# Supplementary Material (ESI) for Physical Chemistry Chemical Physics # This journal is (c) The Owner Societies 2010 #====================================================================== # CRYSTAL DATA #---------------------------------------------------------------------- _chemical_formula_structural 'Ge N' _cell_length_a 3.02814 _cell_length_b 4.89276 _cell_length_c 7.45914 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _symmetry_space_group_name_H-M 'P m n n' _symmetry_Int_Tables_number 58 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 GE1 Ge 1.0 0.50000 0.55240 0.34350 Biso 1.000 N1 N 1.0 0.50000 0.23814 0.21088 Biso 1.000