(Si)8 (Fd-3m) ~ Si (CPU*4) 1.00000000000000 0.0000000000000000 2.7347178454758949 2.7347178454758949 2.7347178454758949 -0.0000000000000000 2.7347178454758949 2.7347178454758949 2.7347178454758949 0.0000000000000000 Si 2 Direct 0.3750000000000000 0.3750000000000000 0.3750000000000000 0.6250000000000000 0.6250000000000000 0.6250000000000000 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00