# AFLOW.org Repositories
# Ru_pvMg_pv.76                           
data_Ru_pvMg_pv.76
_pd_phase_name Ru_pvMg_pv.76
_cell_length_a  3.3465546928
_cell_length_b  3.3465546928
_cell_length_c  6.5260155677
_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
/fslhome/glh43/src/potpaw_PBE/Mg_pv/POTCAR1 1.0000000000 0.0000000000 0.0000000000 0.5000000000  Biso 1.0 /fslhome/glh43/src/potpaw_PBE/Mg_pv/POTCAR
/fslhome/glh43/src/potpaw_PBE/Mg_pv/POTCAR2 1.0000000000 0.5000000000 0.5000000000 0.2092879908  Biso 1.0 /fslhome/glh43/src/potpaw_PBE/Mg_pv/POTCAR
/fslhome/glh43/src/potpaw_PBE/Mg_pv/POTCAR3 1.0000000000 0.5000000000 0.5000000000 0.7907120092  Biso 1.0 /fslhome/glh43/src/potpaw_PBE/Mg_pv/POTCAR
/fslhome/glh43/src/potpaw_PBE/Ru_pv/POTCAR4 1.0000000000 0.0000000000 0.0000000000 0.0000000000  Biso 1.0 /fslhome/glh43/src/potpaw_PBE/Ru_pv/POTCAR
