
potpaw_PBE/Ir10 1.0000000000 0.0000000000 0.2529653328 0.2500000000  Biso 1.0 potpaw_PBE/Ir
potpaw_PBE/Ir11 1.0000000000 0.9900000000 0.2529653328 0.2500000000  Biso 1.0 potpaw_PBE/Ir
potpaw_PBE/Ir12 1.0000000000 0.5000000000 0.7529653328 0.2500000000  Biso 1.0 potpaw_PBE/Ir
potpaw_PBE/Os_pv13 1.0000000000 0.0000000000 0.0821704317 0.7500000000  Biso 1.0 potpaw_PBE/Os_pv
potpaw_PBE/Os_pv14 1.0000000000 0.9900000000 0.0821704317 0.7500000000  Biso 1.0 potpaw_PBE/Os_pv
potpaw_PBE/Os_pv15 1.0000000000 0.5000000000 0.5821704317 0.7500000000  Biso 1.0 potpaw_PBE/Os_pv
potpaw_PBE/Os_pv16 1.0000000000 -0.0000000000 0.9178295683 0.2500000000  Biso 1.0 potpaw_PBE/Os_pv
potpaw_PBE/Os_pv17 1.0000000000 0.9900000000 0.9178295683 0.2500000000  Biso 1.0 potpaw_PBE/Os_pv
potpaw_PBE/Os_pv18 1.0000000000 0.5000000000 0.4178295683 0.2500000000  Biso 1.0 potpaw_PBE/Os_pv
