2 2 1 0
0.1988742E+02 0.3831550E-09 0.3831550E-09 0.3831550E-09 0.5000000E-15
1.000000000000000E-004
CAR
(Si)8 (Fd-3m) ~ Si (GPU)
16.22134885 -8.18438150 301 5.82277484 1.00000000
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