# AFLOW.org Repositories
# NO_RECURSION  [MCL,MCL,mP12] (STD_CONV doi:10.1016/j.commatsci.2010.05.010)
data_NO_RECURSION
_pd_phase_name NO_RECURSION
_cell_length_a  3.3420843621
_cell_length_b  13.2846790660
_cell_length_c  6.6995371402
_cell_angle_alpha  75.1335865830
_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/Fe_pv1 1.0000000000 0.0000000000 0.3612622006 0.7773406535  Biso 1.0 potpaw_PBE/Fe_pv
potpaw_PBE/Fe_pv2 1.0000000000 0.5000000000 0.8612622006 0.7773406535  Biso 1.0 potpaw_PBE/Fe_pv
potpaw_PBE/Fe_pv3 1.0000000000 -0.0000000000 0.3609600216 0.2782149020  Biso 1.0 potpaw_PBE/Fe_pv
potpaw_PBE/Fe_pv4 1.0000000000 0.5000000000 0.8609600216 0.2782149020  Biso 1.0 potpaw_PBE/Fe_pv
potpaw_PBE/Y_sv5 1.0000000000 0.5000000000 0.4871393334 0.9635092330  Biso 1.0 potpaw_PBE/Y_sv
potpaw_PBE/Y_sv6 1.0000000000 0.0000000000 0.9871393334 0.9635092330  Biso 1.0 potpaw_PBE/Y_sv
potpaw_PBE/Y_sv7 1.0000000000 0.5000000000 0.2354208908 0.5913131748  Biso 1.0 potpaw_PBE/Y_sv
potpaw_PBE/Y_sv8 1.0000000000 0.0000000000 0.7354208908 0.5913131748  Biso 1.0 potpaw_PBE/Y_sv
potpaw_PBE/Y_sv9 1.0000000000 0.5000000000 0.4868013314 0.4642423808  Biso 1.0 potpaw_PBE/Y_sv
potpaw_PBE/Y_sv10 1.0000000000 0.0000000000 0.9868013314 0.4642423808  Biso 1.0 potpaw_PBE/Y_sv
potpaw_PBE/Y_sv11 1.0000000000 0.5000000000 0.2350828888 0.0920463225  Biso 1.0 potpaw_PBE/Y_sv
potpaw_PBE/Y_sv12 1.0000000000 -0.0000000000 0.7350828888 0.0920463225  Biso 1.0 potpaw_PBE/Y_sv
