4
Lattice="1.231556 -2.133117 0.0 -2.463112 0.0 0.0 1.231556 -0.711039 -11.119419" Properties=species:S:1:pos:R:3:forces:R:3 energy=-36.87796743252077 stress="-0.005908852753856876 -5.706655653629978e-07 6.52718746091062e-05 -5.706655653629978e-07 -0.005909138815214036 -3.770229742898764e-05 6.52718746091062e-05 -3.770229742898764e-05 -0.00494854788307985" dipole="9.761259354277142e-07 3.108939606947179e-05 -8.865347093290196e-07" pbc="T T T"
C       -1.23156000      -0.71104000      -1.67561000       0.00177701      -0.00094700      -0.11397663
C        1.23156000      -2.13312000      -1.67824000      -0.00056852       0.00024880      -0.01315141
C       -1.23156000      -0.71104000      -9.44118000       0.00056850      -0.00024890       0.01315143
C        1.23156000      -2.13312000      -9.44381000      -0.00177701       0.00094707       0.11397661